# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-06-11T10:44:17+02:00
# Query:
# SELECT data.*
# FROM
#  data 
# WHERE
#  (status is null or status != 'retracted') and
#  (year = 2000 AND duplicateof IS NULL AND (status is NULL OR status != 'errors') AND (method is NULL OR method != 'theoretical'))
# ORDER BY file asc
file,a,siga,b,sigb,c,sigc,alpha,sigalpha,beta,sigbeta,gamma,siggamma,vol,sigvol,celltemp,sigcelltemp,diffrtemp,sigdiffrtemp,cellpressure,sigcellpressure,diffrpressure,sigdiffrpressure,thermalhist,pressurehist,compoundsource,nel,sg,sgHall,sgNumber,commonname,chemname,mineral,formula,calcformula,cellformula,Z,Zprime,acce_code,authors,title,journal,year,volume,issue,firstpage,lastpage,doi,method,radiation,wavelength,radType,radSymbol,Rall,Robs,Rref,wRall,wRobs,wRref,RFsqd,RI,gofall,gofobs,gofgt,gofref,duplicateof,optimal,status,flags,svnrevision,date,time,onhold
"1004010","7.898","0.001","5.514","0.001","12.672","0.003","90","","103.69","0.02","90","","536.182","","","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","catena-(1,6-Hexanediammonium (μ~2~-fluoro)-tetrafluoroaluminate)","","- C6 H18 Al F5 N2 -","- C6 H18 Al2 F6 N2 -","- C12 H36 Al4 F12 N4 -","2","1","","S.P.Thanh; J.Renaudin; V.Maisonneuve","","Solid State Sciences","2000","2","","143","","10.1016/S1293-2558(00)00125-4","","","","","","","0.056","","","0.056","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1004016","8.131","0.003","9.258","0.005","18.084","0.007","90","","90","","90","","1361.31","","","","","","","","","","","","","4","P b c a","","61","","Strontium Hydrogenphosphate(V) - Gamma","","- H O4 P Sr -","- H O4 P Sr -","- H16 O64 P16 Sr16 -","16","2","","Ben Taher, L.; Smiri, L.; Laligant, Y.; Maisonneuve, V.","Investigation of th alkaline earth phosphates: synthesis and crystal structure of a new strontium hydrogen phosphate form","Journal of Solid State Chemistry","2000","152","2","428","434","10.1006/jssc.2000.8700","","","","","","0.039","","","","","","","","","","","","","","","has coordinates","186631","2020-10-21","18:00:00",""
"1100177","7.685","0.002","5.006","0.001","18.58","0.005","90","","97.94","0.02","90","","707.941","","","","213","","","","","","","","","5","P 1 21 1","P 2yb","4","","(S,R)-1-Chloro-2-phenylethyl p-tolyl sulfoxide","","- C15 H15 Cl O S -","- C21 H22 Cl O S -","- C42 H44 Cl2 O2 S2 -","2","1","","Hoffmann, Reinhard W.; Nell, Peter G.; Leo, Roland; Harms, Klaus","Highly Enantiomerically Enriched α-Haloalkyl Grignard Reagents","Chemistry - A European Journal","2000","6","18","3359","3365","10.1002/1521-3765(20000915)6:18<3359::AID-CHEM3359>3.0.CO;2-U","","","","","","","7","","","7","","","","","","","","","","","has coordinates","177552","2020-10-21","18:00:00",""
"1100178","7.842","0.001","12.127","0.001","12.973","0.001","65.76","0.01","86.43","0.01","81.31","0.01","1112.04","","","","223","","","","","","","","","4","P -1","-P 1","2","","3-(Diphenylmethyl)pent-2-yl 3,5-dinitrobenzoate","","- C25 H24 N2 O6 -","- C25 H24 N2 O6 -","- C50 H48 N4 O12 -","2","1","","Bromm, Lars O.; Laaziri, Hamid; Lhermitte, Frédéric; Harms, Klaus; Knochel, Paul","Highly Regio- and Stereoselective Thermal Migration of Organoboranes in Acyclic Molecules","Journal of the American Chemical Society","2000","122","41","10218","10219","10.1021/ja001283y","","","","","","","4.44","","","4.44","","","","","","","","","","","has coordinates","176899","2020-10-21","18:00:00",""
"1100179","23.056","0.001","23.056","0.001","7.325","0.001","90","","90","","120","","3372.15","","","","223","","","","","","","","","3","R 3 :H","R 3","146","","3,4-Diphenylhexan-2-ol","","- C18 H22 O -","- C18 H22 O -","- C162 H198 O9 -","9","1","","Bromm, Lars O.; Laaziri, Hamid; Lhermitte, Frédéric; Harms, Klaus; Knochel, Paul","Highly Regio- and Stereoselective Thermal Migration of Organoboranes in Acyclic Molecules","Journal of the American Chemical Society","2000","122","41","10218","10219","10.1021/ja001283y","","","","","","","3.05","","","3.05","","","","","","","","","","","has coordinates","176899","2020-10-21","18:00:00",""
"1100180","22.864","0.001","22.864","0.001","7.229","0.001","90","","90","","120","","3272.75","","","","223","","","","","","","","","3","R 3 :H","R 3","146","","3,4-Diphenylpentan-2-ol","","- C17 H20 O -","- C17 H20 O -","- C153 H180 O9 -","9","1","","Bromm, Lars O.; Laaziri, Hamid; Lhermitte, Frédéric; Harms, Klaus; Knochel, Paul","Highly Regio- and Stereoselective Thermal Migration of Organoboranes in Acyclic Molecules","Journal of the American Chemical Society","2000","122","41","10218","10219","10.1021/ja001283y","","","","","","","4.89","","","4.89","","","","","","","","","","","has coordinates","176899","2020-10-21","18:00:00",""
"1100182","7.8902","0.0002","5.8375","0.0003","20.5524","0.0007","90","","94.175","0.004","90","","944.112","","","","213","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","threo-4-(Chloro(phenyl)methyl)-1,3-oxazolidin-2-one","","- C10 H10 Cl N O2 -","- C10 H10 Cl N O2 -","- C40 H40 Cl4 N4 O8 -","4","1","","Bach, Thorsten; Schlummer, Björn; Harms, Klaus","Iron(II)-catalyzed intramolecular aminochlorination of alkenes","Chemical Communications (Cambridge, United Kingdom)","2000","","4","287","288","10.1039/a909009f","","","","","","","4.59","","","4.59","","","","","","","","","","","has coordinates","177462","2020-10-21","18:00:00",""
"1100183","8.52","0.001","12.123","0.001","24.105","0.001","90","","90","","90","","2489.76","","","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Menthan-7-yl 2,4,7-trimethyl-2,4-trimethylene-5-pentane lactam-7-carboxylate d ichloromethane solvate","","- C23 H39 Cl2 N O3 -","- C23 H39 Cl2 N O3 -","- C92 H156 Cl8 N4 O12 -","4","1","","T.Bach; H.Bergmann; K.Harms","","Angew.Chem.,Int.Ed.Engl.","2000","39","","2302","","10.1002/1521-3773(20000703)39:13<2302::AID-ANIE2302>3.0.CO;2-6","","","","","","","6.08","","","6.08","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1100184","8.4889","0.0008","10.5945","0.0008","12.2789","0.0007","90","","93.793","0.006","90","","1101.89","","","","188","","","","","","","","","5","P 1 21 1","P 2yb","4","","Di-iodo-tris(dimethoxyethane)-europium","","- C12 H30 Eu I2 O6 -","- C12 H30 Eu I2 O6 -","- C24 H60 Eu2 I4 O12 -","2","1","","T.Grob; G.Seybert; W.Massa; K.Harms; K.Dehnicke","","Z.Anorg.Allg.Chem.","2000","626","","1361","","10.1002/(SICI)1521-3749(200006)626:6<1361::AID-ZAAC1361>3.0.CO;2-X","","","","","","","2.46","","","2.46","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1100185","14.055","0.0014","16.522","0.0015","22.037","0.002","89.404","0.011","72.958","0.011","78.657","0.011","4791","","","","193","","","","","","","","","7","P -1","-P 1","2","","bis(μ~2~-Triphenylphosphoraneiminato)-iodo-tris(triphenylphosphoraneiminato)- dimethoxyethane-di-europium dimethoxyethane solvate","","- C102 H105 Eu2 I N5 O6 P5 -","- C102 H105 Eu2 I N5 O6 P5 -","- C204 H210 Eu4 I2 N10 O12 P10 -","2","1","","T.Grob; G.Seybert; W.Massa; K.Harms; K.Dehnicke","","Z.Anorg.Allg.Chem.","2000","626","","1361","","10.1002/(SICI)1521-3749(200006)626:6<1361::AID-ZAAC1361>3.0.CO;2-X","","","","","","","3.91","","","3.91","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1100186","17.3969","0.0018","17.701","0.002","21.538","0.003","74.929","0.015","84.223","0.014","64.612","0.012","5785.4","","","","103","","","","","","","","","7","P -1","-P 1","2","","(μ~2~-Iodo)-bis((μ~2~-triphenylphosphoraneiminato)-triphenylphosphoraneimina to-bis(tetrahydrofuran)-yttrium) tri-iodide tetrahydrofuran solvate","","- C114 H144 I4 N4 O10.5 P4 Y2 -","- C116 H152 I11 N4 O12 P4 Y2 -","- C232 H304 I22 N8 O24 P8 Y4 -","2","1","","T.Grob; G.Seybert; W.Massa; K.Harms; K.Dehnicke","","Z.Anorg.Allg.Chem.","2000","626","","1361","","10.1002/(SICI)1521-3749(200006)626:6<1361::AID-ZAAC1361>3.0.CO;2-X","","","","","","","6.38","","","6.38","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1100193","6.3611","0.0016","16.313","0.004","8.646","0.0015","90","","96.089","0.018","90","","892.122","","","","213","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","4,4'-Di-t-butylazobenzene","","- C20 H26 N2 -","- C52 H88 N4 -","- C104 H176 N8 -","2","0.5","","K.Harms; M.Marsch","","Private Communication","2000","","","","","","","","","","","","6.55","","","6.55","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1100194","8.3847","0.0002","6.8914","0.0004","14.8257","0.0004","90","","98.28","0.003","90","","847.734","","","","223","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","2-(Adamantyl)-7-nitrofluorene","","- C23 H23 N O2 -","- C29 H37 N O2 -","- C58 H74 N2 O4 -","2","0.5","","K.Harms; M.Marsch","","Private Communication","2000","","","","","","","","","","","","5.82","","","5.82","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1100195","20.449","0.002","12.7631","0.0012","16.5388","0.0015","90","","90","","90","","4316.5","","","","208","","","","","","","","","6","P c a 21","P 2c -2ac","29","","bis(tris(1,2-Dimethoxyethane-O,O')-lithium) bis(μ~2~-chloro)-(μ~2~-oxo)-dich loro-tetraoxo-di-molybdenum","","- C24 H60 Cl4 Li2 Mo2 O17 -","- C24 H60 Cl4 Li2 Mo2 O17 -","- C96 H240 Cl16 Li8 Mo8 O68 -","4","1","","K.Harms; M.Marsch","","Private Communication","2000","","","","","","","","","","","","6.76","","","6.76","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1100196","30.5918","0.0013","30.5918","0.0013","7.7464","0.001","90","","90","","120","","6278.28","","","","","","","","","","","","","3","R -3 :H","-R 3","148","","1-(2-Hydroxyprop-2-yl)pyrene","","- C19 H16 O -","- C19 H16 O -","- C342 H288 O18 -","18","1","","K.Harms; M.Marsch","","Private Communication","2000","","","","","","","","","","","","5.07","","","5.07","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1100197","7.163","0.002","17.466","0.006","10.565","0.003","90","","93.9","0.03","90","","1318.71","","","","197","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bromo(trimethyl)stibinimino-trimethylstibine","","- C6 H18 Br N Sb2 -","- C6 H18 Br N Sb2 -","- C24 H72 Br4 N4 Sb8 -","4","1","","U.Muller; K.Dehnicke; R.Hillwig; K.Harms; J.Pebler; A.Pilz","","Private Communication","2000","","","","","","","","","","","","6.46","","","6.46","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1100198","7.7726","0.0006","17.7023","0.0012","15.1696","0.0014","90","","93.518","0.01","90","","2083.3","","","","173","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","tris(1,2-Dimethoxyethane)-lithium dimethyl-copper(i)","","- C14 H36 Cu Li O6 -","- C14 H36 Cu Li O6 -","- C56 H144 Cu4 Li4 O24 -","4","1","","John, Michael; Auel, Carsten; Behrens, Christoph; Marsch, Michael; Harms, Klaus; Bosold, Ferdinand; Gschwind, Ruth M.; Rajamohanan, Pattuparambil R.; Boche, Gernot","The Relation between Ion Pair Structures and Reactivities of Lithium Cuprates","Chemistry - A European Journal","2000","6","16","3060","3068","10.1002/1521-3765(20000818)6:16<3060::AID-CHEM3060>3.0.CO;2-M","","","","","","","4.05","","","4.05","","","","","","","","","","","has coordinates","187723","2020-10-21","18:00:00",""
"1100199","10.2161","0.001","19.2676","0.001","15.792","0.002","90","","90.858","0.007","90","","3108.14","","","","193","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","tris(1,2-Dimethoxyethane)-lithium bis(trimethylsilylmethyl)-copper(i)","","- C20 H52 Cu Li O6 Si2 -","- C20 H52 Cu Li O6 Si2 -","- C80 H208 Cu4 Li4 O24 Si8 -","4","1","","John, Michael; Auel, Carsten; Behrens, Christoph; Marsch, Michael; Harms, Klaus; Bosold, Ferdinand; Gschwind, Ruth M.; Rajamohanan, Pattuparambil R.; Boche, Gernot","The Relation between Ion Pair Structures and Reactivities of Lithium Cuprates","Chemistry - A European Journal","2000","6","16","3060","3068","10.1002/1521-3765(20000818)6:16<3060::AID-CHEM3060>3.0.CO;2-M","","","","","","","6.65","","","6.65","","","","","","","","","","","has coordinates","187723","2020-10-21","18:00:00",""
"1100200","10.8446","0.0007","10.9136","0.0009","18.9558","0.0012","87.682","0.009","81.637","0.008","82.658","0.009","2200.89","","","","193","","","","","","","","","6","P -1","-P 1","2","","tetrakis(μ~2~-trimethylsilylmethylene)-tris(diethyl ether)-di-copper-di-lithium","","- C28 H74 Cu2 Li2 O3 Si4 -","- C28 H74 Cu2 Li2 O3 Si4 -","- C56 H148 Cu4 Li4 O6 Si8 -","2","1","","John, Michael; Auel, Carsten; Behrens, Christoph; Marsch, Michael; Harms, Klaus; Bosold, Ferdinand; Gschwind, Ruth M.; Rajamohanan, Pattuparambil R.; Boche, Gernot","The Relation between Ion Pair Structures and Reactivities of Lithium Cuprates","Chemistry - A European Journal","2000","6","16","3060","3068","10.1002/1521-3765(20000818)6:16<3060::aid-chem3060>3.0.co;2-m","","","","","","","5.68","","","5.68","","","","","","","","","","","has coordinates","177557","2020-10-21","18:00:00",""
"1100201","9.018","0.0006","9.6771","0.0008","9.974","0.0007","71.564","0.005","62.985","0.005","62.938","0.005","683.92","","","","213","","","","","","","","","5","P 1","P 1","1","","(R,R)-p-Chlorophenyl-1-chloro-2-phenylethyl sulfoxide","","- C14 H12 Cl2 O S -","- C14 H12 Cl2 O S -","- C28 H24 Cl4 O2 S2 -","2","2","","Hoffmann, Reinhard W.; Nell, Peter G.; Leo, Roland; Harms, Klaus","Highly Enantiomerically Enriched α-Haloalkyl Grignard Reagents","Chemistry - A European Journal","2000","6","18","3359","3365","10.1002/1521-3765(20000915)6:18<3359::AID-CHEM3359>3.0.CO;2-U","","","","","","","4.37","","","4.37","","","","","","","","","","","has coordinates","177552","2020-10-21","18:00:00",""
"1100202","9.1121","0.0008","9.7596","0.0007","9.9764","0.0011","84.681","0.008","62.893","0.006","63.397","0.006","699.198","","","","213","","","","","","","","","6","P 1","P 1","1","","(-)-(R,R)-p-Chlorophenyl-1-bromo-2-phenylethyl sulfoxide","","- C14 H12 Br Cl O S -","- C14 H12 Br Cl O S -","- C28 H24 Br2 Cl2 O2 S2 -","2","2","","Hoffmann, Reinhard W.; Nell, Peter G.; Leo, Roland; Harms, Klaus","Highly Enantiomerically Enriched α-Haloalkyl Grignard Reagents","Chemistry - A European Journal","2000","6","18","3359","3365","10.1002/1521-3765(20000915)6:18<3359::AID-CHEM3359>3.0.CO;2-U","","","","","","","5.23","","","5.23","","","","","","","","","","","has coordinates","177552","2020-10-21","18:00:00",""
"1100203","6.866","0.001","9.388","0.001","11.243","0.001","90","","103.31","0.01","90","","705.235","","","","202.15","","","","","","","","","5","P 21/n","","14","","Aminotrimethylphosphonium chloride","","- C3 H11 Cl N P -","","","4","","","Chitsaz, S.; Folkerts, H.; Grebe, J.; Gröb, T.; Harms, K.; Hiller, W.; Krieger, M.; Massa, W.; Merle, J.; Möhlen, M.; Neumüller, B.; Dehnicke, K.","Die Kristallstrukturen einer Serie von Verbindungen mit Kationen des Typs [R~3~PNH~2~]^+^, [R3PN(H)SiMe~3~]^+^ und [R3PN(SiMe~3~)~2~]^+^","Zeitschrift für Anorganische und Allgemeine Chemie","2000","626","3","775","783","10.1002/(sici)1521-3749(200003)626:3<775::aid-zaac775>3.0.co;2-h","","","","","","","2.39","","","2.39","","","","","","","","","","","","278158","2022-09-26","15:28:11",""
"1100204","12.736","0.004","11.488","0.003","13.02","0.003","90","","90","","90","","1904.97","","","","223","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Aminotriethylphosphonium chloride","","- C6 H17 Cl N P -","- C6 H17 Cl N P -","- C48 H136 Cl8 N8 P8 -","8","1","","Chitsaz, S.; Folkerts, H.; Grebe, J.; Gröb, T.; Harms, K.; Hiller, W.; Krieger, M.; Massa, W.; Merle, J.; Möhlen, M.; Neumüller, B.; Dehnicke, K.","Die Kristallstrukturen einer Serie von Verbindungen mit Kationen des Typs [R~3~PNH~2~]^+^, [R3PN(H)SiMe~3~]^+^ und [R3PN(SiMe~3~)~2~]^+^","Zeitschrift für Anorganische und Allgemeine Chemie","2000","626","3","775","783","10.1002/(sici)1521-3749(200003)626:3<775::aid-zaac775>3.0.co;2-h","","","","","","","4.19","","","4.19","","","","","","","","","","","has coordinates","177560","2020-10-21","18:00:00",""
"1100205","17.7708","0.0011","11.7355","0.0004","16.1137","0.001","90","","115.389","0.006","90","","3035.94","","","","190.15","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","Trimethylsilylaminotrimethylphosphonium trifluoromethanesulfonate","","- C7 H19 F3 N O3 P S Si -","- C7 H19 F3 N O3 P S Si -","- C56 H152 F24 N8 O24 P8 S8 Si8 -","8","2","","Chitsaz, S.; Folkerts, H.; Grebe, J.; Gröb, T.; Harms, K.; Hiller, W.; Krieger, M.; Massa, W.; Merle, J.; Möhlen, M.; Neumüller, B.; Dehnicke, K.","Die Kristallstrukturen einer Serie von Verbindungen mit Kationen des Typs [R~3~PNH~2~]^+^, [R3PN(H)SiMe~3~]^+^ und [R3PN(SiMe~3~)~2~]^+^","Zeitschrift für Anorganische und Allgemeine Chemie","2000","626","3","775","783","10.1002/(sici)1521-3749(200003)626:3<775::aid-zaac775>3.0.co;2-h","","","","","","","3.32","","","3.32","","","","","","","","","","","has coordinates","177560","2020-10-21","18:00:00",""
"1100206","8.093","0.001","17.036","0.001","18.001","0.002","90","","96.34","0.01","90","","2466.66","","","","223","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","bis(Aminotriethylphosphonium) decahydro-closo-decaborate","","- C12 H44 B10 N2 P2 -","- C12 H44 B10 N2 P2 -","- C48 H176 B40 N8 P8 -","4","1","","Chitsaz, S.; Folkerts, H.; Grebe, J.; Gröb, T.; Harms, K.; Hiller, W.; Krieger, M.; Massa, W.; Merle, J.; Möhlen, M.; Neumüller, B.; Dehnicke, K.","Die Kristallstrukturen einer Serie von Verbindungen mit Kationen des Typs [R~3~PNH~2~]^+^, [R3PN(H)SiMe~3~]^+^ und [R3PN(SiMe~3~)~2~]^+^","Zeitschrift für Anorganische und Allgemeine Chemie","2000","626","3","775","783","10.1002/(sici)1521-3749(200003)626:3<775::aid-zaac775>3.0.co;2-h","","","","","","","5.33","","","5.33","","","","","","","","","","","has coordinates","177560","2020-10-21","18:00:00",""
"1100207","8.253","0.003","10.864","0.003","12.412","0.004","114.12","0.02","104.5","0.02","93.21","0.02","967.441","","","","213","","","","","","","","","6","P -1","-P 1","2","","Aminotriphenylphosphonium dichloroiodide","","- C18 H17 Cl2 I N P -","- C18 H17 Cl2 I N P -","- C36 H34 Cl4 I2 N2 P2 -","2","1","","Chitsaz, S.; Folkerts, H.; Grebe, J.; Gröb, T.; Harms, K.; Hiller, W.; Krieger, M.; Massa, W.; Merle, J.; Möhlen, M.; Neumüller, B.; Dehnicke, K.","Die Kristallstrukturen einer Serie von Verbindungen mit Kationen des Typs [R~3~PNH~2~]^+^, [R3PN(H)SiMe~3~]^+^ und [R3PN(SiMe~3~)~2~]^+^","Zeitschrift für Anorganische und Allgemeine Chemie","2000","626","3","775","783","10.1002/(sici)1521-3749(200003)626:3<775::aid-zaac775>3.0.co;2-h","","","","","","","6.44","","","6.44","","","","","","","","","","","has coordinates","177560","2020-10-21","18:00:00",""
"1100208","7.121","0.001","12.333","0.002","12.571","0.002","90","","90","","90","","1104.03","","","","223","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Aminotriethylphosphonium iodide","","- C6 H17 I N P -","- C6 H17 I N P -","- C24 H68 I4 N4 P4 -","4","1","","Chitsaz, S.; Folkerts, H.; Grebe, J.; Gröb, T.; Harms, K.; Hiller, W.; Krieger, M.; Massa, W.; Merle, J.; Möhlen, M.; Neumüller, B.; Dehnicke, K.","Die Kristallstrukturen einer Serie von Verbindungen mit Kationen des Typs [R~3~PNH~2~]^+^, [R3PN(H)SiMe~3~]^+^ und [R3PN(SiMe~3~)~2~]^+^","Zeitschrift für Anorganische und Allgemeine Chemie","2000","626","3","775","783","10.1002/(sici)1521-3749(200003)626:3<775::aid-zaac775>3.0.co;2-h","","","","","","","5.76","","","5.76","","","","","","","","","","","has coordinates","177560","2020-10-21","18:00:00",""
"1100209","13.602","0.001","8.742","0.001","14.621","0.001","90","","115.19","0.01","90","","1573.23","","","","203","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Trimethylsilylaminotriethylphosphonium iodide","","- C9 H25 I N P Si -","- C9 H25 I N P Si -","- C36 H100 I4 N4 P4 Si4 -","4","1","","Chitsaz, S.; Folkerts, H.; Grebe, J.; Gröb, T.; Harms, K.; Hiller, W.; Krieger, M.; Massa, W.; Merle, J.; Möhlen, M.; Neumüller, B.; Dehnicke, K.","Die Kristallstrukturen einer Serie von Verbindungen mit Kationen des Typs [R~3~PNH~2~]^+^, [R3PN(H)SiMe~3~]^+^ und [R3PN(SiMe~3~)~2~]^+^","Zeitschrift für Anorganische und Allgemeine Chemie","2000","626","3","775","783","10.1002/(sici)1521-3749(200003)626:3<775::aid-zaac775>3.0.co;2-h","","","","","","","6.6","","","6.6","","","","","","","","","","","has coordinates","177560","2020-10-21","18:00:00",""
"1100210","19.254","0.009","12.6907","0.0009","15.073","0.004","90","","111.79","0.03","90","","3419.89","","","","213","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","bis(Trimethylsilyl)aminotrimethylphosphonium iodide","","- C9 H27 I N P Si2 -","- C9 H27 I N P Si2 -","- C72 H216 I8 N8 P8 Si16 -","8","2","","Chitsaz, S.; Folkerts, H.; Grebe, J.; Gröb, T.; Harms, K.; Hiller, W.; Krieger, M.; Massa, W.; Merle, J.; Möhlen, M.; Neumüller, B.; Dehnicke, K.","Die Kristallstrukturen einer Serie von Verbindungen mit Kationen des Typs [R~3~PNH~2~]^+^, [R3PN(H)SiMe~3~]^+^ und [R3PN(SiMe~3~)~2~]^+^","Zeitschrift für Anorganische und Allgemeine Chemie","2000","626","3","775","783","10.1002/(sici)1521-3749(200003)626:3<775::aid-zaac775>3.0.co;2-h","","","","","","","5.81","","","5.81","","","","","","","","","","","has coordinates","177560","2020-10-21","18:00:00",""
"1100211","25.54","0.002","13.223","0.001","11.653","0.002","90","","90","","90","","3935.4","","","","223","","","","","","","","","6","P b c n","-P 2n 2ab","60","","bis(Trimethylsilyl)aminotriethylphosphonium iodide","","- C12 H33 I N P Si2 -","- C15 H42 I N P Si2 -","- C120 H336 I8 N8 P8 Si16 -","8","1","","Chitsaz, S.; Folkerts, H.; Grebe, J.; Gröb, T.; Harms, K.; Hiller, W.; Krieger, M.; Massa, W.; Merle, J.; Möhlen, M.; Neumüller, B.; Dehnicke, K.","Die Kristallstrukturen einer Serie von Verbindungen mit Kationen des Typs [R~3~PNH~2~]^+^, [R3PN(H)SiMe~3~]^+^ und [R3PN(SiMe~3~)~2~]^+^","Zeitschrift für Anorganische und Allgemeine Chemie","2000","626","3","775","783","10.1002/(sici)1521-3749(200003)626:3<775::aid-zaac775>3.0.co;2-h","","","","","","","3.7","","","3.7","","","","","","","","","","","has coordinates","177560","2020-10-21","18:00:00",""
"1100212","9.477","0.001","10.476","0.001","16.016","0.004","90","","105.96","0.01","90","","1528.79","","","","223","","","","","","","","","6","P 1 21 1","P 2yb","4","","bis(Trimethylsilyl)aminotriphenylphosphonium triiodide","","- C24 H33 I3 N P Si2 -","- C24 H33 I3 N P Si2 -","- C48 H66 I6 N2 P2 Si4 -","2","1","","Chitsaz, S.; Folkerts, H.; Grebe, J.; Gröb, T.; Harms, K.; Hiller, W.; Krieger, M.; Massa, W.; Merle, J.; Möhlen, M.; Neumüller, B.; Dehnicke, K.","Die Kristallstrukturen einer Serie von Verbindungen mit Kationen des Typs [R~3~PNH~2~]^+^, [R3PN(H)SiMe~3~]^+^ und [R3PN(SiMe~3~)~2~]^+^","Zeitschrift für Anorganische und Allgemeine Chemie","2000","626","3","775","783","10.1002/(sici)1521-3749(200003)626:3<775::aid-zaac775>3.0.co;2-h","","","","","","","3.34","","","3.34","","","","","","","","","","","has coordinates","177560","2020-10-21","18:00:00",""
"1100214","6.434","0.001","7.4927","0.0013","24.108","0.004","96.28","0.02","90.192","0.019","98.24","0.019","1143.08","","","","193","","","","","","","","","4","P -1","-P 1","2","","(3RS,4SR,6SR,7SR)-1-Aza-9-oxa-4-phenyltricyclo(5.3.0.0^3,6^)decan-10-one","","- C14 H15 N O2 -","- C16 H19 N1.5 O2 -","- C64 H76 N6 O8 -","4","2","","Bach, Thorsten; Krüger, Christa; Harms, Klaus","The Stereoselective Synthesis of 2-Substituted 3-Azabicyclo[3.2.0]heptanes by Intramolecular [2+2]-Photocycloaddition Reactions","Synthesis","2000","2000","2","305","320","10.1055/s-2000-6261","","","","","","","4.52","","","4.52","","","","","","","","","","","has coordinates","176882","2020-10-21","18:00:00",""
"1100239","15.2552","0.0016","19.0288","0.0019","21.783","0.002","95.435","0.012","91.145","0.012","90.448","0.012","6293.36","","","","193","","","","","","","","","5","P -1","-P 1","2","","hexakis((μ~4~-Triphenylphosphoraneiminato)-rubidium)","","- C139.5 H126 N6 P6 Rb6 -","- C251 H226 N12 P12 Rb12 -","- C502 H452 N24 P24 Rb24 -","2","1","","T.Grob; K.Harms; K.Dehnicke","","Z.Anorg.Allg.Chem.","2000","626","","1065","","10.1002/(SICI)1521-3749(200005)626:5<1065::AID-ZAAC1065>3.0.CO;2-T","","","","","","","5.29","","","5.29","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1100240","26.7973","0.0014","26.7973","0.0014","26.7973","0.0014","90","","90","","90","","19243","","","","123","","","","","","","","","5","F d -3 :2","-F 2uv 2vw 3","203","","tetrakis(μ~3~-Triphenylphosphoraneiminato)-tetra-cesium toluene hexane solvat e","","- C108.5 H128.5 Cs4 N4 P4 -","- C922 H768 Cs16 N16 P16 -","- C7376 H6144 Cs128 N128 P128 -","8","0.0833333","","T.Grob; K.Harms; K.Dehnicke","","Z.Anorg.Allg.Chem.","2000","626","","1065","","10.1002/(SICI)1521-3749(200005)626:5<1065::AID-ZAAC1065>3.0.CO;2-T","","","","","","","4.05","","","4.05","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1100241","14.1888","0.0008","22.5891","0.001","24.9759","0.0011","90","","91.055","0.006","90","","8003.72","","","","193","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","tetrakis(μ~3~-Triphenylphosphoraneiminato)-tetra-cesium toluene solvate","","- C86 H76 Cs4 N4 P4 -","- C86 H76 Cs4 N4 P4 -","- C344 H304 Cs16 N16 P16 -","4","1","","T.Grob; K.Harms; K.Dehnicke","","Z.Anorg.Allg.Chem.","2000","626","","1065","","10.1002/(SICI)1521-3749(200005)626:5<1065::AID-ZAAC1065>3.0.CO;2-T","","","","","","","2.78","","","2.78","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1100242","9.56","0.005","18.546","0.007","9.671","0.003","90","","119","0.03","90","","1499.68","","","","213","","","","","","","","","4","P 1 21 1","P 2yb","4","","N-Phenyl-2-benzylthiobutanamide","","- C17 H19 N S -","- C17.5 H22 N S -","- C70 H88 N4 S4 -","4","2","","Hoffmann, Reinhard W.; Hölzer, Bettina; Knopff, Oliver; Harms, Klaus","Asymmetric Synthesis of a Chiral Secondary Grignard Reagent","Angewandte Chemie, International Edition","2000","39","17","3072","3074","10.1002/1521-3773(20000901)39:17<3072::AID-ANIE3072>3.0.CO;2-4","","","","","","","5.82","","","5.82","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1100243","13.318","0.0004","6.836","0.0002","17.3181","0.0011","90","","96.045","0.005","90","","1567.91","","","","213","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(2SR,3SR)-N-t-Butoxycarbonyl-2-benzyl-3-pyrrolidinol","","- C16 H23 N O3 -","- C16 H23 N O3 -","- C64 H92 N4 O12 -","4","1","","Bach, Thorsten; Brummerhop, Harm; Harms, Klaus","The Synthesis of (+)-Preussin and Related Pyrrolidinols by Diastereoselective Paternò-Büchi Reactions of Chiral 2-Substituted 2,3-Dihydropyrroles","Chemistry - A European Journal","2000","6","20","3838","3848","10.1002/1521-3765(20001016)6:20<3838::aid-chem3838>3.0.co;2-1","","","","","","","3.97","","","3.97","","","","","","","","","","","has coordinates","177559","2020-10-21","18:00:00",""
"1100244","11.657","0.002","5.3217","0.0011","13.483","0.003","90","","107.81","0.02","90","","796.334","","","","193","","","","","","","","","4","P 1 21 1","P 2yb","4","","(2S,3S,5R)-N-Methyl-2,5-dibenzyl-3-pyrrolidinol","","- C19 H23 N O -","- C19 H23 N O -","- C38 H46 N2 O2 -","2","1","","Bach, Thorsten; Brummerhop, Harm; Harms, Klaus","The Synthesis of (+)-Preussin and Related Pyrrolidinols by Diastereoselective Paternò-Büchi Reactions of Chiral 2-Substituted 2,3-Dihydropyrroles","Chemistry - A European Journal","2000","6","20","3838","3848","10.1002/1521-3765(20001016)6:20<3838::aid-chem3838>3.0.co;2-1","","","","","","","6.44","","","6.44","","","","","","","","","","","has coordinates","177559","2020-10-21","18:00:00",""
"1100245","13.514","0.002","12.213","0.003","12.644","0.001","90","","101.74","0.02","90","","2043.19","","","","213","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-Benzylmethyl-4-(2,2-dimethylpropylidene)-5-(1-cyclopropylethoxy)-oxazolidin-2-one","","- C21 H29 N O3 -","- C26 H38 N O3 -","- C104 H152 N4 O12 -","4","1","","Bach, Thorsten; Schlummer, Björn; Harms, Klaus","Intramolecular Iron(II)-Catalyzed Addition Reactions of Propargyloxycarbonyl Azides","Synlett","2000","2000","9","1330","1332","10.1055/s-2000-7129","","","","","","","7.71","","","7.71","","","","","","","","","","","has coordinates","176887","2020-10-21","18:00:00",""
"1100700","13.657","0.004","8.278","0.003","14.071","0.004","90","","103.063","0.004","90","","1549.7","0.8","173","2","173","2","","","","","","","","7","P 1 2/n 1","-P 2yac","13","","","","- C12 H12 Ag F6 N2 P S -","- C12 H12 Ag F6 N2 P S -","- C48 H48 Ag4 F24 N8 P4 S4 -","4","1","","Caradoc-Davies, Paula L.; Hanton, Lyall R.; Lee, Kitty","Extension of a π-stacked N~2~S ligand to form bi- and tri-nuclear silver(I) complexes","Chemical Communications (Cambridge, United Kingdom)","2000","","9","783","784","10.1039/a910342m","","","0.71073","MoKα","","0.0426","0.0353","","","0.0899","0.094","","","","","","1.06","","","","has coordinates","178221","2020-10-21","18:00:00",""
"1100907","10.7589","0.0009","17.8696","0.0017","22.667","0.0018","90","","90","","90","","4357.9","0.7","294","1","294","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(2S)-3-(4-hydroxyphenyl)-2-(1-oxoisoindolin-2-yl)propanoic acidd","","- C17 H15 N O4 -","- C17 H15 N O4 -","- C204 H180 N12 O48 -","12","3","","Brady, Fiona; Gallagher, John F.","Intermolecular O-H...O hydrogen bonding in the three independent molecules of (2S)-3-(4-hydroxyphenyl)-2-(1-oxoisoindolin-2-yl)propanoic acid","Acta Crystallographica, Section C","2000","56","","1407","1410","10.1107/S010827010001163X","","","0.7107","MoKα","","0.086","0.045","","","","0.116","","","","","","1.02","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1100908","15.922","0.002","5.7331","0.0008","21.341","0.003","90","","91.097","0.011","90","","1947.6","0.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Aqua-bis(trans-2-butenoate)- bis(pyridine)copper(II)","","- C18 H22 Cu N2 O5 -","- C18 H22 Cu N2 O5 -","- C72 H88 Cu4 N8 O20 -","4","0.5","","Baggio, Ricardo; Foxman, Bruce; Garland, Maria Teresa; Perec, Mireille; Shang, Wen","Aquabis(crotonato)bis(pyridine)copper(II)","Acta Crystallographica Section C","2000","56","11","e505","e506","10.1107/S0108270100013937","","","0.71073","MoKα","","0.041","0.031","","","","0.082","","","","","","1.068","","","","has coordinates,has Fobs","176428","2020-10-21","18:00:00",""
"1100910","7.496","0.001","6.308","0.001","10.125","0.002","90","","100.11","0.01","90","","471.32","0.13","293","2","293","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","Bismuth(V)iron(III) oxophosphate","Bismuth(V) iron(III) tris(phosphate) oxide","","- Bi0.4 Fe3 O13 P3 -","- Bi0.4 Fe3 O13 P3 -","- Bi0.8 Fe6 O26 P6 -","2","0.5","","Benabad, Aicha; Bakhous, Karima; Cherkaoui, Fatima; Holt, Elizabeth M.","Bismuth(V) iron(III) tris(phosphate) oxide","Acta Crystallographica, Section C","2000","56","","1292","1293","10.1107/S010827010000977X","","","0.71073","MoKα","","0.099","0.058","","","","0.128","","","","","","0.835","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1100911","6.207","0.003","11.915","0.005","15.583","0.006","90","","90","","90","","1152.5","0.9","293","2","293","2","","","","","","","","6","P n n m","-P 2 2n","58","Sodium nitroprusside, deuterated","disodium pentacyanonitrosylferrate(III) bis(dideuterium oxide)","","- C5 D4 Fe N6 Na2 O3 -","- C5 D4 Fe N6 Na2 O3 -","- C20 D16 Fe4 N24 Na8 O12 -","4","0.5","","Schultz, Arthur J.; Figgis, Brian N.; Sobolev, Alexandre N.","Na~2~Fe(CN)~5~NO.2D~2~O at 11 and 293 K by X-ray and at 15 K by neutron diffraction","Acta Crystallographica, Section C","2000","56","","1289","1291","10.1107/S0108270100008763","","","0.71073","MoKα","","0.02","0.019","","","","0.051","","","","","","1.227","","","","has coordinates","277833","2022-09-14","15:22:10",""
"1100912","6.124","0.002","11.837","0.005","15.547","0.006","90","","90","","90","","1127","0.7","11","1","11","2","","","","","","","","6","P n n m","-P 2 2n","58","Sodium nitroprusside, deuterated","disodium pentacyanonitrosylferrate(III) bis(dideuterium oxide)","","- C5 D4 Fe N6 Na2 O3 -","- C5 D4 Fe N6 Na2 O3 -","- C20 D16 Fe4 N24 Na8 O12 -","4","0.5","","Schultz, Arthur J.; Figgis, Brian N.; Sobolev, Alexandre N.","Na~2~Fe(CN)~5~NO.2D~2~O at 11 and 293 K by X-ray and at 15 K by neutron diffraction","Acta Crystallographica, Section C","2000","56","","1289","1291","10.1107/S0108270100008763","","","0.71073","MoKα","","0.025","0.02","","","","0.054","","","","","","1.081","","","","has coordinates","277833","2022-09-14","15:22:10",""
"1100913","6.124","0.002","11.837","0.005","15.547","0.006","90","","90","","90","","1127","0.7","11","","15","","","","","","","","","7","P n n m","-P 2 2n","58","Sodium nitroprusside, deuterated","disodium pentacyanonitrosylferrate(III) bis(dideuterium oxide)","","- C5 H1.1 D2.9 Fe N6 Na2 O3 -","- C5 H1.102 D2.898 Fe N6 Na2 O3 -","- C20 H4.408 D11.592 Fe4 N24 Na8 O12 -","4","0.5","","Schultz, Arthur J.; Figgis, Brian N.; Sobolev, Alexandre N.","Na~2~Fe(CN)~5~NO.2D~2~O at 11 and 293 K by X-ray and at 15 K by neutron diffraction","Acta Crystallographica, Section C","2000","56","","1289","1291","10.1107/S0108270100008763","","neutron","","pulsedneutron","","","0.058","","","0.051","","","","3.75","","","","","","","has coordinates","277831","2022-09-14","14:31:32",""
"1100916","5.5462","0.0003","5.6028","0.0004","15.6365","0.0013","90","","90","","90","","485.9","0.06","292","1","","","","","","","","","","3","P b c m","-P 2c 2b","57","","silver niobate","","- Ag Nb O3 -","- Ag Nb O3 -","- Ag8 Nb8 O24 -","8","1","","Fabry, Jan; Zikmund, Zdenek; Kania, Antoni; Petricek, Vaclav","Structural study of AgNbO~3~ at room temperature","Acta Crystallographica, Section C","2000","56","","916","918","10.1107/S0108270100006806","","","0.71073","MoKα","","","0.034","","","","0.053","","","2.69","","","2.84","","","","has coordinates","134621","2020-10-21","18:00:00",""
"1101090","28.836","0.003","3.6902","0.0002","12.116","0.001","90","","109.763","0.003","90","","1213.3","0.5","253","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C5 H5 N4 O1.5 -","- C5 H5 N4 O1.25 -","- C40 H40 N32 O10 -","8","1","","Mohammad Abul Haj; Juan M. Salas; Miguel Quirós; José Molina; René Faure","5-Oxo and 7-oxo derivatives of [1,2,4]triazolo-[1,5-a]pyrimidine: characterization and theoretical study","Journal of Molecular Structure","2000","519","","165","172","10.1016/S0022-2860(99)00303-8","","","","","","","0.036","","","0.037","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1101100","12.925","0.003","6.367","0.001","16.628","0.003","90","","98.07","0.02","90","","1354.8","0.5","293","2","293","2","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C15 H24 O2 -","- C15 H24 O2 -","- C60 H96 O8 -","4","1","","Alejandro F. Barrero; María M. Herrador; Ramón J. Álvarez-Manzaneda; Miguel Quirós; Armando Lara; José Quílez del Moral","Longipinene derivatives from Santolina Viscosa","Journal of Natural Products","2000","63","","587","591","10.1021/np9904206","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1101108","23.522","0.003","13.6089","0.001","22.327","0.002","90","","112.478","0.006","90","","6604","1","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C70 H54 Cl2 Cu2 N12 O14 -","- C70 H54 Cl2 Cu2 N12 O14 -","- C280 H216 Cl8 Cu8 N48 O56 -","4","0.5","","José M. Seco; Miguel Quirós; María J. González Garmendia","Synthesis, X-ray crystal structure and spectroscopic, magnetic and EPR studies of copper(II) dimers with methoxy-di-(2-pyridyl)methoxide as bridging ligand","Polyhedron","2000","19","","1005","1013","10.1016/S0277-5387(00)00356-9","","","","","","","0.0496","","","0.1402","","","","","","","","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1101109","25.197","0.002","14.495","0.002","29.659","0.003","90","","115.55","0.01","90","","9773.1","1.8","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C44 H39 Cu2 F12 N8 O4.5 P2 -","- C44 H39 Cu2 F12 N8 O4.5 P2 -","- C352 H312 Cu16 F96 N64 O36 P16 -","8","2","","José M. Seco; Miguel Quirós; María J. González Garmendia","Synthesis, X-ray crystal structure and spectroscopic, magnetic and EPR studies of copper(II) dimers with methoxy-di-(2-pyridyl)methoxide as bridging ligand","Polyhedron","2000","19","","1005","1013","10.1016/S0277-5387(00)00356-9","","","","","","","0.1003","","","0.218","","","","","","","","","","","has coordinates,has disorder","198667","2020-10-21","18:00:00",""
"1101110","54.836","0.008","15.923","0.001","12.299","0.001","90","","94.382","0.009","90","","10707.5","1.9","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C36 H24 Cu F12 N6 P2 -","- C36 H24 Cu F12 N6 P2 -","- C432 H288 Cu12 F144 N72 P24 -","12","1.5","","José M. Seco; Miguel Quirós; María J. González Garmendia","Synthesis, X-ray crystal structure and spectroscopic, magnetic and EPR studies of copper(II) dimers with methoxy-di-(2-pyridyl)methoxide as bridging ligand","Polyhedron","2000","19","","1005","1013","10.1016/S0277-5387(00)00356-9","","","","","","","0.0883","","","0.2557","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1101144","29.7553","0.0015","18.0498","0.0009","12.2258","0.0006","90","","111.143","0.001","90","","6124.2","0.5","183","2","183","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- H64 Mo12 Ni4 O66 -","- Mo12 Ni4 O66 -","- Mo48 Ni16 O264 -","4","0.5","","Achim Müller; Christian Beugholt; Paul Kögerler; Hartmut Bögge; Sergey Bud'ko; Marshall Luban","[MoV12O30(μ2-OH)10H2{NiII(H2O)3}4], a Highly Symmetrical ε-Keggin Unit Capped with Four NiII Centers: Synthesis and Magnetism","Inorganic Chemistry","2000","39","","5176","5177","10.1021/ic0005285","","","","","","","","","","","","","","","","","","","","","has coordinates","201170","2020-10-21","18:00:00",""
"1501515","3.95251","0.000025","3.95251","0.000025","4.1484","0.00006","90","","90","","90","","64.8077","0.0011","","","","","","","","","","","","4","P 4 m m","P 4 -2","99","","","","- Mg0.8 O3 Pb Ti0.2 -","- O3 Pb Ti0.8 Zr0.2 -","- O3 Pb Ti0.8 Zr0.2 -","1","0.125","","Frantti, J.; Lappalainen, J.; Eriksson, S.; Lantto, V.; Nishio, S.; Kakihana, M.; Ivanov, S.; Rundlof, H.","Neutron diffraction studies of Pb (Zrx Ti1-x) O3 ceramics","Japanese Journal of Applied Physics, Part 1","2000","39","","5697","5703","10.1143/JJAP.39.5697","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1501615","10.633","0.003","12.528","0.003","14.729","0.003","90","0.02","91.62","0.04","90","0.03","1961.3","0.8","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C21 H13 Cu F3 O6 -","- C21 H13 Cu F3 O6 -","- C84 H52 Cu4 F12 O24 -","4","1","","Fedor Valach; Miroslav Tokarčík; Thierry Maris; David J. Watkin; Keith Prout","Bond-valence approach to the copper-copper and copper-oxygen bonding in binuclear copper(II) complexes: Structure of tetrakis(2-fluorobenzoato-O,O')-bis (2-fluorobenzoate-O) dicopper(II)","Zeitschrift für Kristallographie - Crystalline Materials","2000","215","1","56","60","10.1524/zkri.2000.215.1.56","","","1.5418","CuKα","","","0.0448","","","0.0539","","","","","1.0574","1.0574","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1507546","11.335","0.009","5.24","0.008","13.442","0.01","90","","104.1","0.05","90","","774.3","1.5","153","2","153","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C17 H21 N O4 -","- C17 H21 N O4 -","- C34 H42 N2 O8 -","2","1","","McAuley, Barry J.; Nieuwenhuyzen, Mark; Sheldrake, Gary N.","An Unusual Samarium Diiodide Mediated Reductive Ring Contraction of a Tricyclic Oxazine to a Highly-Functionalized Cyclopentane and Cyclobutane","Organic Letters","2000","2","10","1457","","10.1021/ol000057q","","","0.71073","MoKα","","0.1279","0.0608","","","0.1195","0.1466","","","","","","1.002","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1507547","18.672","0.0013","9.6069","0.0007","6.5761","0.0005","90","","97.519","0.001","90","","1169.48","0.15","163","2","163","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C5 H7 N O3 -","- C5 H7 N O3 -","- C40 H56 N8 O24 -","8","2","","Cheng, Jianjun; Ziller, Joseph W.; Deming, Timothy J.","Synthesis of Optically Active β-Amino AcidN-Carboxyanhydrides","Organic Letters","2000","2","13","1943","","10.1021/ol000122w","","","0.71073","MoKα","","0.0343","0.0328","","","0.088","0.0891","","","","","","1.064","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1507548","7.295","0.002","10.9","0.002","11.366","0.002","76.21","0.02","88.53","0.02","76.68","0.02","853.7","0.3","223","2","223","2","","","","","","","","4","P -1","-P 1","2","","","","- C17 H27 N O3 -","- C17.005 H27 N O3 -","- C34.01 H54 N2 O6 -","2","1","","Deiters, Alexander; Mück-Lichtenfeld, Christian; Fröhlich, Roland; Hoppe, Dieter","Asymmetric Synthesis of a (2Z,7E)-Cyclononadiene by an Intramolecular Cycloalkylation and Insight to Its Conformational Properties","Organic Letters","2000","2","16","2415","","10.1021/ol005998h","","","1.54178","CuKα","","0.1578","0.0631","","","0.1615","0.2058","","","","","","1.003","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1507549","12.044","0.002","25.471","0.002","14.6318","0.0015","90","","113.524","0.009","90","","4115.6","0.9","183","2","183","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C80 H100 F12 N4 O20 P2 -","- C80 H100 F12 N4 O20 P2 -","- C160 H200 F24 N8 O40 P4 -","2","1","","Chang, Theresa; Heiss, Aaron M.; Cantrill, Stuart J.; Fyfe, Matthew C. T.; Pease, Anthony R.; Rowan, Stuart J.; Stoddart, J. Fraser; Williams, David J.","Toward Interlocked Molecules beyond Catenanes and Rotaxanes","Organic Letters","2000","2","19","2943","","10.1021/ol006187g","","","1.54178","CuKα","","0.0678","0.0615","","0.1729","0.1639","","","","1.041","1.053","1.053","","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1507550","27.3","0.006","9.301","0.0019","17.584","0.004","90","","129.37","0.03","90","","3452","2","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Diver-5B","","","- C19 H20 N2 O S2 -","- C19 H20 N2 O S2 -","- C152 H160 N16 O8 S16 -","8","1","","Ellis, Keisha K.; Wilke, Burkhardt; Zhang, Yuegang; Diver, Steven T.","A New Method for the Synthesis of Imidazolidinone- and Benzimidazolone-Containing [2.2]Cyclophanes","Organic Letters","2000","2","24","3785","","10.1021/ol0064866","","","0.71073","MoKα","","0.0419","0.0396","","","0.106","0.1085","","","","","","1.051","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1507551","7.5911","0.0007","13.9115","0.0011","14.3428","0.001","90","","90","","90","","1514.7","0.2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","DIVER-7B","","","- C19 H20 N2 O -","- C19 H20 N2 O -","- C76 H80 N8 O4 -","4","1","","Ellis, Keisha K.; Wilke, Burkhardt; Zhang, Yuegang; Diver, Steven T.","A New Method for the Synthesis of Imidazolidinone- and Benzimidazolone-Containing [2.2]Cyclophanes","Organic Letters","2000","2","24","3785","","10.1021/ol0064866","","","0.71073","MoKα","","0.0471","0.0358","","","0.0705","0.0748","","","","","","0.954","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1507552","24.808","0.002","5.9534","0.0005","13.2719","0.0008","90","","96.887","0.006","90","","1946","0.3","213","2","213","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C10 H14 O3 -","- C10 H14 O3 -","- C80 H112 O24 -","8","1","","Paczkowski, Ralph; Maichle-Mössmer, Cäcilia; Maier, Martin E.","A Formal Total Synthesis of Dysidiolide","Organic Letters","2000","2","25","3967","","10.1021/ol006742e","","","1.54184","CuKα","","0.0847","0.0599","","","0.1519","0.1718","","","","","","1.045","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1507553","16.744","","4.719","","19.995","","90","","102.7","","90","","1541.25","","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Methyl 3-(2-methyl-acroylamido)-2-phenylacetylamino-acrylate Methyl 3-(2-methyl-acroylamido)-2-phenylacetylamino-acrylate","","- C15 H15 N2 O4 -","- C16 N2 O4 -","- C64 N8 O16 -","4","1","","Gunda, Tamas E.","Rearrangement and Degradation of Cephalosporins and Penicillins in the Presence of Mercury(II) Trifluoroacetate","Organic Letters","2000","2","2","103","","10.1021/ol9911627","","","0.71073","MoKα","","0.1097","0.0911","","0.2921","0.2654","","","","1.092","1.151","1.151","","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1507554","11.144","0.002","11.144","0.002","27.418","0.007","90","","90","","120","","2948.8","1.1","293","2","293","2","","","","","","","","4","P 32","P 32","145","","","","- C22 H23 N O4 -","- C22 H23 N O4 -","- C132 H138 N6 O24 -","6","2","","Gizecki, Patricia; Dhal, Robert; Toupet, Loïc; Dujardin, Gilles","First Asymmetric Synthesis of a 6-Alkoxy-5,6-dihydro-1,3-oxazine: A Promising Enantioselective Route to β-Amido Aldehydes","Organic Letters","2000","2","5","585","","10.1021/ol991326j","","","0.71069","MoKα","","0.1392","0.0635","","","0.1589","0.1955","","","","","","1.053","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1509080","10.4263","","10.4263","","10.4263","","90","","90","","90","","1133.42","","","","","","","","","","","","","4","P 43 3 2","P 4acd 2ab 3","212","","Lithium silver hafnium sulfide (5/0.25/3/8)","","- Ag0.25 Hf3 Li5 S8 -","- Ag0.25 Hf3 Li4.999 S8 -","- Ag Hf12 Li19.996 S32 -","4","0.166667","","Ishii, M.; Wada, H.; Sakamaki, K.","Electrochemical and structural characterization of silver hafnium sulfide cathodes","Solid State Ionics","2000","136","","469","472","","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1509195","7.7548","","7.7548","","7.7548","","90","","90","","90","","466.35","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","Ag (As F6)","","- Ag As F6 -","- Ag As F5.9994 -","- Ag4 As4 F23.9976 -","4","0.0208333","","Ito, Y.; Kitashita, K.; Tamada, O.; Hagiwara, R.","Crystal structure of Ag P F6 and Ag As F6 at ambient temperatures","Solid State Sciences","2000","2","","237","241","10.1016/S1293-2558(00)00124-2","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509327","7.5508","","7.5508","","7.5508","","90","","90","","90","","430.506","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","Ag (P F6)","","- Ag F6 P -","- Ag F5.9994 P -","- Ag4 F23.9976 P4 -","4","0.0208333","","Hagiwara, R.; Kitashita, K.; Tamada, O.; Ito, Y.","Crystal structure of Ag P F6 and Ag As F6 at ambient temperatures","Solid State Sciences","2000","2","","237","241","10.1016/S1293-2558(00)00124-2","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509336","13.975","","5.249","","7.609","","90","","90","","90","","558.156","","","","","","","","","","","","","4","P n a 21","P 2c -2n","33","","Ag Fe (Se O3)2","","- Ag Fe O6 Se2 -","- Ag Fe O6 Se2 -","- Ag4 Fe4 O24 Se8 -","4","1","","Giester, G.","Syntheses and crystal structures of the new compounds Ba Fe2 (Se O3)4, Ag Fe (Se O3)2 and Rb Fe (Se O4) (Se O3)","Journal of Alloys Compd.","2000","308","","71","76","10.1016/S0925-8388(00)00848-3","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509349","8.031","","8.014","","6.221","","90","","128.42","","90","","313.693","","","","","","","","","","","","","3","C 1 c 1","C -2yc","9","","","","- Ag Ga S2 -","- Ag Ga S2 -","- Ag4 Ga4 S8 -","4","1","","Ishizawa, N.; Kitahara Eba, H.; Noda, Y.; Marumo, F.","Synchrotron X-ray stuy of the monoclinic high-pressure structure of Ag Ga S2","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2000","61","","3310","3316","10.1103/PhysRevB.61.3310","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1509508","34.691","","20.018","","11.576","","90","","90","","90","","8038.89","","","","","","","","","","","","","4","C c c 2","C 2 -2c","37","","Ag Ti2 (P S4)3","","- Ag P3 S12 Ti2 -","- Ag P3 S12 Ti2 -","- Ag16 P48 S192 Ti32 -","16","2","","Quarton, M.; Angenault, J.; Wallez, G.; Cieren, X.","Two new thiophosphates with interlocked structures: Ag Ti2 (P S4)3 and Ag2 Nb Ti3 P6 S25","Journal of Solid State Chemistry","2000","153","","55","65","10.1006/jssc.2000.8739","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509674","5.432","","6.619","","16.51","","80.78","","82.43","","72.82","","557.547","","","","","","","","","","","","","4","P -1","-P 1","2","","Ag2 Mn3 (P2 O7)2","","- Ag2 Mn3 O14 P4 -","- Ag2 Mn3 O14 P4 -","- Ag4 Mn6 O28 P8 -","2","1","","Holt, E.M.; Erragh, F.; Bennazha, J.; Boukhari, A.","Identification of a new family of diphosphate compounds, A(I)2 B(II)3 (P2 O7)2: structures of Ag2 Co3 (P2 O7)2, Ag2 Mn3 (P2 O7)2, and Na2 Cd3 (P2 O7)2","Journal of Chemical Crystallography","2000","30","","705","716","10.1023/A:1012294026877","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1509677","22.609","","27.6939","","11.589","","90","","90","","90","","7256.24","","","","","","","","","","","","","5","P c c n","-P 2ab 2ac","56","","Ag2 (Nb Ti3 P6 S25)","","- Ag2 Nb P6 S25 Ti3 -","- Ag1.985 Nb P6 S25 Ti3 -","- Ag15.88 Nb8 P48 S200 Ti24 -","8","1","","Quarton, M.; Angenault, J.; Cieren, X.; Wallez, G.","Two new thiophosphates with interlocked structures: Ag Ti2 (P S4)3 and Ag2 Nb Ti3 P6 S25","Journal of Solid State Chemistry","2000","153","","55","65","10.1006/jssc.2000.8739","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509703","7.743","","7.743","","10.5","","90","","90","","90","","629.518","","","","","","","","","","","","","4","P 42/m n m","-P 4n 2n","136","","Ag2 Zn (P2 O7)","","- Ag2 O7 P2 Zn -","- Ag2 O7 P2 Zn -","- Ag8 O28 P8 Zn4 -","4","0.25","","Chaminade, J.P.; Moine, B.; Gravereau, P.; le Flem, G.; Belharouak, I.; Parent, C.","Luminescent properties of silver(I) diphosphate of compositions Na2-x Agx Zn P2 O7","Journal of Solid State Chemistry","2000","149","","284","291","10.1006/jssc.1999.8528","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509781","5.351","","6.375","","16.532","","80.83","","81.45","","72.87","","528.942","","","","","","","","","","","","","4","P -1","-P 1","2","","Ag2 Co3 (P2 O7)2","","- Ag2 Co3 O14 P4 -","- Ag2 Co3 O14 P4 -","- Ag4 Co6 O28 P8 -","2","1","","Boukhari, A.; Erragh, F.; Holt, E.M.; Bennazha, J.","Identification of a new family of diphosphate compounds, A(I)2 B(II)3 (P2 O7)2: structures of Ag2 Co3 (P2 O7)2, Ag2 Mn3 (P2 O7)2, and Na2 Cd3 (P2 O7)2","Journal of Chemical Crystallography","2000","30","","705","716","10.1023/A:1012294026877","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1509800","7.857","","11.192","","10.177","","90","","97.5","","90","","887.264","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","K3 Ag2 Zr4 F23","","- Ag2 F23 K3 Zr4 -","- Ag2 F23 K3 Zr4 -","- Ag4 F46 K6 Zr8 -","2","0.5","","Mueller, B.G.; Koller, D.","Synthese und Struktur von K3 Ag2 M4 F23 (M= Zr, Hf)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","1429","1433","10.1002/(SICI)1521-3749(200006)626:6<1429::AID-ZAAC1429>3.0.CO;2-O","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1509916","19.359","","7.713","","19.533","","90","","90.6","","90","","2916.43","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Ag5 Te2 Cl","","- Ag5 Cl Te2 -","- Ag5 Cl Te2 -","- Ag80 Cl16 Te32 -","16","4","","Boettcher, P.; Sieler, J.; Doert, T.; Roensch, E.; Schnieders, F.","Die Kristallstruktur der Tieftemperaturmodifikation von Ag5 Te2 Cl","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","89","93","10.1002/(SICI)1521-3749(200001)626:1<89::AID-ZAAC89>3.0.CO;2-B","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509918","14.083","","14.083","","4.41","","90","","90","","90","","874.639","","","","","","","","","","","","","3","P 42/m n m","-P 4n 2n","136","","Cs Ag5 Se3","","- Ag5 Cs Se3 -","- Ag5 Cs Se3 -","- Ag20 Cs4 Se12 -","4","0.25","","Schimek, G. L.; Kolis, J. W.; Eanes, M. E.","Synthesis and structural characterization of CsAg~5~Se~3~ and RbAg~3~Te~2~","Journal of Chemical Crystallography","2000","30","4","223","226","10.1023/A:1009582820690","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1509959","14.009","","14.009","","9.79","","90","","90","","120","","1663.9","","","","","","","","","","","","","3","R -3 :H","-R 3","148","","Ag7 (Zr6 F31)","","- Ag7 F31 Zr6 -","- Ag7 F31 Zr6 -","- Ag21 F93 Zr18 -","3","0.166667","","Koller, D.; Mueller, B.G.","Synthese und Struktur von Ag7 M6 F31 (M = Zr, Hf, Ce)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","1426","1428","10.1002/(SICI)1521-3749(200006)626:6<1426::AID-ZAAC1426>3.0.CO;2-5","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1509981","14.7443","","14.7443","","14.7443","","90","","90","","90","","3205.33","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","","","- Ag8 Ca19 N7 -","- Ag8 Ca19 N7 -","- Ag32 Ca76 N28 -","4","0.0208333","","Meyer, H.J.; Reckeweg, O.; Braun, T.P.; DiSalvo, F.","Ag8 Ca19 N7 - nitrogen bridged Ca19 N7 superoctahedra surrounded by silver tetrahedra","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","62","67","10.1002/(SICI)1521-3749(200001)626:1<62::AID-ZAAC62>3.0.CO;2-K","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1510031","6.36","","11.071","","6.518","","90","","108.17","","90","","436.058","","","","","","","","","","","","","3","P 1 21/m 1","-P 2yb","11","","Ag3 Sn P7","","- Ag3 P7 Sn -","- Ag3 P7 Sn -","- Ag6 P14 Sn2 -","2","0.5","","Shevel'kov, A.V.; Popovkin, B.A.; Shatruk, M.M.; Kovnir, K.A.","Ag3 Sn P7: A polyphosphide with a unique infinite(P7) chain and a novel Ag3 Sn heterocluster","Angew. Chem. Int. ed.","2000","39","","2508","2509","10.1002/1521-3773(20000717)39:14<2508::AID-ANIE2508>3.0.CO;2-O","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510037","4.3223","","15.229","","17.42","","90","","90","","90","","1146.66","","","","","","","","","","","","","4","C m c m","-C 2c 2","63","","Rb Sm2 Ag3 Se5","","- Ag3 Rb Se5 Sm2 -","- Ag3 Rb Se5 Sm2 -","- Ag12 Rb4 Se20 Sm8 -","4","0.25","","Huang Fuqiang; Ibers, J.A.","Syntheses and structures of the new quaternary rubidium selenides Rb Ln2 Cu Se4 (Ln = Sm, Gd, Dy), Rb1.5 Ln2 Cu2.5 Se5 (Ln = Gd, Dy),and Rb Sm2 Ag3 Se5","Journal of Solid State Chemistry","2000","151","","317","322","10.1006/jssc.2000.8661","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510038","17.546","","4.617","","9.165","","90","","113.04","","90","","683.231","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","Rb Ag3 Te2","","- Ag3 Rb Te2 -","- Ag3 Rb Te2 -","- Ag12 Rb4 Te8 -","4","0.5","","Schimek, G. L.; Kolis, J. W.; Eanes, M. E.","Synthesis and structural characterization of CsAg~5~Se~3~ and RbAg~3~Te~2~","Journal of Chemical Crystallography","2000","30","4","223","226","10.1023/A:1009582820690","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1510130","7.606","","4.488","","8.758","","90","","90","","90","","298.961","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Eu Au Mg","","- Au Eu Mg -","- Au1.023 Eu0.962 Mg1.015 -","- Au4.092 Eu3.848 Mg4.06 -","4","0.5","","Hoffmann, R.D.; Moeller, M.H.; Rodewald, U.C.; Poettgen, R.; Renger, J.","Intermetallic Gold Compounds REAuMg (RE = Y, La-Nd, Sm, Eu, Gd-Yb)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","2257","2263","10.1002/1521-3749(200011)626:11<2257::AID-ZAAC2257>3.0.CO;2-#","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510136","8.255","","8.244","","8.764","","90","","90","","90","","596.427","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Au (P F3)2 (Sb F6)","","- Au F12 P2 Sb -","- Au F12 P2 Sb -","- Au2 F24 P4 Sb2 -","2","0.5","","Seppelt, K.; Kuester, R.","Preparation and structure of F3 As-Au+ Sb F6-, structures of Au (C O)2+ and Au (P F3)2+","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","236","240","10.1002/(SICI)1521-3749(200001)626:1<236::AID-ZAAC236>3.0.CO;2-G","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"1510137","7.9403","","9.1775","","17.391","","99.539","","92.64","","94.656","","1243.39","","","","","","","","","","","","","4","P -1","-P 1","2","","(Au Xe4) (Sb2 F11)2","","- Au F22 Sb4 Xe4 -","- Au F22 Sb4 Xe4 -","- Au2 F44 Sb8 Xe8 -","2","1","","Seidel, S.; Seppelt, K.","Xenon as complex ligand: The tetra xenono gold(II) cation in AuXe42+(Sb2F11-)2","Science","2000","290","","117","118","10.1126/science.290.5489.117","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510231","7.708","","7.708","","4.195","","90","","90","","120","","215.847","","","","","","","","","","","","","3","P -6 2 m","P -6 -2","189","","Pr Au Mg","","- Au Mg Pr -","- Au1.012 Mg0.988 Pr -","- Au3.036 Mg2.964 Pr3 -","3","0.25","","Moeller, M.H.; Hoffmann, R.D.; Rodewald, U.C.; Renger, J.; Poettgen, R.","Intermetallic Gold Compounds REAuMg (RE = Y, La-Nd, Sm, Eu, Gd-Yb)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","2257","2263","10.1002/1521-3749(200011)626:11<2257::AID-ZAAC2257>3.0.CO;2-#","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510232","7.384","","4.362","","8.646","","90","","90","","90","","278.479","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Yb Au Mg","","- Au Mg Yb -","- Au Mg Yb -","- Au4 Mg4 Yb4 -","4","0.5","","Hoffmann, R.D.; Rodewald, U.C.; Moeller, M.H.; Poettgen, R.; Renger, J.","Intermetallic Gold Compounds REAuMg (RE = Y, La-Nd, Sm, Eu, Gd-Yb)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","2257","2263","10.1002/1521-3749(200011)626:11<2257::AID-ZAAC2257>3.0.CO;2-#","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510248","5.7679","","5.7618","","12.4657","","90","","90","","90","","414.279","","","","","","","","","","","","","4","A m m m","-A 2 2","65","","La2 Li0.5 Au0.5 O4","","- Au0.5 La2 Li0.5 O4 -","- Au0.5 La2 Li0.5 O4 -","- Au2 La8 Li2 O16 -","4","0.25","","Massa, W.; Warda, S.A.; Reinen, D.; Pietzuch, W.","Die Kristallstruktur von La2 Li1/2 Au1/2 O4 und bindungschemische Aspekte.","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","113","117","10.1002/(SICI)1521-3749(200001)626:1<113::AID-ZAAC113>3.0.CO;2-3","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"1510333","7.509","","7.509","","4.077","","90","","90","","120","","199.084","","","","","","","","","","","","","3","P -6 2 m","P -6 -2","189","","Ho Au Mg","","- Au1.026 Ho Mg0.974 -","- Au1.026 Ho Mg0.974 -","- Au3.078 Ho3 Mg2.922 -","3","0.25","","Moeller, M.H.; Rodewald, U.C.; Hoffmann, R.D.; Poettgen, R.; Renger, J.","Intermetallic Gold Compounds REAuMg (RE = Y, La-Nd, Sm, Eu, Gd-Yb)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","2257","2263","10.1002/1521-3749(200011)626:11<2257::AID-ZAAC2257>3.0.CO;2-#","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510398","11.8241","","5.9922","","11.8013","","90","","90","","90","","836.15","","","","","","","","","","","","","3","P b c n","-P 2n 2ab","60","","Eu4 (Au2 O9)","","- Au2 Eu4 O9 -","- Au2 Eu4 O9 -","- Au8 Eu16 O36 -","4","0.5","","Jansen, M.; Figulla-Kroschel, C.","Darstellung, Kristallstrukturen und Eigenschaften von Ln4 Au2 O9 (Ln= Nd, Sm, Eu)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","2178","2184","10.1002/1521-3749(200010)626:10<2178::AID-ZAAC2178>3.0.CO;2-#","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1510450","11.9813","","6.1474","","11.9641","","90","","90","","90","","881.202","","","","","","","","","","","","","3","P b c n","-P 2n 2ab","60","","Nd4 (Au2 O9)","","- Au2 Nd4 O9 -","- Au2 Nd4 O9 -","- Au8 Nd16 O36 -","4","0.5","","Figulla-Kroschel, C.; Jansen, M.","Darstellung, Kristallstrukturen und Eigenschaften von Ln4 Au2 O9 (Ln= Nd, Sm, Eu)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","2178","2184","10.1002/1521-3749(200010)626:10<2178::AID-ZAAC2178>3.0.CO;2-#","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1510453","11.8689","","6.036","","11.8469","","90","","90","","90","","848.72","","","","","","","","","","","","","3","P b c n","-P 2n 2ab","60","","Sm4 (Au2 O9)","","- Au2 O9 Sm4 -","- Au2 O9 Sm4 -","- Au8 O36 Sm16 -","4","0.5","","Figulla-Kroschel, C.; Jansen, M.","Darstellung, Kristallstrukturen und Eigenschaften von Ln4 Au2 O9 (Ln= Nd, Sm, Eu)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","2178","2184","10.1002/1521-3749(200010)626:10<2178::AID-ZAAC2178>3.0.CO;2-#","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1510508","7.364","","14.308","","5.679","","90","","90","","90","","598.363","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Rb5 Au3 O2","","- Au3 O2 Rb5 -","- Au3 O2 Rb5 -","- Au6 O4 Rb10 -","2","0.25","","Jansen, M.; Wedig, U.; Nuss, J.; Mudring, A.V.","Mixed valent gold oxides: syntheses, structures, and properties of Rb5 Au3 O2, Rb7 Au5 O2, and Cs7 Au5 O2","Journal of Solid State Chemistry","2000","155","","29","36","10.1006/jssc.2000.8881","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1510540","4.6042","","13.895","","10.396","","90","","90","","90","","665.088","","","","","","","","","","","","","3","I 1 2/m 1","-I 2y","12","","La3 Au4 In7","","- Au4 In7 La3 -","- Au4 In7 La3 -","- Au8 In14 La6 -","2","0.25","","Poettgen, R.; Hoffmann, R.D.; Galadzhun, Ya.V.; Zaremba, V.I.; Kal'ichak, Ya.M.","The Structure of La3 Au4 In7 and its relation to the Ba Al4 Type","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","1773","1777","10.1002/1521-3749(200008)626:8<1773::AID-ZAAC1773>3.0.CO;2-S","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"1510568","5.671","","9.301","","16.594","","90","","90","","90","","875.267","","","","","","","","","","","","","3","I m m m","-I 2 2","71","","(Rb Au)4 (Rb3 (Au O2))","","- Au5 O2 Rb7 -","- Au5 O2 Rb7 -","- Au10 O4 Rb14 -","2","0.125","","Jansen, M.; Mudring, A.V.","Base-induced disproportionation of elemental gold","Angew. Chem. Int. ed.","2000","39","","3066","3067","","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1510589","3.837","","3.875","","50.492","","90","","90","","90","","750.734","","","","","","","","","","","","","5","A m m m","-A 2 2","65","","Ba4 Er2 Cu6.84 Au0.16 O15","","- Au0.16 Ba4 Cu6.84 Er2 O15 -","- Au0.16 Ba4 Cu6.84 Er2 O15 -","- Au0.32 Ba8 Cu13.68 Er4 O30 -","2","0.125","","Waszczak, J.V.; Siegrist, T.; Schneemeyer, L.F.; van Dover, R.B.","Structural effects of impurities in Ba4 Er2 Cu7 O15-d: incorporation of Au and of Al","Journal of Solid State Chemistry","2000","150","","228","232","","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"1510744","12.5947","","3.6853","","9.0935","","90","","106.035","","90","","405.655","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","La5 (B2 N4) N2","","- B2 La5 N6 -","- B2 La5 N6 -","- B4 La10 N12 -","2","0.25","","Jing, H.; Meyer, H.J.","Ueber das metallreiche Lanthannitridoboratnitrid La5 (B2 N4) N2","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","514","517","10.1002/(SICI)1521-3749(200002)626:2<514::AID-ZAAC514>3.0.CO;2-I","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1510764","8.984","","9.816","","10.552","","91.14","","114.61","","110.94","","774.389","","","","","","","","","","","","","3","P -1","-P 1","2","","Gd10 Br15 B2","","- B2 Br15 Gd10 -","- B2 Br15 Gd10 -","- B2 Br15 Gd10 -","1","0.5","","Oeckler, O.; Warkentin, E.; Simon, A.; Mattausch, H.J.","Metalloktaederdoppel in den Clusterverbindungen Gd10 I16 (C2)2 und Gd10 Br15 B2 / Tb10 Br15 B2","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","2117","2124","10.1002/1521-3749(200010)626:10<2117::AID-ZAAC2117>3.0.CO;2-H","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1510773","8.939","","9.788","","10.502","","91.19","","114.51","","111.1","","764.193","","","","","","","","","","","","","3","P -1","-P 1","2","","Tb10 Br15 B2","","- B2 Br15 Tb10 -","- B2 Br15 Tb10 -","- B2 Br15 Tb10 -","1","0.5","","Simon, A.; Mattausch, H.J.; Warkentin, E.; Oeckler, O.","Metalloktaederdoppel in den Clusterverbindungen Gd10 I16 (C2)2 und Gd10 Br15 B2 / Tb10 Br15 B2","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","2117","2124","10.1002/1521-3749(200010)626:10<2117::AID-ZAAC2117>3.0.CO;2-H","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1510860","2.8321","","25.406","","2.8106","","90","","90","","90","","202.229","","","","","","","","","","","","","3","C m c m","-C 2c 2","63","","Cu2 Ir4 B2.96","","- B2.96 Cu2 Ir4 -","- B2.96 Cu2 Ir4 -","- B5.92 Cu4 Ir8 -","2","0.125","","Kluenter, W.; Jung, W.","Das Kupfer-Iridiumborid Cu2 Ir4 B3 mit einer vom Zn Ir4 B3 Typ abgeleiteten Schichtstruktur","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","502","505","10.1002/(SICI)1521-3749(200002)626:2<502::AID-ZAAC502>3.0.CO;2-U","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1510869","5.874","","10.403","","8.359","","90","","90.17","","90","","510.793","","","","","","","","","","","","","2","I 1 m 1","I -2y","8","","Na2 B29","","- B29 Na2 -","- B29 Na2 -","- B58 Na4 -","2","0.5","","Eckert, H.; Fild, C.; Gruehn, R.; Albert, B.; Hofmann, K.; Schleifer, M.","""Na B15"": a new structural description based on X-ray and neutron diffraction, electron microscopy, and solid-state NMR spectroscopy","Chemistry - A European Journal","2000","6","","2531","2536","10.1002/1521-3765(20000717)6:14<2531::AID-CHEM2531>3.0.CO;2-2","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"1510944","8.209","","10.092","","5.382","","90","","90","","90","","445.873","","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","Rb (B3 O5)","","- B3 O5 Rb -","- B3 O5 Rb -","- B12 O20 Rb4 -","4","1","","Filatov, S.K.; Bubnova, R.S.; Krzhizhanovskaya, M.G.; Kabalov, Yu.K.; Sokolova, E.V.","Crystal structure of the low temperature modification alpha-(Rb B3 O5)","Kristallografiya","2000","45","","629","634","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510959","11.181","","10.85","","10.252","","90.64","","90.05","","89.97","","1243.63","","","","","","","","","","","","","10","I -1","-P 1 (-1/2*x+1/2*y+1/2*z,1/2*x-1/2*y+1/2*z,1/2*x+1/2*y-1/2*z)","2","","(Ba3.68 K0.12 Pb0.20) (Y Ca0.66 Gd0.34) (Si8 B2 (B1.70 Si0.30) O28 F)","","- B3.7 Ba3.68 Ca0.66 F Gd0.34 K0.12 O28 Pb0.2 Si8.3 Y -","- B3.7 Ba3.68 Ca0.66 F Gd0.34 K0.12 O28 Pb0.2 Si8.3 Y -","- B7.4 Ba7.36 Ca1.32 F2 Gd0.68 K0.24 O56 Pb0.4 Si16.6 Y2 -","2","","","Sokolova, E.V.; Pautov, L.A.; Ferraris, G.; Ivaldi, G.; Khvorov, P.V.","Crystal structure of kapitsaite-(Y), a new borosilicate isotypic with hyalotekite - Crystal chemistry of the related isomorphous series","Neues Jahrbuch fuer Mineralogie. Monatshefte (Band=Jahr) (1950-)","2000","2000","","74","84","","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"1511030","5.4898","","5.4898","","7.886","","90","","90","","120","","205.826","","","","","","","","","","","","","3","P 62 2 2","P 62 2 (0 0 4)","180","","Ce Pt2 B","","- B Ce Pt2 -","- B Ce Pt2 -","- B3 Ce3 Pt6 -","3","0.25","","Noel, H.; Almeida, M.; Potel, M.; Sologub, O.L.; Salamakha, P.S.; Godart, C.","New structure type of ternary intermetallic borides Ce Pt2 B","Journal of Alloys Compd.","2000","307","","40","44","10.1016/S0925-8388(00)00825-2","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"1511103","3.934","","3.934","","3.934","","90","","90","","90","","60.884","","","","","","","","","","","","","3","P m -3 m","-P 4 2 3","221","","Sc Rh3 B0.21","","- B0.21 Rh3 Sc -","- B0.21 Rh3 Sc -","- B0.21 Rh3 Sc -","1","0.0208333","","Higashi, I.; Naka, T.; Horiuchi, H.; Oku, M.; Fukuda, T.; Kudou, K.; Isida, S.; Sasaki, T.; Ye, J.-H.; Okkada, S.; Shishido, T.; Kishi, H.","Synthesis and characterization of the nonstoichiometric perovskite-type compound Sc Rh3 Bx","Journal of Alloys Compd.","2000","309","","107","112","10.1016/S0925-8388(00)01048-3","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511193","3.973","","3.973","","3.973","","90","","90","","90","","62.713","","","","","","","","","","","","","3","P m -3 m","-P 4 2 3","221","","Sc Rh3 B0.444","","- B0.444 Rh3 Sc -","- B0.444 Rh3 Sc -","- B0.444 Rh3 Sc -","1","0.0208333","","Horiuchi, H.; Naka, T.; Oku, M.; Shishido, T.; Ye, J.-H.; Okkada, S.; Kudou, K.; Higashi, I.; Fukuda, T.; Kishi, H.; Sasaki, T.; Isida, S.","Synthesis and characterization of the nonstoichiometric perovskite-type compound Sc Rh3 Bx","Journal of Alloys Compd.","2000","309","","107","112","10.1016/S0925-8388(00)01048-3","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511200","7.133","0.001","7.232","0.001","13.259","0.002","82","0.01","99.77","0.01","117.08","0.01","598.665","","","","","","","","","","","","","4","P -1","-P 1","2","","K3 (B Sb4 O13)","","- B K3 O13 Sb4 -","- B K3 O13 Sb4 -","- B2 K6 O26 Sb8 -","2","1","","Ftini, M. M.; Haddad, A.; Jouini, T.","Synthesis and crystal structure of K~3~Sb~4~BO~13~","Journal of Chemical Crystallography","2000","30","1","49","53","10.1023/A:1009598116581","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1511213","9.5587","","9.5587","","7.2173","","90","","90","","120","","571.088","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","La5 (Si2 B O13)","","- B La5 O13 Si2 -","- B0.999 La5 O13 Si2.001 -","- B1.998 La10 O26 Si4.002 -","2","0.166667","","Tribaudino, M.; Mazza, D.; Delmastro, A.; Lebech, B.","Synthesis and neutron diffraction study of La5 Si2 B O13, an analog of the apatite mineral","Journal of Solid State Chemistry","2000","155","","389","393","10.1006/jssc.2000.8929","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511274","4.773","","4.773","","15.48","","90","","90","","120","","305.411","","","","","","","","","","","","","4","R -3 :H","-R 3","148","","(Tb0.25 Sc0.75) (B O3)","","- B O3 Sc0.75 Tb0.25 -","- B O3 Sc0.75 Tb0.25 -","- B6 O18 Sc4.5 Tb1.5 -","6","0.333333","","Kuz'micheva, G.M.; Panyutin, V.L.; Rybakov, V.B.; Kuz'min, O.V.; Kutovoi, S.A.","Morphotropic series of Ln Sc3 (B O3)4 compounds","Kristallografiya","2000","45","","990","995","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511298","4.019","","4.019","","4.019","","90","","90","","90","","64.916","","","","","","","","","","","","","3","P m -3 m","-P 4 2 3","221","","Sc Rh3 B0.706","","- B0.706 Rh3 Sc -","- B0.706 Rh3 Sc -","- B0.706 Rh3 Sc -","1","0.0208333","","Sasaki, T.; Naka, T.; Isida, S.; Oku, M.; Shishido, T.; Kishi, H.; Fukuda, T.; Kudou, K.; Higashi, I.; Horiuchi, H.; Ye, J.-H.; Okkada, S.","Synthesis and characterization of the nonstoichiometric perovskite-type compound Sc Rh3 Bx","Journal of Alloys Compd.","2000","309","","107","112","10.1016/S0925-8388(00)01048-3","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511341","3.1648","","5.4799","","7.884","","90","","90","","90","","136.731","","","","","","","","","","","","","3","C 2 2 2","C 2 2","21","","Ce Pt2 B1.27","","- B1.27 Ce Pt2 -","- B1.27 Ce Pt2 -","- B2.54 Ce2 Pt4 -","2","0.25","","Salamakha, P.S.; Sologub, O.L.; Godart, C.","Ce Pt2 B2-x, a new structure type of ternary intermetallic borides","Journal of Alloys Compd.","2000","299","","189","194","10.1016/S0925-8388(99)00687-8","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511346","4.0201","","4.0201","","2.7937","","90","","90","","120","","39.101","","","","","","","","","","","","","2","P 63/m m c","-P 6c 2c","194","","Li B0.88","","- B0.88 Li -","- B0.88 Li -","- B1.76 Li2 -","2","0.0833333","","Nesper, R.; Woerle, M.","Infinite, linear, unbranched borynide chains in LiBx isoelectronic to polyyne and polycumulene","Angew. Chem. Int. ed.","2000","39","","2349","2353","10.1002/1521-3773(20000703)39:13<2349::AID-ANIE2349>3.0.CO;2-U","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511352","5.6539","","11.2569","","4.2013","","90","","90","","90","","267.393","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Ce2 Ni B10","","- B10 Ce2 Ni -","- B10 Ce2 Ni -","- B20 Ce4 Ni2 -","2","0.25","","Jeitschko, W.; Konrad, T.; Hartjes, K.; Lang, A.; Hoffmann, R.D.","Polyborides with Th2 Ni B10 - type structure: synthesis, crystal structure, and magnetic and electrical properties","Journal of Solid State Chemistry","2000","154","","246","253","10.1006/jssc.2000.8844","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511353","11.206","","11.206","","7.8641","","90","","90","","90","","987.53","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","Ce3 Co29 Si4 B10","","- B10 Ce3 Co29 Si4 -","- B10 Ce3 Co29 Si4 -","- B20 Ce6 Co58 Si8 -","2","0.125","","Campbell, S.J.; Edge, A.V.J.; Zhang, H.","Formation and structure of rare-earth intermetallic compounds R3 Co29 M4 B10","Journal of Physics: Condensed Matter","2000","12","","159","166","","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1511354","11.1893","","11.1893","","7.8581","","90","","90","","90","","983.838","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","Dy3 Co29 Si4 B10","","- B10 Co29 Dy3 Si4 -","- B10 Co29 Dy3 Si4 -","- B20 Co58 Dy6 Si8 -","2","0.125","","Edge, A.V.J.; Campbell, S.J.; Zhang, H.","Formation and structure of rare-earth intermetallic compounds R3 Co29 M4 B10","Journal of Physics: Condensed Matter","2000","12","","159","166","","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1511355","11.175","","11.175","","7.851","","90","","90","","90","","980.438","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","Er3 Co29 Si4 B10","","- B10 Co29 Er3 Si4 -","- B10 Co29 Er3 Si4 -","- B20 Co58 Er6 Si8 -","2","0.125","","Zhang, H.; Campbell, S.J.; Edge, A.V.J.","Formation and structure of rare-earth intermetallic compounds R3 Co29 M4 B10","Journal of Physics: Condensed Matter","2000","12","","159","166","","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1511356","11.209","","11.209","","7.8709","","90","","90","","90","","988.913","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","Gd3 Co29 Si4 B10","","- B10 Co29 Gd3 Si4 -","- B10 Co29 Gd3 Si4 -","- B20 Co58 Gd6 Si8 -","2","0.125","","Zhang, H.; Campbell, S.J.; Edge, A.V.J.","Formation and structure of rare-earth intermetallic compounds R3 Co29 M4 B10","Journal of Physics: Condensed Matter","2000","12","","159","166","","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1511357","11.182","","11.182","","7.853","","90","","90","","90","","981.917","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","Ho3 Co29 Si4 B10","","- B10 Co29 Ho3 Si4 -","- B10 Co29 Ho3 Si4 -","- B20 Co58 Ho6 Si8 -","2","0.125","","Campbell, S.J.; Edge, A.V.J.; Zhang, H.","Formation and structure of rare-earth intermetallic compounds R3 Co29 M4 B10","Journal of Physics: Condensed Matter","2000","12","","159","166","","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1511358","11.287","","11.287","","7.9193","","90","","90","","90","","1008.89","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","La3 Co29 Si4 B10","","- B10 Co29 La3 Si4 -","- B10 Co29 La3 Si4 -","- B20 Co58 La6 Si8 -","2","0.125","","Campbell, S.J.; Zhang, H.; Edge, A.V.J.","Formation and structure of rare-earth intermetallic compounds R3 Co29 M4 B10","Journal of Physics: Condensed Matter","2000","12","","159","166","","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1511359","11.164","","11.164","","7.843","","90","","90","","90","","977.511","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","Lu3 Co29 Si4 B10","","- B10 Co29 Lu3 Si4 -","- B10 Co29 Lu3 Si4 -","- B20 Co58 Lu6 Si8 -","2","0.125","","Edge, A.V.J.; Zhang, H.; Campbell, S.J.","Formation and structure of rare-earth intermetallic compounds R3 Co29 M4 B10","Journal of Physics: Condensed Matter","2000","12","","159","166","","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1511360","11.2405","","11.2405","","7.8905","","90","","90","","90","","996.956","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","Nd3 Co29 Si4 B10","","- B10 Co29 Nd3 Si4 -","- B10 Co29 Nd3 Si4 -","- B20 Co58 Nd6 Si8 -","2","0.125","","Zhang, H.; Edge, A.V.J.; Campbell, S.J.","Formation and structure of rare-earth intermetallic compounds R3 Co29 M4 B10","Journal of Physics: Condensed Matter","2000","12","","159","166","","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1511361","11.2456","","11.2456","","7.8912","","90","","90","","90","","997.949","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","Pr3 Co29 Si4 B10","","- B10 Co29 Pr3 Si4 -","- B10 Co29 Pr3 Si4 -","- B20 Co58 Pr6 Si8 -","2","0.125","","Zhang, H.; Edge, A.V.J.; Campbell, S.J.","Formation and structure of rare-earth intermetallic compounds R3 Co29 M4 B10","Journal of Physics: Condensed Matter","2000","12","","159","166","","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1511362","11.2201","","11.2201","","7.8772","","90","","90","","90","","991.666","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","Sm3 Co29 Si4 B10","","- B10 Co29 Si4 Sm3 -","- B10 Co29 Si4 Sm3 -","- B20 Co58 Si8 Sm6 -","2","0.125","","Edge, A.V.J.; Campbell, S.J.; Zhang, H.","Formation and structure of rare-earth intermetallic compounds R3 Co29 M4 B10","Journal of Physics: Condensed Matter","2000","12","","159","166","","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1511365","11.1944","","11.1944","","7.8615","","90","","90","","90","","985.161","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","Tb3 Co29 Si4 B10","","- B10 Co29 Si4 Tb3 -","- B10 Co29 Si4 Tb3 -","- B20 Co58 Si8 Tb6 -","2","0.125","","Campbell, S.J.; Edge, A.V.J.; Zhang, H.","Formation and structure of rare-earth intermetallic compounds R3 Co29 M4 B10","Journal of Physics: Condensed Matter","2000","12","","159","166","","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1511366","11.172","","11.172","","7.85","","90","","90","","90","","979.787","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","Tm3 Co29 Si4 B10","","- B10 Co29 Si4 Tm3 -","- B10 Co29 Si4 Tm3 -","- B20 Co58 Si8 Tm6 -","2","0.125","","Zhang, H.; Campbell, S.J.; Edge, A.V.J.","Formation and structure of rare-earth intermetallic compounds R3 Co29 M4 B10","Journal of Physics: Condensed Matter","2000","12","","159","166","","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1511376","5.6251","","11.207","","4.182","","90","","90","","90","","263.635","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Nd2 Ni B10","","- B10 Nd2 Ni -","- B10 Nd2 Ni -","- B20 Nd4 Ni2 -","2","0.25","","Hoffmann, R.D.; Hartjes, K.; Konrad, T.; Lang, A.; Jeitschko, W.","Polyborides with Th2 Ni B10 - type structure: synthesis, crystal structure, and magnetic and electrical properties","Journal of Solid State Chemistry","2000","154","","246","253","10.1006/jssc.2000.8844","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511439","4.907","","4.907","","9.62","","90","","90","","120","","200.603","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Ba Ga (B O3) F2","","- B Ba F2 Ga O3 -","- B Ba F2 Ga O3 -","- B2 Ba2 F4 Ga2 O6 -","2","0.166667","","Barbier, J.; Park, H.-S.","Crystal structures of the new borate fluorides Ba M B O3 F2 (M = Ga, Al)","Journal of Solid State Chemistry","2000","155","","354","358","10.1006/jssc.2000.8924","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511463","12.7613","","11.4271","","7.3728","","90","","90","","90","","1075.14","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","(P I3) (B Br3)","","- B Br3 I3 P -","- B Br3 I3 P -","- B4 Br12 I12 P4 -","4","0.5","","Schulz, A.; Mayer, P.; Piotrowski, H.; Klapoetke, T.M.; Davidge, K.; Aubauer, C.","Crystal structures of the phosphorus-boron adducts n-Pr3 P . B Br3 and I3 P . B Br3","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","2373","2378","10.1002/1521-3749(200011)626:11<2373::AID-ZAAC2373>3.0.CO;2-D","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511474","5.0448","","13.1688","","13.3933","","90","","90.069","","90","","889.769","","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","Li4 (B4 Si8 O24)","","- B4 Li4 O24 Si8 -","- B4 Li4 O24 Si8 -","- B8 Li8 O48 Si16 -","2","1","","Parise, J.B.; Gier, T.E.","Hydrothermal synthesis and structure of Li4 B4 Si8 O24","International Journal of Inorganic Materials","2000","2","","81","86","10.1016/S1466-6049(99)00072-0","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1511478","2.9128","","11.859","","9.758","","90","","90","","90","","337.07","","","","","","","","","","","","","3","C m c m","-C 2c 2","63","","Mg Os3 B4","","- B4 Mg Os3 -","- B4 Mg Os3 -","- B16 Mg4 Os12 -","4","0.25","","Jung, W.; Schiffer, J.","Mg Os3 B4 and Sc Os3 B4, ternary borides with a new channel structure","Journal of Solid State Chemistry","2000","154","","232","237","10.1006/jssc.2000.8841","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511497","7.7138","","9.8347","","12.032","","90","","105.387","","90","","880.064","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Pr Sc3 (B O3)4","","- B4 O12 Pr Sc3 -","- B4 O12 Pr Sc3 -","- B16 O48 Pr4 Sc12 -","4","0.5","","Rybakov, V.B.; Panyutin, V.L.; Kuz'micheva, G.M.; Kuz'min, O.V.; Kutovoi, S.A.","Morphotropic series of Ln Sc3 (B O3)4 compounds","Kristallografiya","2000","45","","990","995","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511504","2.9503","","11.797","","9.819","","90","","90","","90","","341.747","","","","","","","","","","","","","3","C m c m","-C 2c 2","63","","Sc Os3 B4","","- B4 Os3 Sc -","- B4 Os3 Sc -","- B16 Os12 Sc4 -","4","0.25","","Jung, W.; Schiffer, J.","Mg Os3 B4 and Sc Os3 B4, ternary borides with a new channel structure","Journal of Solid State Chemistry","2000","154","","232","237","10.1006/jssc.2000.8841","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511579","5.1264","","5.1264","","16.5602","","90","","90","","120","","376.896","","","","","","","","","","","","","3","P 6/m m m","-P 6 2","191","","Pr5 Co19 B6","","- B6 Co19 Pr5 -","- B6 Co19 Pr5 -","- B6 Co19 Pr5 -","1","0.0416667","","Chen, L.; Li, X.; Liang, J.K.; Shen, B.-G.; Liu, Q.L.; Chen, Y.","Synthesis, structure and magnetic properties of Pr5 Co19 B6","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2000","61","","3502","3507","10.1103/PhysRevB.61.3502","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1511603","9.81","","9.81","","25.847","","90","","90","","120","","2154.16","","","","","","","","","","","","","7","P 31","P 31","144","","Nd3.33 Sm3.71 Eu3.33 Gd3.63 (Ge2 B6 O34)","","- B6 Eu3.33 Gd3.63 Ge2 Nd3.33 O34 Sm3.71 -","- B6 Eu3.328 Gd3.632 Ge2 Nd3.328 O34 Sm3.712 -","- B18 Eu9.984 Gd10.896 Ge6 Nd9.984 O102 Sm11.136 -","3","1","","Palkina, K.K.; Dzhurinskii, B.F.; Kvardakov, A.M.; Sanygin, V.P.; Kuz'mina, N.E.; Pobedina, A.B.","Crystal structure of the oxoboratogermanate Ndx Smy Euz Gd14-x-y-z Ge2 B6 O34","Zhurnal Neorganicheskoi Khimii","2000","45","","1781","1785","","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1511617","9.796","","9.796","","7.96","","90","","90","","120","","661.517","","","","","","","","","","","","","4","R 3 2 :H","R 3 2""","155","","Ce Sc3 (B O3)4","","- B4 Ce O12 Sc3 -","- B4 Ce O12 Sc3 -","- B12 Ce3 O36 Sc9 -","3","0.166667","","Reynolds, T.A.; Peterson, G.A.; Keszler, D.A.","Stoichiometric, trigonal huntite borate Ce Sc3 (B O3)4","International Journal of Inorganic Materials","2000","2","","101","106","10.1016/S1466-6049(00)00011-8","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1512485","5.5307","0.0004","10.7829","0.0008","3.8145","0.0003","90","","90","","90","","227.49","","","","425","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Mn2 O5 Sr2 -","- Mn2 O5 Sr2 -","- Mn4 O10 Sr4 -","2","0.25","","Takanori Mori; Kazuko Inoue; Naoki Kamegashira; Yasuo Yamaguchi; Kenji Ohoyama","Neutron diffraction study of Sr2Mn2O5","Journal of Alloys and Compounds","2000","296","1--2","92","97","10.1016/S0925-8388(99)00521-6","powder diffraction","neutron","1.8196","","","","","","","","","","","","","","","","","","has coordinates","203889","2020-10-21","18:00:00",""
"1512486","5.499","0.003","10.73","0.07","7.6","0.006","90","","90","","90","","448.43","","","","20","","","","","","","","","3","P n n m","-P 2 2n","58","","","","- Mn2 O5 Sr2 -","- Mn2 O5 Sr2 -","- Mn8 O20 Sr8 -","4","0.5","","Takanori Mori; Kazuko Inoue; Naoki Kamegashira; Yasuo Yamaguchi; Kenji Ohoyama","Neutron diffraction study of Sr2Mn2O5","Journal of Alloys and Compounds","2000","296","1--2","92","97","10.1016/S0925-8388(99)00521-6","powder diffraction","neutron","1.8196","","","","","","","","","","","","","","","","","","has coordinates","203889","2020-10-21","18:00:00",""
"1512946","17.7947","0.0005","14.4615","0.0004","23.7863","0.0006","90","","102.38","","90","","5978.8","0.3","198","2","198","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C42 H74 Cl2 N2 Ni2 S15 -","- C42 H74 Cl2 N2 Ni2 S15 -","- C168 H296 Cl8 N8 Ni8 S60 -","4","1","","Jonathan G. Breitzer; Thomas B. Rauchfuss","Studies on α-C~3~S~5~^2-^ (dmit^2^) and its dinuclear Ni(II) complex: spectroscopic and structural characterization","Polyhedron","2000","19","10","1283","1291","10.1016/S0277-5387(00)00381-8","","","0.71073","MoKα","","0.1424","0.0665","","","0.1032","0.1305","","","","","","1.077","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1513333","3.97802","0.000023","3.97802","0.000023","4.14877","0.00005","90","","90","","90","","65.6528","0.001","","","","","","","","","","","","4","P 4 m m","P 4 -2","99","","Lead Zirconium Titanium Oxide (1/0.3/0.7/3)","","- O3 Pb Ti0.7 Zr0.3 -","- O3 Pb Ti0.7 Zr0.3 -","- O3 Pb Ti0.7 Zr0.3 -","1","0.125","","Frantti, J.; Lappalainen, J.; Eriksson, S.; Lantto, V.; Nishio,S.; Kakihana, M.; Ivanov, S.; Rundlof, H.","Neutron diffraction studies of Pb (Zrx Ti1-x) O3 ceramics","Japanese Journal of Applied Physics, Part 1","2000","39","","5697","5703","10.1143/JJAP.39.5697","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1513334","3.9272","0.0002","3.9272","0.0002","4.1319","0.0003","90","","90","","90","","63.726","0.007","","","","","","","","","","","","4","P 4 m m","P 4 -2","99","","Lead Zirconium Titanium Oxide (1/0.1/0.9/3)","","- O3 Pb Ti0.9 Zr0.1 -","- O3 Pb Ti0.9 Zr0.1 -","- O3 Pb Ti0.9 Zr0.1 -","1","0.125","","Joseph, J.; Vimala, T.M.; Sivasubramanian, V.","Structural investigations on Pb (Zrx Ti1-x) O3 solid solutions using the X-ray Rietveld method","Journal of Materials Science","2000","35","","1571","1575","10.1023/A:1004778223721","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1514004","8.2579","0.0003","8.2579","0.0003","8.2579","0.0003","90","","90","","90","","563.13","0.04","","","","","","","","","","","","3","F d -3 m :1","F 4d 2 3 -1d","227","","Lithium Manganese Oxide (0.96/2.04/4)","","- Li0.956 Mn2.044 O4 -","- Li0.956 Mn2.044 O4 -","- Li7.648 Mn16.352 O32 -","8","0.0416667","","Piszora, P.; Catlow, C. R. A.; Woodley, S. M.; Wolska, E.","Relationship of crystal structure to interionic interactions in the lithium-manganese spinel oxides","Computers and Chemistry","2000","24","","609","613","","","","","","","0.047","","","","","","","","","","","","","","","has coordinates","176808","2020-10-21","18:00:00",""
"1514005","8.1845","0.0003","8.1845","0.0003","8.1845","0.0003","90","","90","","90","","548.25","0.03","","","","","","","","","","","","3","F d -3 m :1","F 4d 2 3 -1d","227","","Lithium Manganese Oxide (1.05/1.95/4)","","- Li1.049 Mn1.951 O4 -","- Li1.049 Mn1.951 O4 -","- Li8.392 Mn15.608 O32 -","8","0.0416667","","Piszora, P.; Catlow, C. R. A.; Woodley, S. M.; Wolska, E.","Relationship of crystal structure to interionic interactions in the lithium-manganese spinel oxides","Computers and Chemistry","2000","24","","609","613","","","","","","","0.05","","","","","","","","","","","","","","","has coordinates","176808","2020-10-21","18:00:00",""
"1514018","8.2164","","8.2164","","8.2164","","90","","90","","90","","554.683","","","","","","","","","","","","","3","P 43 3 2","P 4acd 2ab 3","212","","Lithium Iron(III) Manganese Oxide (1.09/1.96/4)","","- Li1.09 Mn1.96 O4 -","- Li1.09 Mn1.91 O4 -","- Li8.72 Mn15.28 O32 -","8","0.333333","","Woodley, S. M.; Catlow, C. R. A.; Piszora, P.; Stempin, K.; Wolska, E.","Computer modeling study of the lithium ion distribution in quaternary Li- Mn - Fe - O spinels","Journal of Solid State Chemistry","2000","153","","310","316","10.1006/jssc.2000.8770","","","","","","","","","","","","","","","","","","","","","has coordinates","176808","2020-10-21","18:00:00",""
"1519057","4.6935","0.0007","7.2515","0.001","11.1025","0.0015","90","","94.724","0.003","90","","376.59","0.09","","","293","","","","","","","","","5","P 1 c 1","P -2yc","7","","","","- C H2 O7 P2 Sb2 -","- C O7 P2 Sb2 -","- C2 O14 P4 Sb4 -","2","1","","Brian A. Adair; Graciela Diaz de Delgado; J. Miguel Delgado; Anthony K. Cheetham","On the synthesis and characterization of open-framework antimony(III) diphosphonates","Solid State Sciences","2000","2","","119","126","","","x-ray","0.71073","MoKα","","","0.0397","","","0.1002","","","","","","","1.325","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519058","4.6707","0.0002","16.9992","0.0006","16.7699","0.0006","90","","98","0.01","90","","1318.54","0.09","","","293","","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C2 H5 O6 P2 Sb -","","","2","0.5","","Brian A. Adair; Graciela Diaz de Delgado; J. Miguel Delgado; Anthony K. Cheetham","On the synthesis and characterization of open-framework antimony(III) diphosphonates","Solid State Sciences","2000","2","","119","126","","","x-ray","0.71073","MoKα","","","0.0891","","","","","","","","","","","","","","","191028","2020-10-21","18:00:00",""
"1519059","4.6635","0.0006","19.545","0.002","8.7608","0.0001","90","","103.87","0.04","90","","775.25","0.18","","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C3 H7 O6 P2 Sb -","","","2","0.5","","Brian A. Adair; Graciela Diaz de Delgado; J. Miguel Delgado; Anthony K. Cheetham","On the synthesis and characterization of open-framework antimony(III) diphosphonates","Solid State Sciences","2000","2","","119","126","","","x-ray","0.71073","MoKα","","","0.0352","","","","","","","","","","","","","","","176729","2020-10-21","18:00:00",""
"1519064","5.213","0.0005","5.213","0.0005","12.959","0.001","90","","90","","90","","352.17","0.05","","","293","","","","","","","","","5","I 41/a m d :2","-I 4bd 2","141","","","","- Co0.46 H1.26 O5 P V0.94 -","- Co0.464 O5 P V0.944 -","- Co1.856 O20 P4 V3.776 -","4","0.125","","E. Le Fur; A. Riou; O. Pena; J.Y. Pivan","Crystal structure of (V0.94Co0.46)[PO4(OH)0.74(OH2)0.26]: a mixed-valence phosphate related to the mineral caminite and the synthetic lipscombite","Solid State Sciences","2000","2","","135","141","","","x-ray","0.71073","MoKα","","","0.0305","","","0.0726","","","","","","","0.93","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1519065","10.356","0.002","10.356","0.002","4.0224","0.0008","90","","90","","120","","373.59","0.13","","","293","","","","","","","","","3","P -6","P -6","174","","","","- Br2 F12 Pb7 -","- Br2 F12 Pb7 -","- Br2 F12 Pb7 -","1","0.166667","","F. Kubel; H. Vollenkle","Hydrothermal synthesis and structure of the ordered modification of Pb7F12Br2","Solid State Sciences","2000","2","","193","196","","","x-ray","0.71073","MoKα","","","0.028","","","0.059","","","","","","","1.027","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519091","8.016","0.001","8.788","0.001","13.186","0.001","71.42","0.01","89.16","0.01","86.49","0.01","878.81","0.17","","","293","","","","","","","","","4","P -1","-P 1","2","","","","- K4 Nb2 S9.5 Se1.5 -","- K4 Nb2 S9.54 Se1.46 -","- K8 Nb4 S19.08 Se2.92 -","2","1","","Oliver Krause; Peter Durichen; Christian Nather; Wolfgang Bensch","Chemical reactivity of the [Nb2S11]4- anion: selective substitution of sulfur by selenium on a molecular level","Solid State Sciences","2000","2","","197","203","","","x-ray","0.71073","MoKα","","","0.0494","","","0.1311","","","","","","","1.041","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519092","7.938","0.001","8.744","0.003","13.098","0.002","71.91","0.02","89.38","0.01","86.85","0.01","862.9","0.4","","","200","","","","","","","","","4","P -1","-P 1","2","","","","- K4 Nb2 S8.9 Se2.1 -","- K4 Nb2 S8.92 Se2.08 -","- K8 Nb4 S17.84 Se4.16 -","2","1","","Oliver Krause; Peter Durichen; Christian Nather; Wolfgang Bensch","Chemical reactivity of the [Nb2S11]4- anion: selective substitution of sulfur by selenium on a molecular level","Solid State Sciences","2000","2","","197","203","","","x-ray","0.71073","MoKα","","","0.0556","","","0.1475","","","","","","","1.064","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519093","10.9317","0.0001","8.05578","0.00009","9.2774","0.0001","90","","90.201","0.001","90","","816.994","0.015","","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- H7 Mg2 O10.5 P2 -","- Mg2 O10.5 P2 -","- Mg8 O42 P8 -","4","1","","Kjell Ove Kongshaug; Helmer Fjellvag; Karl Petter Lillerud","Synthesis and crystal structure of the hydrated magnesium diphosphate Mg2P2O7.3.5H2O and its high temperature variant Mg2P2O7.H2O","Solid State Sciences","2000","2","","205","214","","powder diffraction","x-ray","1.5406","CuKα","","","","","","","","","0.094","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519094","18.6596","0.0004","7.9769","0.0001","8.9757","0.0002","90","","107.378","0.001","90","","1275.01","0.04","","","293","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- H2 Mg2 O8 P2 -","- Mg4 O16 P4 -","- Mg16 O64 P16 -","4","0.5","","Kjell Ove Kongshaug; Helmer Fjellvag; Karl Petter Lillerud","Synthesis and crystal structure of the hydrated magnesium diphosphate Mg2P2O7.3.5H2O and its high temperature variant Mg2P2O7.H2O","Solid State Sciences","2000","2","","205","214","","powder diffraction","x-ray","1.5406","CuKα","","","","","","","","","0.0418","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519095","4.179","0.002","4.179","0.002","7.069","0.003","90","","90","","120","","106.91","0.09","","","293","","","","","","","","","3","P -3 m 1","-P 3 2""","164","","","","- Al2 Ge2 Yb -","- Al2 Ge2 Yb -","- Al2 Ge2 Yb -","1","0.0833333","","Christian Kranenberg; Dirk Johrendt; Albrecht Mewis; Rainer Pottgen; Gunter Kotzyba; Carsten Rosenhahn; Bernd D Mosel","Structure and properties of the compounds LnAl2X2 (Ln=Eu, Yb; X=Si, Ge)","Solid State Sciences","2000","2","","215","222","","","x-ray","0.71073","MoKα","","","0.024","","","0.05","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519096","4.214","0.001","4.214","0.001","7.32","0.001","90","","90","","120","","112.57","0.04","","","293","","","","","","","","","3","P -3 m 1","-P 3 2""","164","","","","- Al2 Eu Ge2 -","- Al2 Eu Ge2 -","- Al2 Eu Ge2 -","1","0.0833333","","Christian Kranenberg; Dirk Johrendt; Albrecht Mewis; Rainer Pottgen; Gunter Kotzyba; Carsten Rosenhahn; Bernd D Mosel","Structure and properties of the compounds LnAl2X2 (Ln=Eu, Yb; X=Si, Ge)","Solid State Sciences","2000","2","","215","222","","","x-ray","0.71073","MoKα","","","0.014","","","0.022","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519097","4.181","0.001","4.181","0.001","7.259","0.001","90","","90","","120","","109.89","0.04","","","293","","","","","","","","","3","P -3 m 1","-P 3 2""","164","","","","- Al2 Eu Si2 -","- Al2 Eu Si2 -","- Al2 Eu Si2 -","1","0.0833333","","Christian Kranenberg; Dirk Johrendt; Albrecht Mewis; Rainer Pottgen; Gunter Kotzyba; Carsten Rosenhahn; Bernd D Mosel","Structure and properties of the compounds LnAl2X2 (Ln=Eu, Yb; X=Si, Ge)","Solid State Sciences","2000","2","","215","222","","","x-ray","0.71073","MoKα","","","0.01","","","0.024","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519098","5.6109","0.0007","8.1277","0.0008","31.205","0.003","90","","90","","90","","1423.1","0.3","","","293","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- Bi Nb O8 Te2 -","- Bi Nb O8 Te2 -","- Bi8 Nb8 O64 Te16 -","8","1","","S. Blanchandin; J.C. Champarnaud-Mesjard; P. Thomas; B. Frit","Crystal structure of BiNbTe2O8","Solid State Sciences","2000","2","","223","228","","","x-ray","0.71073","MoKα","","","0.0512","","","0.0948","","","","","","","1.005","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519099","10.097","0.004","10.097","0.004","10.097","0.004","90","","90","","90","","1029.4","0.7","","","295","","","","","","","","","4","I -4 3 d","I -4bd 2c 3","220","","","","- Bi5 Na3 O24 P6 -","- Bi5 Na3 O24 P6 -","- Bi10 Na6 O48 P12 -","2","0.0416667","","El Hassan Arbib; Jean-Pierre Chaminade; Jacques Darriet; Brahim Elouadi","The crystal structure of eulytite Na3Bi5(PO4)6","Solid State Sciences","2000","2","","243","247","","","x-ray","0.71069","MoKα","","","0.0257","","","0.0533","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519100","6.958","0.0008","17.302","0.003","7.003","0.002","90","","105.47","0.02","90","","812.5","0.3","","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H12 La2 O16 -","- C10 H12 La2 O16 -","- C20 H24 La4 O32 -","2","0.5","","J.C. Trombe; S. Romero","Crystal structure and characterization of [La(H2O)]2(C2O4)(C4H4O5)2","Solid State Sciences","2000","2","","279","283","","","x-ray","0.71073","MoKα","","","0.0245","","","0.0277","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519101","5.3086","0.0008","7.1465","0.0009","7.6871","0.0009","90","","115.48","0.02","90","","263.27","0.07","","","293","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- Cd H2 O7 P V -","- Cd O7 P V -","- Cd2 O14 P2 V2 -","2","1","","Andre Leclaire; Marie-Madeleine Borel; Josiane Chardon; Bernard Raveau","A cadmium vanadophosphate built up from rutile and HTB-TYPE ribbons: CdVO2(H2O)PO4","Solid State Sciences","2000","2","","293","297","","","x-ray","0.71073","MoKα","","","0.048","","","0.05","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1519102","7.309","0.003","7.115","0.006","20.45","0.01","90","","91.56","0.02","90","","1063.1","1.1","","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- Al2 F10 H O4 P Sr3 -","- Al2 F10 O4 P Sr3 -","- Al8 F40 O16 P4 Sr12 -","4","1","","J.-M. Le Meins","Hydrothermal synthesis and structure determination of a new aluminium phosphate fluoride: Sr3Al2(HPO4)F10","Solid State Sciences","2000","2","","299","306","","","x-ray","0.71073","MoKα","","","0.042","","","0.108","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1519103","7.7033","0.0002","10.0798","0.0002","8.6667","0.0002","90","","100.284","0.001","90","","662.14","0.03","","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- Cr H Na2 O7.5 P2 -","- Cr Na2 O7.5 P2 -","- Cr4 Na8 O30 P8 -","4","1","","N. Stock; G. Ferey; A.K. Cheetham","Hydrothermal synthesis and characterization of a chromium(II) pyrophosphate, Na2CrP2O7.0.5H2O","Solid State Sciences","2000","2","","307","312","","","x-ray","0.71073","MoKα","","","0.0327","","","0.0785","","","","","","","1.078","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1519104","6.1672","0.0012","8.3595","0.0017","14.223","0.003","77.35","0.03","86.8","0.03","87.7","0.03","714.1","0.3","","","296","","","","","","","","","6","P -1","-P 1","2","","","","- C10 H8 Ag Cu N5 O8 -","- C10 H8 Ag Cu N5 O8 -","- C20 H16 Ag2 Cu2 N10 O16 -","2","1","","Yu-Bin Dong; Mark D Smith; Hans-Conrad zur Loye","Synthesis and characterization of a novel copper(II) silver(I) mixed-metal coordination polymer: Ag[Cu(2-pyrazinecarboxylate)2](H2O)(NO3)","Solid State Sciences","2000","2","","335","341","","","x-ray","0.71073","MoKα","","","0.048","","","0.121","","","","","","","1.078","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1519105","13.8684","0.0008","17.492","0.001","22.5","0.001","90","","102.147","0.001","90","","5336","0.5","","","293","","","","","","","","","7","P 1 n 1","P -2yac","7","","","","- C24 H134 B6 N26 O87 P12 V12 -","- C24 B6 N16 O89 P12 V12 -","- C48 B12 N32 O178 P24 V24 -","2","1","","Junghwan Do; Li-Min Zheng; Ranko P. Bontchev; Allan J. Jacobson","Synthesis, structure and magnetic properties of (NH4)2(C3H12N3)8[V2P2BO12]6.15H2O","Solid State Sciences","2000","2","","343","351","","","x-ray","0.71073","MoKα","","","0.0468","","","0.132","","","","","","","1.045","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519106","8.1527","","14.1209","","5.3243","","90","","90","","90","","612.952","","","","293","","","","","","","","","2","P m c m","-P 2c 2","51","","","","- Bi Ni0.92 -","- Bi0.75 Ni1.75 -","- Bi6 Ni14 -","8","1","","Sven Lidin; Vaclav Petricek; Lars Stenberg; Sigrid Furuseth; Helmer Fjellvag; Ann-Kristin Larsson","The incommensurately modulated structure of NiBi","Solid State Sciences","2000","2","","353","363","","","x-ray","0.71073","MoKα","","","0.077","","","0.078","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519108","7.494","0.001","7.726","0.001","17.852","0.003","90","","97.7","0.1","90","","1024.3","0.4","","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C5 H7 Co2 N O10 P -","- C5 Co2 N O10 P -","- C20 Co8 N4 O40 P4 -","4","1","","Amitava Choudhury; Srinivasan Natarajan","Inorganic hybrid open-framework structures: synthesis and structure of a cobalt phosphate-oxalate, [C4N2H12]0.5[Co2(HPO4)(C2O4)1.5]","Solid State Sciences","2000","2","","365","372","","","x-ray","0.71073","MoKα","","","0.04","","","0.1","","","","","","","1.13","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519236","10.349","0.002","12.081","0.002","15.099","0.003","91","0.03","103.07","0.03","90.72","0.03","1838.3","0.6","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H16 O3 S3 -","- C19 H16 O3 S3 -","- C76 H64 O12 S12 -","4","2","","Khan, T.; Hursthouse, Michael B.; Coles, Simon J.; Skabara, P. J.","2,4-bis(2-Methoxyphenyl)-3-oxa-6,8-dioxabicyclo(3.3.0)oct-1(5)en-7-thione","Crystal Structure Report Archive","2000","","","102","","","","","0.71073","MoKα","","0.0651","0.0412","","","0.0948","0.1038","","","","","","1.021","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519237","8.8098","0.0018","10.574","0.002","24.736","0.005","90","","90","","90","","2304.3","0.8","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C12 H12 N2 O2 S -","- C12 H12 N2 O2 S -","- C96 H96 N16 O16 S8 -","8","1","","Coles, Simon J.; Hursthouse, Michael B.; Mayer, Thomas A.; Threlfall, Terry L.","N-(4-Methyl-1H-pyridin-2-ylidene)-benzenesulfonamide","Crystal Structure Report Archive","2000","","","177","","","","","0.71073","MoKα","","0.0666","0.0441","","","0.1096","0.1208","","","","","","1.038","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519238","8.1459","0.0016","14.656","0.003","12.532","0.003","90","","105.63","0.03","90","","1440.8","0.6","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H15 N3 O3 S -","- C14 H15 N3 O3 S -","- C56 H60 N12 O12 S4 -","4","1","","Coles, Simon J.; Hursthouse, Michael B.; Mayer, Thomas A.; Threlfall, Terry L.","N-[4-(3-Methyl-1H-pyridin-2-ylidene sulfamoyl)-phenyl]-acetamide","Crystal Structure Report Archive","2000","","","179","","","","","0.71073","MoKα","","0.0929","0.0482","","","0.1201","0.1408","","","","","","1.015","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519239","10.728","0.002","14.895","0.003","14.669","0.003","90","","103.2","0.03","90","","2282.1","0.8","1510","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H12 N2 O2 S -","- C12 H12 N2 O2 S -","- C96 H96 N16 O16 S8 -","8","2","","Threlfall, Terry L.; Coles, Simon J.; Mayer, Thomas A.; Hursthouse, Michael B.","4-Methyl-N-(1H-pyridin-2-ylidene)-benzenesulfonamide","Crystal Structure Report Archive","2000","","","185","","","","","0.71073","MoKα","","0.1272","0.0547","","","0.1049","0.1285","","","","","","0.98","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519240","10.218","0.002","8.8345","0.0018","16.655","0.003","90","","99.09","0.03","90","","1484.6","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H19 N3 O4 S -","- C12 H19 N3 O4 S -","- C48 H76 N12 O16 S4 -","4","1","","Coles, Simon J.; Hursthouse, Michael B.; Mayer, Thomas A.; Threlfall, Terry L.","4-Amino-benzenesulfonamide 1-Morpholin-4-yl-ethanone solvate","Crystal Structure Report Archive","2000","","","192","","","","","0.71073","MoKα","","0.054","0.0417","","","0.1075","0.1155","","","","","","1.047","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519241","18.931","0.004","9.413","0.0019","14.701","0.003","90","","115.96","0.03","90","","2355.4","1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H12 N2 O2 S -","- C12 H12 N2 O2 S -","- C96 H96 N16 O16 S8 -","8","1","","Coles, Simon J.; Hursthouse, Michael B.; Mayer, Thomas A.; Threlfall, Terry L.","N-(3-Methyl-1H-pyridin-2-ylidene)-benzenesulfonamide","Crystal Structure Report Archive","2000","","","197","","","","","0.71073","MoKα","","0.0976","0.0481","","","0.1024","0.1205","","","","","","0.977","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519242","5.9447","0.0012","7.789","0.0016","12.333","0.003","97.75","0.03","94.54","0.03","106.5","0.03","538.4","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C13 H12 N2 O -","- C13 H12 N2 O -","- C26 H24 N4 O2 -","2","1","","Coles, Simon J.; Threlfall, Terry L.; Mayer, Thomas A.; Hursthouse, Michael B.","4-Methyl-N-pyridin-2-yl-benzamide","Crystal Structure Report Archive","2000","","","201","","","","","0.71073","MoKα","","0.0598","0.0448","","","0.1128","0.1244","","","","","","1.031","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519243","8.5829","0.0017","15.587","0.003","25.277","0.005","90","","90","","90","","3381.6","1.1","120","2","120","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C15 H25 Cl8 N9 P6 S -","- C15 H25 Cl8 N9 P6 S -","- C60 H100 Cl32 N36 P24 S4 -","4","1","","Shaw, R. A.; Davies, David B.; Kilic, A.; Ibisoglu, H.; Coles, Simon J.; Hursthouse, Michael B.","(4,4,6,6-tetrachloro-2-[(2,4-dimethylphenyl)thio]-N-[4-(2,2,4,4- tetrachloro- 1,3,5,7,11-pentaaza-2?5,4?5,6?5-triphosphaspiro[5.5] undeca-1,3,5-trien-7-yl) butyl]-1,3,5,2?5,4?5,6?5- triazatriphosphinin-2-amine (C15H25Cl8N9P6S)","Crystal Structure Report Archive","2000","","","336","","","","","0.71073","MoKα","","0.0665","0.0453","","","0.1003","0.1127","","","","","","1.033","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519244","14.845","0.003","15","0.003","9.045","0.0018","90","","115.04","0.03","90","","1824.8","0.8","150","2","150","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C21 H24 Br N O -","- C21 H24 Br N O -","- C84 H96 Br4 N4 O4 -","4","1","","Pelter, Andy; Coles, Simon J.; Hursthouse, Michael B.","C21H24BrNO","Crystal Structure Report Archive","2000","","","777","","","","","0.71073","MoKα","","0.0613","0.0481","","","0.1076","0.1159","","","","","","1.024","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519245","8.824","0.0005","8.8434","0.0005","9.1388","0.0006","94.442","0.002","100.154","0.003","94.77","0.003","696.45","0.07","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","","","- C16 H24 O12 Si8 -","- C16 H24 O12 Si8 -","- C16 H24 O12 Si8 -","1","0.5","","Taylor, Peter. G.; Gelbrich, Thomas; Hursthouse, Michael B","C16H24O12Si8","Crystal Structure Report Archive","2000","","","838","","","","","0.71073","MoKα","","0.1255","0.0568","","","0.1029","0.117","","","","","","0.914","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519246","6.9169","0.0014","21.853","0.004","6.7218","0.0013","90","","110.79","0.03","90","","949.9","0.4","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H18 Cl2 N6 O6 Pt -","- C12 H18 Cl2 N6 O6 Pt -","- C24 H36 Cl4 N12 O12 Pt2 -","2","0.5","","Azam, A.; Maurya, M. R.; Naqvi, F.; Mata-Cardenas, B. D.; Cruz-Vega, D. E.; Garza, M. T. G.; Mayer, Thomas A.; Hursthouse, Michael B.; Coles, Simon J.; Bharti, N.","trans-Dichloro-bis(1-(2-hydroxyethyl)-2-methyl-5-nitroimidazole-N3)- platinum(ii)","Crystal Structure Report Archive","2000","","","100","","","","","0.71073","MoKα","","0.048","0.0433","","","0.1192","0.1258","","","","","","1.086","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519247","10.97","0.002","12.766","0.003","11.5","0.002","90","","107.27","0.03","90","","1537.9","0.6","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H19 N3 O3 S -","- C15 H19 N3 O3 S -","- C60 H76 N12 O12 S4 -","4","1","","Threlfall, Terry L.; Coles, Simon J.; Hursthouse, Michael B.; Mayer, Thomas A.","4-Amino-N-(1H-pyridin-2-ylidene)-benzenesulfonamide and tetrahydro-furan solvate","Crystal Structure Report Archive","2000","","","183","","","","","0.71073","MoKα","","0.056","0.0419","","","0.105","0.1142","","","","","","1.034","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519248","5.5166","0.0011","8.7652","0.0018","20.695","0.004","90","","96.25","0.03","90","","994.7","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H8 N2 O2 S2 -","- C9 H8 N2 O2 S2 -","- C36 H32 N8 O8 S8 -","4","1","","Coles, Simon J.; Hursthouse, Michael B.; Mayer, Thomas A.; Threlfall, Terry L.","2-Benzenesulfonylamino-3H-thiazol-1-ylium","Crystal Structure Report Archive","2000","","","191","","","","","0.71073","MoKα","","0.0711","0.044","","","0.0988","0.1113","","","","","","1.034","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519249","6.2197","0.0012","8.1201","0.0016","12.208","0.002","103.18","0.03","91.76","0.03","104.15","0.03","579.7","0.2","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C10 H11 N3 O2 S2 -","- C10 H11 N3 O2 S2 -","- C20 H22 N6 O4 S4 -","2","1","","Coles, Simon J.; Hursthouse, Michael B.; Mayer, Thomas A.; Threlfall, Terry L.","4-Methyl-N-(5-methyl-3H-[1,3,4]thiadiazol-2-ylidene)-benzenesulfonamide","Crystal Structure Report Archive","2000","","","195","","","","","0.71073","MoKα","","0.054","0.0369","","","0.0908","0.1054","","","","","","0.669","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519250","10.273","0.0003","16.4508","0.0005","11.1879","0.0004","90","","96.538","0.002","90","","1878.45","0.1","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H17 Br Fe -","- C26 H17 Br Fe -","- C104 H68 Br4 Fe4 -","4","1","","Butler, Ian. R.; Light, Mark E.; Hursthouse, Michael B.","C26H17BrFe","Crystal Structure Report Archive","2000","","","720","","","","","0.71073","MoKα","","0.069","0.0524","","","0.1405","0.1499","","","","","","1.069","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519251","16.4884","0.0002","10.8238","0.0002","10.8189","0.0003","90","","108.896","0.001","90","","1826.76","0.07","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C19 H14 Cl N2 P S Se -","- C19 H14 Cl N2 P S Se -","- C76 H56 Cl4 N8 P4 S4 Se4 -","4","1","","Smith, Martin B.; Light, Mark E.; Hursthouse, Michael B.","C19H14ClN2PSSe","Crystal Structure Report Archive","2000","","","721","","","","","0.71073","MoKα","","0.0375","0.0304","","","0.0736","0.0772","","","","","","1.081","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519252","7.9797","0.0001","16.1834","0.0002","21.5337","0.0003","90","","90.409","0.001","90","","2780.76","0.06","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C29 H28 Cl2 Ir N2 P S2 -","- C29 H28 Cl2 Ir N2 P S2 -","- C116 H112 Cl8 Ir4 N8 P4 S8 -","4","1","","Smith, Martin B.; Light, Mark E.; Hursthouse, Michael B.","C29H28Cl2IrN2PS2","Crystal Structure Report Archive","2000","","","738","","","","","0.71073","MoKα","","0.0337","0.0271","","","0.0624","0.065","","","","","","1.033","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519253","6.5051","0.0013","10.758","0.002","16.079","0.003","100.36","0.03","101.24","0.03","93.97","0.03","1079.3","0.4","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H24 Cl2 N4 O4 -","- C21 H24 Cl2 N4 O4 -","- C42 H48 Cl4 N8 O8 -","2","1","","Jones, Ray; Coles, Simon J.; Hursthouse, Michael B.","C21H24Cl2N4O4","Crystal Structure Report Archive","2000","","","773","","","","","0.71073","MoKα","","0.0767","0.0449","","","0.1053","0.1182","","","","","","1.035","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519254","6.2157","0.0012","9.6972","0.0019","11.921","0.002","89.14","0.03","79.65","0.03","81.51","0.03","699.1","0.2","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C8 H22 O5 Si2 -","- C8 H22 O5 Si2 -","- C16 H44 O10 Si4 -","2","1","","Taylor, Peter. G.; Coles, Simon J.; Hursthouse, Michael B.","C8H22O5Si2","Crystal Structure Report Archive","2000","","","774","","","","","0.71073","MoKα","","0.0602","0.0443","","","0.1168","0.1264","","","","","","1.065","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519255","7.9054","0.0003","10.5443","0.0004","5.9511","0.0002","90","","90","","90","","496.07","0.03","150","2","150","2","","","","","","","","3","P n a 21","P 2c -2n","33","","","","- Cl H5 O6 -","- Cl H5 O6 -","- Cl4 H20 O24 -","4","1","","Ward, Robert S.; Gelbrich, Thomas; Hursthouse, Michael B.","ClH5O6","Crystal Structure Report Archive","2000","","","825","","","","","0.71073","MoKα","","0.0376","0.0374","","","0.097","0.0971","","","","","","1.663","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519256","13.1826","0.0002","12.8268","0.0002","16.4122","0.0003","90","","105.964","0.001","90","0.001","2668.12","0.08","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C20 H19 Br Cl6 Cu D2 N3 -","- C20 H19 Br Cl6 Cu D2 N3 -","- C80 H76 Br4 Cl24 Cu4 D8 N12 -","4","1","","Eastham, G.; Hursthouse, Michael B.; Light, Mark E.; Kleinhenz, S.; Danopoulos, A. A.; Tulloch, A. A. D.","catena-((I(1/4)2-3-(Mesityl)-1-((pyrid-2-yl)methyl)imidazol-2-ylidene-C,N)- bromo-copper(i) deuterochloroform solvate)","Crystal Structure Report Archive","2000","","","115","","","","","0.71073","MoKα","","0.1755","0.056","","","0.1144","0.1528","","","","","","0.922","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519257","7.4172","0.0004","21.242","0.0006","5.6592","0.0017","90","","90","","90","","891.6","0.3","150","2","150","2","","","","","","","","3","P c c n","-P 2ab 2ac","56","","","","- C10 H8 S2 -","- C10 H8 S2 -","- C40 H32 S8 -","4","0.5","","Murphy, Patrick J.; Light, Mark E.; Hursthouse, Michael B.","C10H8S2","Crystal Structure Report Archive","2000","","","733","","","","","0.71073","MoKα","","0.0582","0.0423","","","0.1115","0.1205","","","","","","1.043","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519258","14.9089","0.0003","11.4831","0.0002","16.9207","0.0003","90","","100.345","0.001","90","","2849.74","0.09","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C30 H24 N4 P2 Pt S2 -","- C30 H24 N4 P2 Pt S2 -","- C120 H96 N16 P8 Pt4 S8 -","4","1","","Smith, Martin B.; Light, Mark E.; Hursthouse, Michael B.","C30H24N4P2PtS2","Crystal Structure Report Archive","2000","","","735","","","","","0.71073","MoKα","","0.0387","0.0311","","","0.0753","0.0791","","","","","","1.037","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519259","8.7176","0.0001","13.4265","0.0002","16.1511","0.0004","95.555","0.001","101.99","0.001","104.518","0.001","1767.88","0.06","150","2","150","2","","","","","","","","3","P -1","-P 1","2","","","","- C20 H24 N4 -","- C20 H24 N4 -","- C80 H96 N16 -","4","2","","Bell, Norman A.; Light, Mark E.; Hursthouse, Michael B.","C20H24N4","Crystal Structure Report Archive","2000","","","736","","","","","0.71073","MoKα","","0.0671","0.0408","","","0.094","0.1062","","","","","","0.992","","","","has coordinates","188564","2020-10-21","18:00:00",""
"1519260","13.4814","0.0003","7.2705","0.0002","17.7911","0.0004","90","","94.266","0.001","90","","1738.99","0.07","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C20 H20 O6 -","- C20 H20 O6 -","- C80 H80 O24 -","4","1","","Ward, Robert S.; Light, Mark E.; Hursthouse, Michael B.","C20H20O6","Crystal Structure Report Archive","2000","","","737","","","","","0.71073","MoKα","","0.0432","0.0349","","","0.087","0.0919","","","","","","1.041","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519261","7.1328","0.0014","20.699","0.004","7.1455","0.0014","90","","116.17","0.03","90","","946.8","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H18 Cl2 N6 O6 Pd -","- C12 H18 Cl2 N6 O6 Pd -","- C24 H36 Cl4 N12 O12 Pd2 -","2","0.5","","Maurya, M. R.; Naqvi, F.; Mata-Cardenas, B. D.; Cruz-Vega, D. E.; Garza, M. T. G.; Mayer, Thomas A.; Hursthouse, Michael B.; Coles, Simon J.; Bharti, N.; Azam, A.","trans-Dichloro-bis(1-(2'-hydroxyethyl)-2-methyl-5-nitroimidazole-N3)- palladium(ii)","Crystal Structure Report Archive","2000","","","99","","","","","0.71073","MoKα","","0.0298","0.0229","","","0.0538","0.0572","","","","","","0.959","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519262","10.647","0.002","17.517","0.004","16.715","0.003","90","","105.06","0.03","90","","3010.3","1.1","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C33 H30 Cl N O3 P2 Pt -","- C33 H30 Cl N O3 P2 Pt -","- C132 H120 Cl4 N4 O12 P8 Pt4 -","4","1","","Smith, Martin B.; Coles, Simon J.; Hursthouse, Michael B.","C33H30ClNO3P2Pt","Crystal Structure Report Archive","2000","","","1013","","","","","0.71073","MoKα","","0.0423","0.0363","","","0.1003","0.1076","","","","","","0.871","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519263","10.223","0.002","17.348","0.004","19.475","0.004","90","","94.73","0.03","90","","3442.1","1.3","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C19 H14 Cl N2 P S -","- C19 H14 Cl N2 P S -","- C152 H112 Cl8 N16 P8 S8 -","8","1","","Smith, Martin B.; Coles, Simon J.; Hursthouse, Michael B.","C19H14ClN2PS","Crystal Structure Report Archive","2000","","","1027","","","","","0.71073","MoKα","","0.052","0.038","","","0.112","0.125","","","","","","0.948","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519264","8.6514","0.0012","8.6514","0.0012","20.538","0.004","90","","90","","90","","1537.2","0.4","150","2","150","2","","","","","","","","5","P 41","P 4w","76","","","","- C14 H14 N4 O2 S2 -","- C14 H14 N4 O2 S2 -","- C56 H56 N16 O8 S8 -","4","1","","Coles, Simon J.; Hursthouse, Michael B.; Mayer, Thomas A.; Threlfall, Terry L.","2-(4-Amino-benzenesulfonylamino)-3H-thiazol-1-ylium and pyridine solvate","Crystal Structure Report Archive","2000","","","184","","","","","0.71073","MoKα","","0.0353","0.031","","","0.0714","0.0747","","","","","","1.038","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519265","12.179","0.002","9.6098","0.0019","13.353","0.003","90","","101.92","0.03","90","","1529.1","0.5","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H17 N5 O2 S2 -","- C13 H17 N5 O2 S2 -","- C52 H68 N20 O8 S8 -","4","1","","Coles, Simon J.; Hursthouse, Michael B.; Mayer, Thomas A.; Threlfall, Terry L.","2-(4-Amino-benzenesulfonylamino)-3H-thiazol-1-ylium 2-Methyl-imidazolidine solvate","Crystal Structure Report Archive","2000","","","194","","","","","0.71073","MoKα","","0.0436","0.0347","","","0.0863","0.0917","","","","","","1.034","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519266","10.7087","0.001","11.4437","0.0013","13.708","0.0015","110.139","0.004","91.011","0.004","96.298","0.004","1564.9","0.3","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C9 H14 Cl2 O -","- C9 H14 Cl2 O -","- C54 H84 Cl12 O6 -","6","3","","Gelbrich, Thomas; Peron, G.; Hursthouse, Michael B.; Kilburn, Jeremy D.","1,7-Dichloro-3-methyl-bicyclo[4.2.0]octan-3-ol","Crystal Structure Report Archive","2000","","","402","","","","","0.71073","MoKα","","0.1259","0.0611","","","0.1194","0.1309","","","","","","1.061","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519267","11.7383","0.0003","10.1001","0.0002","21.5543","0.0007","90","","92.982","0.009","90","","2551.97","0.12","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C14 H20 O2 -","- C14 H20 O2 -","- C112 H160 O16 -","8","2","","Gelbrich, Thomas; Watson, Faye; Hursthouse, Michael B.; Kilburn, Jeremy D.","4-Methylene-1-(2-methylene-cyclopropyl)-octahydro-isochromen-4a-ol","Crystal Structure Report Archive","2000","","","403","","","","","0.71073","MoKα","","0.1375","0.0533","","","0.0946","0.1063","","","","","","1.027","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519268","7.515","0.0002","9.3921","0.0002","30.7365","0.0002","90","","90","","90","","2169.43","0.08","150","2","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C11 H15 B O2 -","- C11 H15 B O2 -","- C88 H120 B8 O16 -","8","1","","Gelbrich, Thomas; Sampson, David; Hursthouse, Michael B.","(E)-5-Phenyl-pent-1-enyl-boronic acid","Crystal Structure Report Archive","2000","","","528","","","","","","","","0.1058","0.0547","","","0.1241","0.1393","","","","","","0.92","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519269","10.9623","0.0004","10.1397","0.0004","11.9175","0.0005","90","","92.078","0.002","90","","1323.81","0.09","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H16 O6 S -","- C12 H16 O6 S -","- C48 H64 O24 S4 -","4","1","","Gelbrich, Thomas; Lucas, Matthew; Hursthouse, Michael B.; Harrowven, David C.","6a-Methyl-2,3,3-trioxo-octahydro-1-oxa-3lamda*6*-thia-cyclopenta[cd]pentalene- 6b-carboxylic acid ethyl ester","Crystal Structure Report Archive","2000","","","533","","","","","","MoKα","","0.0522","0.0384","","","0.0786","0.083","","","","","","1.04","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519270","7.9022","0.0003","10.6116","0.0004","15.3911","0.0008","104.376","0.0017","91.507","0.0015","90.616","0.002","1249.58","0.09","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H31 N O6 Si -","- C25 H31 N O6 Si -","- C50 H62 N2 O12 Si2 -","2","1","","Gelbrich, Thomas; Peron, G.; Hursthouse, Michael B.; Kilburn, Jeremy D.","4-Nitrobenzoic acid 2-[4-(hydroxy-dimethyl-silanyl)-1-methyl-3-methylene-4- phenyl-cyclohexyloxy]-ethyl ester","Crystal Structure Report Archive","2000","","","534","","","","","0.71073","MoKα","","0.2022","0.0727","","","0.1133","0.1274","","","","","","1.22","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519271","11.5628","0.0005","12.1797","0.0005","14.6529","0.0008","80.292","0.002","72.282","0.002","81.472","0.002","1927.19","0.16","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H19 Fe N3 O2 -","- C23 H19 Fe N3 O2 -","- C92 H76 Fe4 N12 O8 -","4","2","","Tucker, James H. R.; Light, Mark E.; Hursthouse, Michael B.","C23H19FeN3O2","Crystal Structure Report Archive","2000","","","730","","","","","0.71073","MoKα","","0.1844","0.0664","","","0.1176","0.1567","","","","","","0.907","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519272","9.2288","0.0018","20.362","0.004","7.6375","0.0015","90","","91","0.03","90","","1435","0.5","150","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H17 F3 O2 -","- C16 H17 F3 O2 -","- C64 H68 F12 O8 -","4","1","","Metwally, R. N.; Salem, E. E. -D. M.; El-Sagheer, A. H.; Mellor, J. M.; Coles, Simon J.","2-(3,4-Dihydro-2H-pyran-5-yl)-1,1,1-trifluoro-3-phenylpent-4-en-2-ol","Crystal Structure Report Archive","2000","","","78","","","","","0.71073","MoKα","","0.086","0.0571","","","0.1599","0.1774","","","","","","1.136","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519273","14.5002","0.0003","13.4816","0.0003","7.0091","0.0001","90","","90","","90","","1370.18","0.05","150","2","150","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C13 H10 O S4 -","- C13 H10 O S4 -","- C52 H40 O4 S16 -","4","0.5","","Murphy, P. J.; Gelbrich, Thomas; Hursthouse, Michael B.","C13H10OS4","Crystal Structure Report Archive","2000","","","824","","","","","0.71073","MoKα","","0.0426","0.038","","","0.1019","0.1049","","","","","","1.08","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519274","9.54","0.0019","13.248","0.003","28.592","0.006","90","","98.73","0.03","90","","3571.8","1.3","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C44 H45 O4 Sb -","- C44 H45 O4 Sb -","- C176 H180 O16 Sb4 -","4","1","","Hursthouse, Michael B.; Costello, J. F.; Coles, Simon J.; Barucki, H.","(RR,SS,RS)-Triphenyl-bis(2-cyclopentyl-2-phenylacetato-O)-antimony(v)","Crystal Structure Report Archive","2000","","","93","","","","","0.71073","MoKα","","0.0778","0.0577","","","0.1866","0.1945","","","","","","1.43","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519275","7.9539","0.0016","9.5523","0.0019","10.695","0.002","97.61","0.03","110.44","0.03","104.17","0.03","716.7","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H14 Br F3 O2 -","- C14 H14 Br F3 O2 -","- C28 H28 Br2 F6 O4 -","2","1","","Hursthouse, Michael; Coles, Simon J.","3-(4-Bromophenyl)-2-(3,4-dihydro-2H-pyran-5-yl)-1,1,1-trifluoropropan-2-ol","Crystal Structure Report Archive","2000","","","98","","","","","0.71073","MoKα","","0.1379","0.0576","","","0.1393","0.1797","","","","","","1.002","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519276","12.732","0.003","13.131","0.003","13.04","0.003","90","","96.88","0.03","90","","2164.4","0.9","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H20 O5 S3 -","- C21 H20 O5 S3 -","- C84 H80 O20 S12 -","4","1","","Hursthouse, Michael B.; Coles, Simon J.; Skabara, P. J.; Khan, T.","4-Formyl-5-bis(2,4-dimethoxyphenyl)methyl-1,3-dithiole-2-thione","Crystal Structure Report Archive","2000","","","105","","","","","0.71073","MoKα","","0.1006","0.0493","","","0.122","0.1432","","","","","","0.991","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519277","18.175","0.004","8.1029","0.0016","16.535","0.003","90","","91.08","0.03","90","","2434.7","0.8","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H13 N3 O2 S -","- C12 H13 N3 O2 S -","- C96 H104 N24 O16 S8 -","8","1","","Coles, Simon J.; Hursthouse, Michael B.; Mayer, Thomas A.; Threlfall, Terry L.","4-Amino-N-(3-methyl-1H-pyridin-2-ylidene)-benzenesulfonamide","Crystal Structure Report Archive","2000","","","178","","","","","0.71073","MoKα","","0.0471","0.0374","","","0.0979","0.1041","","","","","","1.053","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519278","15.837","0.003","8.6247","0.0017","18.643","0.004","90","","94.14","0.03","90","","2539.8","0.9","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H13 N3 O2 S -","- C12 H13 N3 O2 S -","- C96 H104 N24 O16 S8 -","8","1","","Coles, Simon J.; Hursthouse, Michael B.; Mayer, Thomas A.; Threlfall, Terry L.","4-Amino-N-(4-methyl-1H-pyridin-2-ylidene)-benzenesulfonamide","Crystal Structure Report Archive","2000","","","180","","","","","0.71073","MoKα","","0.104","0.049","","","0.1077","0.1276","","","","","","1.008","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519279","13.681","0.003","5.8449","0.0012","14.859","0.003","90","","114.97","0.03","90","","1077.1","0.5","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H10 N4 O2 S -","- C10 H10 N4 O2 S -","- C40 H40 N16 O8 S4 -","4","1","","Coles, Simon J.; Hursthouse, Michael B.; Mayer, Thomas A.; Threlfall, Terry L.","4-Amino-N-pyrimidin-2-yl-benzenesulfonamide","Crystal Structure Report Archive","2000","","","186","","","","","0.71073","MoKα","","0.0527","0.0389","","","0.0973","0.1062","","","","","","1.045","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519280","6.0265","0.0012","7.9404","0.0016","12.193","0.002","82.26","0.03","89.81","0.03","88.35","0.03","577.91","0.19","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C11 H11 N3 O2 S -","- C11 H11 N3 O2 S -","- C22 H22 N6 O4 S2 -","2","1","","Coles, Simon J.; Hursthouse, Michael B.; Mayer, Thomas A.; Threlfall, Terry L.","N-(2,5-Dihydro-pyrimidine-2-yl)-4-methyl-benzenesulfonamide","Crystal Structure Report Archive","2000","","","105","","","","","0.71073","MoKα","","0.0534","0.0418","","","0.1083","0.1176","","","","","","1.053","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519281","11.748","0.002","5.9187","0.0012","14.655","0.003","90","","99.3","0.03","90","","1005.6","0.3","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H9 N3 O2 S -","- C10 H9 N3 O2 S -","- C40 H36 N12 O8 S4 -","4","1","","Coles, Simon J.; Hursthouse, Michael B.; Mayer, Thomas A.; Threlfall, Terry L.","N-(1,4-Dihydro-pyrimidin-2-yl)-benzenesulfonamide","Crystal Structure Report Archive","2000","","","188","","","","","0.71073","MoKα","","0.0689","0.0432","","","0.102","0.1138","","","","","","1.019","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519282","6.5117","0.0013","7.9405","0.0016","11.213","0.002","75.67","0.03","86.6","0.03","75.93","0.03","544.9","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C9 H9 N3 O2 S2 -","- C9 H9 N3 O2 S2 -","- C18 H18 N6 O4 S4 -","2","1","","Coles, Simon J.; Hursthouse, Michael B.; Mayer, Thomas A.; Threlfall, Terry L.","N-(5-Methyl-3H-[1,3,4]thiadiazol-2-ylidene)-benzenesulfonamide","Crystal Structure Report Archive","2000","","","190","","","","","0.71073","MoKα","","0.0432","0.0355","","","0.0951","0.1005","","","","","","1.069","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519283","10.778","0.002","15.436","0.003","15.688","0.003","90","","102.46","0.03","90","","2548.5","0.9","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H14 N2 O2 S -","- C13 H14 N2 O2 S -","- C104 H112 N16 O16 S8 -","8","2","","Coles, Simon J.; Hursthouse, Michael B.; Mayer, Thomas A.; Threlfall, Terry L.","4-Methyl-N-(4-methyl-1H-pyridin-2-ylidene)-benzenesulfonamide","Crystal Structure Report Archive","2000","","","193","","","","","0.71073","MoKα","","0.2038","0.057","","","0.0976","0.1342","","","","","","0.911","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519284","8.8031","0.0018","9.6811","0.0019","10.862","0.002","83.99","0.03","71.84","0.03","78.35","0.03","860.6","0.3","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H20 N3 O4 S -","- C16 H20 N3 O4 S -","- C32 H40 N6 O8 S2 -","2","1","","Coles, Simon J.; Hursthouse, Michael B.; Mayer, Thomas A.; Threlfall, Terry L.","4-Amino-N-Pyridin-2-yl-benzenesulfonamide with Formic acid butyl ester","Crystal Structure Report Archive","2000","","","196","","","","","0.71073","MoKα","","0.0644","0.0476","","","0.122","0.1335","","","","","","0.958","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519285","8.9541","0.0002","7.1843","0.0002","19.1662","0.0002","90","","98.162","0.001","90","","1220.45","0.05","296","2","296","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C13 H22 O2 -","- C13 H22 O2 -","- C52 H88 O8 -","4","1","","Gelbrich, Thomas; Peron, G.; Hursthouse, Michael B.; Kilburn, Jeremy D.","4,4-Dimethyl-3-methylideneoctahydronaphthalene-2,4a(2H)-diol","Crystal Structure Report Archive","2000","","","404","","","","","0.71073","MoKα","","0.1003","0.049","","","0.1011","0.1134","","","","","","0.945","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519286","18.5858","0.001","7.649","0.0003","8.0285","0.0004","90","","90","","90","","1141.35","0.09","150","2","150","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","","","","- C9 H20 N2 O3 -","- C9 H20 N2 O3 -","- C36 H80 N8 O12 -","4","1","","Gelbrich, Thomas; Shepherd, Emma; Hursthouse, Michael B.; Kilburn, Jeremy D.","N,N,N-Trimethylmethanaminium 2-(acetylamino)propanoate","Crystal Structure Report Archive","2000","","","405","","","","","0.71073","MoKα","","0.052","0.0385","","","0.092","0.097","","","","","","1.052","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519287","7.783","0.0007","7.4943","0.0008","18.919","0.002","90","","90.027","0.004","90","","1103.51","0.19","150","2","150","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C24 H29 O8 -","- C24 H29 O8 -","- C48 H58 O16 -","2","1","","Ward, Robert S.; Light, Mark E.; Hursthouse, Michael B","C24H29O8","Crystal Structure Report Archive","2000","","","732","","","","","0.71073","MoKα","","0.0844","0.0535","","","0.1174","0.1293","","","","","","0.998","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519288","8.342","0.0017","12.846","0.003","22.736","0.005","90","","90","","90","","2436.4","0.9","150","2","150","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C26 H30 O9 -","- C26 H30 O9 -","- C104 H120 O36 -","4","1","","Ward, Robert S.; Coles, Simon J.; Hursthouse, Michael B.","C26H30O9","Crystal Structure Report Archive","2000","","","105","","","","","0.71073","MoKα","","0.0658","0.0427","","","0.0957","0.105","","","","","","1.09","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519289","20.426","0.004","5.5841","0.0011","25.536","0.005","90","","93.05","0.03","90","","2908.5","1","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C15 H17 F3 O3 -","- C15 H17 F3 O3 -","- C120 H136 F24 O24 -","8","1","","Metwally, R. N.; Salem, E. E. -D. M.; El-Sagheer, A. H.; Mellor, J. M.; Coles, Simon J.","cis-2,2,2,-Trifluoro-1-(2-(p-methoxybenzyl)-tetrahydro-2H-pyran-3-yl)-1- ethanone","Crystal Structure Report Archive","2000","","","79","","","","","0.71073","MoKα","","0.1169","0.0491","","","0.1236","0.1587","","","","","","0.895","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519290","11.862","0.002","17.91","0.004","24.123","0.005","90","","90.95","0.03","90","","5124.2","1.8","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H22 Fe N4 O3 -","- C28 H22 Fe N4 O3 -","- C224 H176 Fe8 N32 O24 -","8","1","","Light, Mark E.; Hursthouse, Michael B.; Green, S. J.; Gasser, G.; Collinson, S. R.; Coles, Simon J.; Westwood, J.; Tucker, J. H. R.","1,3-(((6-Methylpyrid-2-yl)amino)carbonyl)ferrocene diethylether solvate","Crystal Structure Report Archive","2000","","","84","","","","","0.71073","MoKα","","0.1144","0.0623","","","0.1642","0.1872","","","","","","1.121","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1520483","5.636","0.001","6.151","0.001","6.498","0.001","90.52","0.01","90.62","0.01","107.43","0.01","214.89","0.06","","","293","","","","","","","","","5","P -1","-P 1","2","","","","- C4 H13 F6 Mn N2 -","- C4 H13 F6 Mn N2 -","- C4 H13 F6 Mn N2 -","1","0.5","","U. Bentrup; K. Harms; W. Massa; J. Pebler","Magnetic exchange interaction via HF2‒bridges? Structure and magnetism of pipzH2[MnF4(HF2)]","Solid State Sciences","2000","2","","373","377","10.1016/S1293-2558(00)00138-2","","x-ray","0.71073","MoKα","","","0.0233","","","0.0568","","","","","","","1.237","","","","has coordinates","183819","2020-10-21","18:00:00",""
"1520500","11.89","0.003","6.929","0.003","12.095","0.004","90","","90","","90","","996.5","0.6","","","293","","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- As Ba H8 N O2 S4 -","- As Ba H8 N O2 S4 -","- As4 Ba4 H32 N4 O8 S16 -","4","0.5","","Michael B. Korzenski; George L. Schimek; Joseph W. Kolis","Hydrothermal synthesis and characterization of a new hydrated ammonium barium thioarsenate: (NH4)BaAsS4.2H2O","Solid State Sciences","2000","2","","379","383","","","x-ray","0.71073","MoKα","","","0.023","","","0.0307","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520501","19.1418","0.0005","8.5274","0.0002","14.545","0.0001","90","","104.543","0.002","90","","2298.11","0.08","","","296","","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C6 H23 Al3 N4 O17 P4 -","- C6 H16 Al3 N4 O17 P4 -","- C24 H64 Al12 N16 O68 P16 -","4","1","","N. Simon; T. Loiseau; G. Ferey","Synthesis and crystal structure of MIL-32: a new chiral layered aluminophosphate templated with non chiral tris(2-aminoethyl)amine: Al3(PO4)4, N4C6H21, H2O","Solid State Sciences","2000","2","","391","397","","","x-ray","0.71073","MoKα","","","0.0712","","","0.1703","","","","","","","1.037","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1520503","15.258","0.003","19.696","0.004","11.578","0.005","90","","89.93","0.02","90","","3479.4","1.8","","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H22 N2 O7 P2 -","- C14 N2 O7 P2 -","- C112 N16 O56 P16 -","8","2","","S Akriche; M Rzaigui","Synthesis and crystal structure of (o-CH3C6H4NH3)2H2P2O7","Solid State Sciences","2000","2","","399","405","","","x-ray","0.71073","MoKα","","","0.049","","","0.052","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1520508","4.10811","0.00008","4.10811","0.00008","27.988","0.001","90","","90","","90","","472.34","0.02","","","293","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","","","- Bi I O3 Te -","- Bi0.5 I0.5 O1.5 Te0.5 -","- Bi4 I4 O12 Te4 -","8","0.5","","Peter S. Berdonosov; Dmitry O. Charkin; Ardak M. Kusainova; Charles H. Hervoches; Valeriy A. Dolgikh; Philip Lightfoot","The crystal structures of BiTeO3I, NdTeO3X (X=Cl, Br) and Bi5TeO8.5I2: some crystal chemistry peculiarities of layered Bi(Ln)Te oxyhalides","Solid State Sciences","2000","2","","553","562","","powder diffraction","x-ray","1.54056","CuKα1","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1520509","4.06603","0.00007","4.06603","0.00007","26.922","0.001","90","","90","","90","","445.09","0.02","","","293","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","","","- Br Nd O3 Te -","- Br0.5 Nd0.5 O1.5 Te0.5 -","- Br4 Nd4 O12 Te4 -","8","0.5","","Peter S. Berdonosov; Dmitry O. Charkin; Ardak M. Kusainova; Charles H. Hervoches; Valeriy A. Dolgikh; Philip Lightfoot","The crystal structures of BiTeO3I, NdTeO3X (X=Cl, Br) and Bi5TeO8.5I2: some crystal chemistry peculiarities of layered Bi(Ln)Te oxyhalides","Solid State Sciences","2000","2","","553","562","","powder diffraction","neutron","","white","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1520510","4.08096","0.00008","4.03441","0.00008","25.7582","0.0007","90","","90","","90","","424.09","0.017","","","293","","","","","","","","","4","P m m n :2","-P 2ab 2a","59","","","","- Cl Nd O3 Te -","","","8","1","","Peter S. Berdonosov; Dmitry O. Charkin; Ardak M. Kusainova; Charles H. Hervoches; Valeriy A. Dolgikh; Philip Lightfoot","The crystal structures of BiTeO3I, NdTeO3X (X=Cl, Br) and Bi5TeO8.5I2: some crystal chemistry peculiarities of layered Bi(Ln)Te oxyhalides","Solid State Sciences","2000","2","","553","562","","powder diffraction","neutron","","white","","","","","","","","","","","","","","","","","","191028","2020-10-21","18:00:00",""
"1520511","5.6878","0.0003","5.723","0.0003","9.726","0.0006","90","","90","","90","","316.59","0.03","","","293","","","","","","","","","4","C m m 2","C 2 -2","35","","","","- Bi5 I2 O8.5 Te -","- Bi5 I2 O8.5 Te -","- Bi5 I2 O8.5 Te -","1","0.125","","Peter S. Berdonosov; Dmitry O. Charkin; Ardak M. Kusainova; Charles H. Hervoches; Valeriy A. Dolgikh; Philip Lightfoot","The crystal structures of BiTeO3I, NdTeO3X (X=Cl, Br) and Bi5TeO8.5I2: some crystal chemistry peculiarities of layered Bi(Ln)Te oxyhalides","Solid State Sciences","2000","2","","553","562","","powder diffraction","neutron","","white","","","","","","","","","","","","","","","","","has coordinates","139077","2020-10-21","18:00:00",""
"1520512","36.943","0.002","8.1028","0.0003","12.6415","0.0008","90","","98.858","0.007","90","","3739","0.3","","","200","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- Rb6 S25 Ta4 -","- Rb6 S25 Ta4 -","- Rb24 S100 Ta16 -","4","0.5","","Petra Stoll; Christian Nather; Inke Jeb; Wolfgang Bensch","Synthesis, crystal structure and optical properties of the new tantalum polysulfide Rb6Ta4S25 and its thermal degradation to Rb6Ta4S22","Solid State Sciences","2000","2","","563","568","","","x-ray","0.71073","MoKα","","","0.0276","","","0.0714","","","","","","","1.034","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1520541","20.171","0.002","10.558","0.001","9.676","0.001","90","","90","","90","","2060.7","0.4","","","293","","","","","","","","","4","P c c a","-P 2a 2ac","54","","","","- Cu4 O21 P6 Tl4 -","- Cu4 O21 P6 Tl4 -","- Cu16 O84 P24 Tl16 -","4","0.5","","M Fakhfakh; S Ammar-Merah; N Jouini","The compound Tl4Cu4(P2O7)3, a new three-dimensional structure with interconnected tunnels","Solid State Sciences","2000","2","","587","594","10.1016/S1293-2558(00)01060-8","","x-ray","0.71073","MoKα","","","0.04","","","0.093","","","","","","","1.103","","","","has coordinates","139214","2020-10-21","18:00:00",""
"1520770","3.7921","","3.7921","","4.0515","","90","","90","","90","","58.261","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","(La0.813 Sr0.187) Cu (O1.92 F1.08)","","- Cu F1.08 La0.813 O1.92 Sr0.187 -","- Cu F1.08 La0.813 O1.92 Sr0.187 -","- Cu F1.08 La0.813 O1.92 Sr0.187 -","1","0.0625","","Abakumov, A.M.; Rozova, M.G.; Hadermann, J.; Pavljuk, B.P.; Antipov, E.V.; van Tendeloo, G.; Lebedev, O.I.","Synthesis and crystal structure of a new complex oxyfluoride La0.813 Sr0.187 Cu (O, F)3-d","Journal of Solid State Chemistry","2000","149","","189","196","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520772","3.89","","14.18","","3.718","","90","","90","","90","","205.086","","","","","","","","","","","","","3","C m c m","-C 2c 2","63","","","","- H0.28 Mo O3 -","- H0.28 Mo O3 -","- H1.12 Mo4 O12 -","4","0.25","","Adams, S.","CDW superstructures in hydrogen molybdenum bronzes Hx Mo O3","Journal of Solid State Chemistry","2000","149","","75","87","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1520773","14.543","","3.852","","3.7691","","90","","90.73","","90","","211.126","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","","","- H0.6 Mo O3 -","- H0.6 Mo O3 -","- H2.4 Mo4 O12 -","4","0.5","","Adams, S.","CDW superstructures in hydrogen molybdenum bronzes Hx Mo O3","Journal of Solid State Chemistry","2000","149","","75","87","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1520774","4.3954","","4.3954","","41.606","","90","","90","","120","","696.119","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Sn Bi2 Te4","","- Bi2 Sn Te4 -","- Bi2 Sn Te4 -","- Bi6 Sn3 Te12 -","3","0.0833333","","Adouby, K.; Abba Toure, A.; Kra, G.; Olivier-Fourcade, J.; Vicente, C.P.; Jumas, J.C.","Phase diagram and local environment of Sn and Te: Sn Te - Bi and Sn Te - Bi2 Te3 systems","C.R. Acad. Sci. Paris, T. 1, Serie II","2000","3","","51","58","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520775","14.3479","","14.3479","","14.3479","","90","","90","","90","","2953.69","","","","","","","","","","","","","4","I -4 3 d","I -4bd 2c 3","220","","Na1.5 Pb0.75 (P Se4)","","- Na1.5 P Pb0.75 Se4 -","- Na1.5 P Pb0.75 Se4 -","- Na24 P16 Pb12 Se64 -","16","0.333333","","Aitken, J.A.; Marking, G.A.; Evain, M.; Kanatzidis, M.G.; Iordanidis, L.","Flux synthesis and isostructural relationship of cubic Na1.5 Pb0.75 P Se4, Na0.5 Pb1.75 Ge S4 and Li0.5 Pb1.75 Ge S4","Journal of Solid State Chemistry","2000","153","","158","169","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520776","14.115","","14.115","","14.115","","90","","90","","90","","2812.18","","","","","","","","","","","","","4","I -4 3 d","I -4bd 2c 3","220","","Na0.5 Pb1.75 (Ge S4)","","- Ge Na0.5 Pb1.75 S4 -","- Ge Na0.4995 Pb1.7505 S4 -","- Ge16 Na7.992 Pb28.008 S64 -","16","0.333333","","Aitken, J.A.; Marking, G.A.; Iordanidis, L.; Evain, M.; Kanatzidis, M.G.","Flux synthesis and isostructural relationship of cubic Na1.5 Pb0.75 P Se4, Na0.5 Pb1.75 Ge S4 and Li0.5 Pb1.75 Ge S4","Journal of Solid State Chemistry","2000","153","","158","169","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520777","14.0163","","14.0163","","14.0163","","90","","90","","90","","2753.6","","","","","","","","","","","","","4","I -4 3 d","I -4bd 2c 3","220","","Li0.5 Pb1.75 (Ge S4)","","- Ge Li0.5 Pb1.75 S4 -","- Ge Li0.4995 Pb1.7505 S4 -","- Ge16 Li7.992 Pb28.008 S64 -","16","0.333333","","Aitken, J.A.; Marking, G.A.; Kanatzidis, M.G.; Evain, M.; Iordanidis, L.","Flux synthesis and isostructural relationship of cubic Na1.5 Pb0.75P Se4, Na0.5 Pb1.75 Ge S4 and Li0.5 Pb1.75 Ge S4","Journal of Solid State Chemistry","2000","153","","158","169","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520784","5.3627","","5.3627","","5.3627","","90","","90","","90","","154.223","","","","","","","","","","","","","3","P m -3 n","-P 4n 2 3","223","","Nb3 (Al0.84 Nb0.16) D2.52","","- Al0.84 D2.52 Nb3.16 -","- Al0.84 D2.519 Nb3.16 -","- Al1.68 D5.038 Nb6.32 -","2","0.0416667","","Andersson, Y.; Rundqvist, S.; Nolang, B.; Larsson, T.","Neutron powder diffraction investigations of Nb3 (Al0.84 Nb0.16) and Nb3 (Al0.84 Nb0.16) (2)H2.52","Journal of Alloys Compd.","2000","306","","193","196","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520785","8.469","","8.469","","8.469","","90","","90","","90","","607.43","","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Co (Co1.5 Sb0.5) O4","","- Co2.5 O4 Sb0.5 -","- Co2.5 O4 Sb0.5 -","- Co20 O32 Sb4 -","8","0.0416667","","Antic, B.; Tellgren, R.; Rodic, D.; Rundlof, H.","Neutron diffraction study of the magnetic and structure properties of Co2.50 Sb0.50 O4 spinel","Journal of Magnetism and Magnetic Materials","2000","219","","41","44","","","","","","","","","","","","","","","","","","","","","","has coordinates","140329","2020-10-21","18:00:00",""
"1520787","2.8709","","2.8709","","14.179","","90","","90","","120","","101.207","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","(Li0.97 Ni0.03) (Li0.04 Ni0.86 Mn0.1) O2","","- Li1.01 Mn0.1 Ni0.89 O2 -","- Li1.01 Mn0.1 Ni0.89 O2 -","- Li3.03 Mn0.3 Ni2.67 O6 -","3","0.0833333","","Arai, H.; Tsuda, M.; Sakurai, Y.","Lithium nickelate electrodes with enhanced high-temperature performance and thermal stability","Journal of Power Sources","2000","90","","76","81","","","","","","","","","","","","","","","","","","","","","","has coordinates","140331","2020-10-21","18:00:00",""
"1520788","2.8766","","2.8766","","14.215","","90","","90","","120","","101.868","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","(Li0.98 Ni0.02) (Li0.04 Ni0.86 Ti0.1) O2","","- Li1.02 Ni0.88 O2 Ti0.1 -","- Li1.02 Ni0.88 O2 Ti0.1 -","- Li3.06 Ni2.64 O6 Ti0.3 -","3","0.0833333","","Arai, H.; Tsuda, M.; Sakurai, Y.","Lithium nickelate electrodes with enhanced high-temperature performance and thermal stability","Journal of Power Sources","2000","90","","76","81","","","","","","","","","","","","","","","","","","","","","","has coordinates","140332","2020-10-21","18:00:00",""
"1520789","2.8645","","2.8645","","14.161","","90","","90","","120","","100.629","","","","","","","","","","","","","5","R -3 m :H","-R 3 2""","166","","(Li0.98 Ni0.02) (Li0.05 Ni0.75 Co0.1 Mn0.1) O2","","- Co0.1 Li1.03 Mn0.1 Ni0.77 O2 -","- Co0.1 Li1.03 Mn0.1 Ni0.77 O2 -","- Co0.3 Li3.09 Mn0.3 Ni2.31 O6 -","3","0.0833333","","Arai, H.; Tsuda, M.; Sakurai, Y.","Lithium nickelate electrodes with enhanced high-temperature performance and thermal stability","Journal of Power Sources","2000","90","","76","81","","","","","","","","","","","","","","","","","","","","","","has coordinates","140333","2020-10-21","18:00:00",""
"1520790","2.8753","","2.8753","","14.215","","90","","90","","120","","101.776","","","","","","","","","","","","","5","R -3 m :H","-R 3 2""","166","","(Li0.98 Ni0.02) (Li0.05 Ni0.75 Co0.1 Ti0.1) O2","","- Co0.1 Li1.03 Ni0.77 O2 Ti0.1 -","- Co0.1 Li1.03 Ni0.77 O2 Ti0.1 -","- Co0.3 Li3.09 Ni2.31 O6 Ti0.3 -","3","0.0833333","","Arai, H.; Sakurai, Y.; Tsuda, M.","Lithium nickelate electrodes with enhanced high-temperature performance and thermal stability","Journal of Power Sources","2000","90","","76","81","","","","","","","","","","","","","","","","","","","","","","has coordinates","140334","2020-10-21","18:00:00",""
"1520797","8.593","","8.593","","4.815","","90","","90","","90","","355.538","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Y Fe9.6 Mo2.4 H0.93","","- Fe9.6 H0.93 Mo2.4 Y -","- Fe9.6 H0.93 Mo2.4 Y -","- Fe19.2 H1.86 Mo4.8 Y2 -","2","0.0625","","Ayres de Campos, J.; Ferreira, L.P.; Mendes, P.J.; Fruchart, D.; Gil, J.M.; Ferreira, I.C.; Ayres de Campos, N.; Bacmann, M.; Soubeyroux, J.L.; Godinho, M.","Study of R Fe9.5 Mo2.5 H (R = Y, Dy, Ho, Er) and R Fe9.5 Mo2.5 N (R= Y, Dy) compounds by Mossbauer spectroscopy, magnetisation and neutron powder diffraction","Journal of Magnetism and Magnetic Materials","2000","213","","293","303","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520798","8.679","","8.679","","4.814","","90","","90","","90","","362.615","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Y Fe9.6 Mo2.4 N0.91","","- Fe9.6 Mo2.4 N0.91 Y -","- Fe9.6 Mo2.4 N0.91 Y -","- Fe19.2 Mo4.8 N1.82 Y2 -","2","0.0625","","Ayres de Campos, J.; Ferreira, L.P.; Mendes, P.J.; Bacmann, M.; Gil, J.M.; Ferreira, I.C.; Godinho, M.; Soubeyroux, J.L.; Ayres de Campos, N.; Fruchart, D.","Study of R Fe9.5 Mo2.5 H (R = Y, Dy, Ho, Er) and R Fe9.5 Mo2.5 N (R= Y, Dy) compounds by Mossbauer spectroscopy, magnetisation and neutron powder diffraction","Journal of Magnetism and Magnetic Materials","2000","213","","293","303","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520799","8.584","","8.584","","4.81","","90","","90","","90","","354.425","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Ho Fe9.5 Mo2.5 H0.75","","- Fe9.5 H0.75 Ho Mo2.5 -","- Fe9.5 H0.75 Ho Mo2.5 -","- Fe19 H1.5 Ho2 Mo5 -","2","0.0625","","Ayres de Campos, J.; Ferreira, L.P.; Ayres de Campos, N.; Gil, J.M.; Mendes, P.J.; Ferreira, I.C.; Fruchart, D.; Bacmann, M.; Godinho, M.; Soubeyroux, J.L.","Study of R Fe9.5 Mo2.5 H (R = Y, Dy, Ho, Er) and R Fe9.5 Mo2.5 N (R= Y, Dy) compounds by Mossbauer spectroscopy, magnetisation and neutron powder diffraction","Journal of Magnetism and Magnetic Materials","2000","213","","293","303","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520800","9.6975","","9.6975","","8.0938","","90","","90","","120","","659.178","","","","","","","","","","","","","5","P 63","P 6c","173","","(N H4) (Sn4 P3 O12)","","- H4 N O12 P3 Sn4 -","- N O12 P3 Sn4 -","- N2 O24 P6 Sn8 -","2","0.333333","","Ayyappan, S.; Stock, N.; Chang, J.-S.; Hatfield, R.; Cheetham, A.K.; Rao, C.N.R.","Synthesis, characterization and acid-base catalytic properties of ammonium-containing tin(II) phopshates: (N H4) (Sn4 P3 O12) and (N H4) (Sn P O4)","International Journal of Inorganic Materials","2000","2","","21","27","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520801","6.52","","9.4794","","8.0719","","90","","90.95","","90","","498.821","","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(N H4) (Sn P O4)","","- H4 N O4 P Sn -","- N O4 P Sn -","- N4 O16 P4 Sn4 -","4","1","","Ayyappan, S.; Chang, J.-S.; Stock, N.; Hatfield, R.; Rao, C.N.R.; Cheetham, A.K.","Synthesis, characterization and acid-base catalytic properties of ammonium-containing tin(II) phopshates: (N H4) (Sn4 P3 O12) and (N H4) (Sn P O4)","International Journal of Inorganic Materials","2000","2","","21","27","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520802","3.875","","3.875","","11.675","","90","","90","","90","","175.307","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Y Sr2 Fe3 O7.986","","- Fe3 O7.986 Sr2 Y -","- Fe3 O7.986 Sr2 Y -","- Fe3 O7.986 Sr2 Y -","1","0.0625","","Azad, A.K.; Zakaria, A.K.M.; Ahmed, F.U.; Paranjpe, S.K.; Das, A.","Room temperature, low temperature and polarized neutron studies of Y Sr2 Fe3 O8","Journal of Magnetism and Magnetic Materials","2000","214","","251","257","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520810","7.9231","","9.3099","","6.2582","","107.395","","100.98","","105.675","","405.227","","","","","","","","","","","","","4","P -1","-P 1","2","","Cu2 Fe4 (Cu0.4 Fe0.6) (P O4)6","","- Cu2.4 Fe4.6 O24 P6 -","- Cu2.4 Fe4.6 O24 P6 -","- Cu2.4 Fe4.6 O24 P6 -","1","0.5","","Belik, A.A.; Malakho, A.P.; Lazoryak, B.I.; Pokholov, K.V.; Khasanov, S.S.","New mixed-valent iron(II/III) phosphates, Cu3-x Fe4+x (P O4)6","Journal of Solid State Chemistry","2000","150","","159","166","","","","","","","","","","","","","","","","","","","","","","has coordinates","140356","2020-10-21","18:00:00",""
"1520812","7.9434","","9.3089","","6.2654","","107.564","","101.04","","105.643","","406.112","","","","","","","","","","","","","4","P -1","-P 1","2","","Cu2 Fe5 (P O4)6","","- Cu2 Fe5 O24 P6 -","- Cu2 Fe5 O24 P6 -","- Cu2 Fe5 O24 P6 -","1","0.5","","Belik, A.A.; Malakho, A.P.; Khasanov, S.S.; Lazoryak, B.I.; Pokholov, K.V.","New mixed-valent iron(II/III) phosphates, Cu3-x Fe4+x (P O4)6","Journal of Solid State Chemistry","2000","150","","159","166","","","","","","","","","","","","","","","","","","","","","","has coordinates","140358","2020-10-21","18:00:00",""
"1520821","12.916","","12.916","","26.543","","90","","90","","120","","3834.75","","","","","","","","","","","","","8","P 3 2 1","P 3 2""","150","","Na21.47 K8.62 Ca9.91 (Si30 Al30 O120) (S O4)10 (H2 O)2","","- Al30 Ca9.91 H4 K8.62 Na21.47 O162 S10 Si30 -","- Al30 Ca9.903 K8.62 Na21.472 O161.996 S9.994 Si30 -","- Al30 Ca9.903 K8.62 Na21.472 O161.996 S9.994 Si30 -","1","0.166667","","Ballirano, P.; Maras, A.; Bonaccorsi, E.; Merlino, S.","The crystal structure of franzinite, the ten-layer mineral of the cancrinite group","Canadian Mineralogist","2000","38","","657","668","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520823","6.09556","","5.4886","","5.183","","90","","90","","90","","173.403","","","","","","","","","","","","","2","P b c m","-P 2c 2b","57","","Tl F","","- F Tl -","- F Tl -","- F4 Tl4 -","4","0.5","","Berastegui, P.; Hull, S.","The crystal structures of thallium(I) fluoride","Journal of Solid State Chemistry","2000","150","","266","275","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520825","3.78283","","3.78283","","6.12312","","90","","90","","90","","87.621","","","","","","","","","","","","","2","P 4/n m m :2","-P 4a 2a","129","","Tl F","","- F Tl -","- F Tl -","- F2 Tl2 -","2","0.125","","Berastegui, P.; Hull, S.","The crystal structures of thallium(I) fluoride","Journal of Solid State Chemistry","2000","150","","266","275","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520826","8.464","","7.817","","10.337","","90","","90.58","","90","","683.893","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(Na H2 P O4) (H3 P O4)","","- H5 Na O8 P2 -","- H5 Na O8 P2 -","- H20 Na4 O32 P8 -","4","1","","Baran, J.; Lis, T.; Drozd, M.; Ratajczak, H.","Structure, phase transition and vibrational spectra of the Na H5 (P O4)2 and Na D5 (P O4)2 crystals","Journal of Molecular Structure","2000","516","","185","202","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520827","8.495","","7.854","","10.352","","90","","90.67","","90","","690.635","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(Na D2 P O4) (D3 P O4)","","- D5 Na O8 P2 -","- D5 Na O8 P2 -","- D20 Na4 O32 P8 -","4","1","","Baran, J.; Lis, T.; Drozd, M.; Ratajczak, H.","Structure, phase transition and vibrational spectra of the Na H5 (P O4)2 and Na D5 (P O4)2 crystals","Journal of Molecular Structure","2000","516","","185","202","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520831","5.4937","","5.4964","","7.7676","","90","","90","","90","","234.547","","","","","","","","","","","","","4","P b a n :2","-P 2ab 2b","50","","(Sr0.25 La0.5) (Ti O3)","","- La0.5 O3 Sr0.25 Ti -","- La0.5 O3 Sr0.25 Ti -","- La2 O12 Sr Ti4 -","4","0.5","","Battle, P.D.; Bennett, J.E.; Sloan, J.; Tilley, R.J.D.; Vente, J.F.","A-site cation-vacancy ordering in Sr1-3x/2 Lax Ti O3: a study by HRTEM","Journal of Solid State Chemistry","2000","149","","360","369","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520832","5.4925","","5.4937","","7.7562","","90","","90","","90","","234.037","","","","","","","","","","","","","4","P b a n :2","-P 2ab 2b","50","","(Sr0.1 La0.6) (Ti O3)","","- La0.6 O3 Sr0.1 Ti -","- La0.6 O3 Sr0.1 Ti -","- La2.4 O12 Sr0.4 Ti4 -","4","0.5","","Battle, P.D.; Tilley, R.J.D.; Bennett, J.E.; Vente, J.F.; Sloan, J.","A-site cation-vacancy ordering in Sr1-3x/2 Lax Ti O3: a study by HRTEM","Journal of Solid State Chemistry","2000","149","","360","369","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520833","5.45934","","5.49363","","7.7366","","90","","90","","90","","232.033","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","(La0.38 Nd0.62) (Ga O3)","","- Ga La0.38 Nd0.62 O3 -","- Ga La0.38 Nd0.62 O3 -","- Ga4 La1.52 Nd2.48 O12 -","4","0.5","","Berkowski, M.; Fink-Finowicki, J.; Piekarczyk, W.; Perchuc, L.; Byszewski, P.; Vasylechko, L.O.; Mazur, K.; Savitskii, D.I.; Sass, J.; Kowalska, E.; Kapusniak, J.","Czochralski growth and structural investigations of La1-x Ndx Ga O3 solid solution single crystals","Journal of Crystal Growth","2000","209","","75","80","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520834","12.969","","9.817","","6.88","","90","","112.14","","90","","811.352","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Ni (V O3)2 (H2 O)4","","- H8 Ni O10 V2 -","- H8 Ni O10 V2 -","- H32 Ni4 O40 V8 -","4","0.5","","Baudrin, E.; Touboul, M.; Nowogrocki, G.","Synthesis and crystal structure of Ni (V O3)2 . 4(H2 O) and alpha-(Ni (V O3)2 . 2(H2 O))","Journal of Solid State Chemistry","2000","152","","511","516","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520835","5.53","","10.621","","11.756","","90","","90","","90","","690.478","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Ni (V O3)2 (H2 O)2","","- H4 Ni O8 V2 -","- H4 Ni O8 V2 -","- H16 Ni4 O32 V8 -","4","0.5","","Baudrin, E.; Touboul, M.; Nowogrocki, G.","Synthesis and crystal structure of Ni (V O3)2 . 4(H2 O) and alpha-(Ni (V O3)2 . 2(H2 O))","Journal of Solid State Chemistry","2000","152","","511","516","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520836","5.44594","","5.49503","","7.72501","","90","","90","","90","","231.176","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","(La0.21 Nd0.79) (Ga O3)","","- Ga La0.21 Nd0.79 O3 -","- Ga La0.21 Nd0.79 O3 -","- Ga4 La0.84 Nd3.16 O12 -","4","0.5","","Berkowski, M.; Kapusniak, J.; Piekarczyk, W.; Fink-Finowicki, J.; Byszewski, P.; Perchuc, L.; Vasylechko, L.O.; Sass, J.; Kowalska, E.; Savitskii, D.I.; Mazur, K.","Czochralski growth and structural investigations of La1-x Ndx Ga O3 solid solution single crystals","Journal of Crystal Growth","2000","209","","75","80","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520844","7.607","","5.837","","9.879","","90","","91.2","","90","","438.552","","","","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","K3 Ce (As O4)2","","- As2 Ce K3 O8 -","- As2 Ce K3 O8 -","- As4 Ce2 K6 O16 -","2","0.5","","Belam, W.; Zid, M.F.; Daoud, A.; Driss, A.","Preparation et etude structurale du tripotassium cerium(III) bis-arseniate: K3 Ce (As O4)2","Journal de la Societe Chimique, Tunis","2000","4","","715","722","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520845","13.354","","13.354","","18.335","","90","","90","","120","","2831.62","","","","","","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","Na3 Y0.111 Al1.887 (As O4)3","","- Al1.887 As3 Na3 O12 Y0.111 -","- Al1.887 As3 Na3 O12 Y0.111 -","- Al22.644 As36 Na36 O144 Y1.332 -","12","0.333333","","Belam, W.; Daoud, A.; Driss, A.; Madani, A.","Elaboration et etude radiocristallographique du trisodium yttrium-aluminium triarsenic dodecaoxyde Na3 Y0.11 Al1.89 (As O4)3 R . Effet du dopage par Na2 O sur la conductivite electrique","Journal de la Societe Chimique, Tunis","2000","4","","735","743","","","","","","","","","","","","","","","","","","","","","","has coordinates","140400","2020-10-21","18:00:00",""
"1520846","21.771","","21.771","","10.285","","90","","90","","90","","4874.85","","","","","","","","","","","","","4","P 42/n :2","-P 4bc","86","","Na2 Zn (P2 O7)","","- Na2 O7 P2 Zn -","- Na2 O7 P2 Zn -","- Na64 O224 P64 Zn32 -","32","4","","Belharouak, I.; Gravereau, P.; Parent, C.; Chaminade, J.P.; Lebraud, E.; le Flem, G.","Crystal structure of Na2 Zn P2 O7: reinvestigation","Journal of Solid State Chemistry","2000","152","","466","473","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520848","5.0293","","5.0293","","13.7648","","90","","90","","120","","301.52","","","","","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","Fe1.696 Ti0.228 O3","","- Fe1.696 O3 Ti0.228 -","- Fe1.696 O3 Ti0.228 -","- Fe10.176 O18 Ti1.368 -","6","0.166667","","Berry, F.J.; Greaves, C.; Williams, R.T.; Helgason, O.; McManus, J.; Palmer, H.M.","Structural and magnetic properties of Sn-, Ti-, and Mg-substituted alpha-(Fe2 O3): a study by neutron diffraction and Mossbauer spectroscopy","Journal of Solid State Chemistry","2000","151","","157","162","","","","","","","","","","","","","","","","","","","","","","has coordinates","140404","2020-10-21","18:00:00",""
"1520849","5.0506","","5.0506","","13.7919","","90","","90","","120","","304.678","","","","","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","","","- Fe1.886 Mg0.171 O3 -","- Fe1.886 Mg0.171 O3 -","- Fe11.316 Mg1.026 O18 -","6","0.166667","","Berry, F.J.; Greaves, C.; McManus, J.; Helgason, O.; Palmer, H.M.; Williams, R.T.","Structural and magnetic properties of Sn-, Ti-, and Mg-substituted alpha-(Fe2 O3): a study by neutron diffraction and Mossbauer spectroscopy","Journal of Solid State Chemistry","2000","151","","157","162","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1520850","8.5988","","6.6234","","11.5988","","90","","90","","90","","660.59","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Cs2 Mg D4","","- Cs2 D4 Mg -","- Cs2 D4 Mg -","- Cs8 D16 Mg4 -","4","0.5","","Bertheville, B.; Fischer, P.; Yvon, K.","Synthesis and crystal structures of Cs2 Mg D4 and Cs3 Mg D5","Journal of Alloys Compd.","2000","302","","12","16","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520851","8.4022","","8.4022","","12.6951","","90","","90","","90","","896.236","","","","","","","","","","","","","3","I 4/m c m","-I 4 2c","140","","Cs3 Mg D5","","- Cs3 D5 Mg -","- Cs3 D5 Mg -","- Cs12 D20 Mg4 -","4","0.125","","Bertheville, B.; Fischer, P.; Yvon, K.","Synthesis and crystal structures of Cs2 Mg D4 and Cs3 Mg D5","Journal of Alloys Compd.","2000","302","","12","16","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520857","5.0744","","5.0744","","69.94049","","90","","90","","120","","1559.66","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","Li27.84 Ti36.816 Nb1.344 O90","","- Li27.84 Nb1.344 O90 Ti36.816 -","- Li27.84 Nb1.344 O90 Ti36.816 -","- Li27.84 Nb1.344 O90 Ti36.816 -","1","0.0277778","","Bordet, P.; Hodeau, J.L.; Grey, I.E.; Bougerol-Chaillout, C.; Isnard, O.","Structural characterization of the engineered scavenger compound, H- (Li2 Ti3 O7)","Journal of Solid State Chemistry","2000","152","","546","553","","","","","","","","","","","","","","","","","","","","","","has coordinates","140417","2020-10-21","18:00:00",""
"1520858","7.5609","","12.697","","12.736","","116.05","","90.192","","90.031","","1098.45","","","","","","","","","","","","","3","P -1","-P 1","2","","Nb2 Te4 O13","","- Nb2 O13 Te4 -","- Nb2 O13 Te4 -","- Nb8 O52 Te16 -","4","2","","Blanchandin, S.; Thomas, P.; Champarnaud-Mesjard, J.C.; Frit, B.","Crystal structure of Nb2 Te4 O13","Journal of Alloys Compd.","2000","306","","175","185","","","","","","","","","","","","","","","","","","","","","","has coordinates","140418","2020-10-21","18:00:00",""
"1520859","10.5989","","10.5989","","10.5989","","90","","90","","90","","1190.65","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","(Tm0.1 Y1.9) O3","","- O3 Tm0.1 Y1.9 -","- O3 Tm0.09995 Y1.90005 -","- O48 Tm1.5992 Y30.4008 -","16","0.333333","","Blanusa, J.; Mitric, M.; Slaski, M.; Rodic, D.; Szytula, A.","An X-ray diffraction and magnetic susceptibility study of Tmx Y2-x O3","Journal of Magnetism and Magnetic Materials","2000","213","","75","81","","","","","","","","","","","","","","","","","","","","","","has coordinates","140419","2020-10-21","18:00:00",""
"1520860","5.126","","5.126","","70.6122","","90","","90","","120","","1606.82","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","Li27.84 Ti36.816 Nb1.344 O90","","- Li27.84 Nb1.344 O90 Ti36.816 -","- Li27.84 Nb1.344 O90 Ti36.816 -","- Li27.84 Nb1.344 O90 Ti36.816 -","1","0.0277778","","Bordet, P.; Bougerol-Chaillout, C.; Grey, I.E.; Hodeau, J.L.; Isnard, O.","Structural characterization of the engineered scavenger compound, H- (Li2 Ti3 O7)","Journal of Solid State Chemistry","2000","152","","546","553","","","","","","","","","","","","","","","","","","","","","","has coordinates","140420","2020-10-21","18:00:00",""
"1520861","10.5804","","10.5804","","10.5804","","90","","90","","90","","1184.42","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","(Tm0.4 Y1.6) O3","","- O3 Tm0.4 Y1.6 -","- O3 Tm0.40005 Y1.59995 -","- O48 Tm6.4008 Y25.5992 -","16","0.333333","","Blanusa, J.; Mitric, M.; Szytula, A.; Rodic, D.; Slaski, M.","An X-ray diffraction and magnetic susceptibility study of Tmx Y2-x O3","Journal of Magnetism and Magnetic Materials","2000","213","","75","81","","","","","","","","","","","","","","","","","","","","","","has coordinates","140421","2020-10-21","18:00:00",""
"1520862","20.203","","6.37","","14.379","","90","","99.827","","90","","1823.33","","","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","Cs3 (Mo8 P8 O43)","","- Cs3 Mo8 O43 P8 -","- Cs3 Mo8 O43 P8 -","- Cs6 Mo16 O86 P16 -","2","0.25","","Borel, M.M.; Leclaire, A.; Chardon, J.; Raveau, B.","A new mixed valent molybdenum monophosphate with a tunnel structure : Cs3 Mo8 O11 (P O4)8","International Journal of Inorganic Materials","2000","2","","11","19","","","","","","","","","","","","","","","","","","","","","","has coordinates","140422","2020-10-21","18:00:00",""
"1520863","10.5717","","10.5717","","10.5717","","90","","90","","90","","1181.5","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","(Tm0.6 Y1.4) O3","","- O3 Tm0.6 Y1.4 -","- O3 Tm0.59995 Y1.40005 -","- O48 Tm9.5992 Y22.4008 -","16","0.333333","","Blanusa, J.; Slaski, M.; Rodic, D.; Mitric, M.; Szytula, A.","An X-ray diffraction and magnetic susceptibility study of Tmx Y2-x O3","Journal of Magnetism and Magnetic Materials","2000","213","","75","81","","","","","","","","","","","","","","","","","","","","","","has coordinates","140423","2020-10-21","18:00:00",""
"1520864","5.5016","","9.8959","","8.5094","","90","","90.473","","90","","463.264","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Pb (V O2) (P O4)","","- O6 P Pb V -","- O6 P Pb V -","- O24 P4 Pb4 V4 -","4","1","","Borel, M.M.; Leclaire, A.; Chardon, J.; Daturi, M.; Raveau, B.","Dimorphism of the vanadium(V) monophosphate Pb V O2 P O4 : alpha-layered and beta-tunnel structures","Journal of Solid State Chemistry","2000","149","","149","154","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520865","10.5466","","10.5466","","10.5466","","90","","90","","90","","1173.11","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","(Tm Y) O3","","- O3 Tm Y -","- O3 Tm0.99995 Y1.00005 -","- O48 Tm15.9992 Y16.0008 -","16","0.333333","","Blanusa, J.; Rodic, D.; Mitric, M.; Szytula, A.; Slaski, M.","An X-ray diffraction and magnetic susceptibility study of Tmx Y2-x O3","Journal of Magnetism and Magnetic Materials","2000","213","","75","81","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520866","10.5262","","10.5262","","10.5262","","90","","90","","90","","1166.31","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","(Tm1.4 Y0.6) O3","","- O3 Tm1.4 Y0.6 -","- O3 Tm1.39995 Y0.60005 -","- O48 Tm22.3992 Y9.6008 -","16","0.333333","","Blanusa, J.; Rodic, D.; Mitric, M.; Szytula, A.; Slaski, M.","An X-ray diffraction and magnetic susceptibility study of Tmx Y2-x O3","Journal of Magnetism and Magnetic Materials","2000","213","","75","81","","","","","","","","","","","","","","","","","","","","","","has coordinates","140427","2020-10-21","18:00:00",""
"1520867","57.395","","4.151","","13.209","","90","","99.21","","90","","3106.43","","","","","","","","","","","","","2","C 1 2/m 1","-C 2y","12","","","","- Gd16 Sb39 -","- Gd16 Sb39.004 -","- Gd32 Sb78.008 -","2","0.25","","Borzone, G.; Parodi, N.; Fornasini, M.L.; Ferro, R.","Gd-Sb system: standard enthalpies of formation of solid alloys and crystal structure of Gd16 Sb39","Intermetallics","2000","8","","189","194","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1520868","5.94761","","6.09707","","8.48555","","90","","90.042","","90","","307.711","","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Sr1.25 Bi0.75 O3","","- Bi0.75 O3 Sr1.25 -","- Bi0.75 O3 Sr1.25 -","- Bi3 O12 Sr5 -","4","1","","Bougerol-Chaillout, C.; Bordet, P.; Kazakov, S.M.; Pshirkov, J.S.; Putilin, S.N.; Antipov, E.V.; Dooryhee, E.; Fitch, A.","Structure determination of Sr1.25 Bi0.75 O3 and Sr0.4 K0.6 Bi O3 as a function of temperature from synchrotron X-ray powder diffraction data","Journal of Solid State Chemistry","2000","150","","316","323","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1520869","10.5022","","10.5022","","10.5022","","90","","90","","90","","1158.35","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","(Tm1.8 Y0.2) O3","","- O3 Tm1.8 Y0.2 -","- O3 Tm1.7995 Y0.2005 -","- O48 Tm28.792 Y3.208 -","16","0.333333","","Blanusa, J.; Mitric, M.; Rodic, D.; Szytula, A.; Slaski, M.","An X-ray diffraction and magnetic susceptibility study of Tmx Y2-x O3","Journal of Magnetism and Magnetic Materials","2000","213","","75","81","","","","","","","","","","","","","","","","","","","","","","has coordinates","140430","2020-10-21","18:00:00",""
"1520870","10.4908","","10.4908","","10.4908","","90","","90","","90","","1154.58","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Tm2 O3","","- O3 Tm2 -","- O3 Tm2 -","- O48 Tm32 -","16","0.333333","","Blanusa, J.; Mitric, M.; Rodic, D.; Szytula, A.; Slaski, M.","An X-ray diffraction and magnetic susceptibility study of Tmx Y2-x O3","Journal of Magnetism and Magnetic Materials","2000","213","","75","81","","","","","","","","","","","","","","","","","","","","","","has coordinates","140431","2020-10-21","18:00:00",""
"1520872","14.74","","14.74","","14.74","","90","","90","","90","","3202.52","","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","","- Na2 Rb Si17 -","- Na2 Rb Si17 -","- Na16 Rb8 Si136 -","8","0.0416667","","Bobev, S.; Sevov, S.C.","Clathrates of group 14 with alkali metals: an exploration","Journal of Solid State Chemistry","2000","153","","92","105","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1520873","15.4858","","15.4858","","15.4858","","90","","90","","90","","3713.65","","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Na2 Rb Ge17","","- Ge17 Na2 Rb -","- Ge17 Na2 Rb -","- Ge136 Na16 Rb8 -","8","0.0416667","","Bobev, S.; Sevov, S.C.","Clathrates of group 14 with alkali metals: an exploration","Journal of Solid State Chemistry","2000","153","","92","105","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520874","5.92803","","5.92803","","8.4301","","90","","90","","90","","296.247","","","","","","","","","","","","","4","I 4/m c m","-I 4 2c","140","","(Sr0.4 K0.6) Bi O3","","- Bi K0.6 O3 Sr0.4 -","- Bi K0.6 O3 Sr0.4 -","- Bi4 K2.4 O12 Sr1.6 -","4","0.125","","Bougerol-Chaillout, C.; Bordet, P.; Kazakov, S.M.; Antipov, E.V.; Pshirkov, J.S.; Dooryhee, E.; Putilin, S.N.; Fitch, A.","Structure determination of Sr1.25 Bi0.75 O3 and Sr0.4 K0.6 Bi O3 as a function of temperature from synchrotron X-ray powder diffraction data","Journal of Solid State Chemistry","2000","150","","316","323","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520877","5.95493","","5.95493","","8.4508","","90","","90","","90","","299.675","","","","","","","","","","","","","4","I 4/m c m","-I 4 2c","140","","(Sr0.4 K0.6) Bi O2.84","","- Bi K0.6 O2.84 Sr0.4 -","- Bi K0.6 O2.84 Sr0.4 -","- Bi4 K2.4 O11.36 Sr1.6 -","4","0.125","","Bougerol-Chaillout, C.; Bordet, P.; Kazakov, S.M.; Fitch, A.; Antipov, E.V.; Pshirkov, J.S.; Putilin, S.N.; Dooryhee, E.","Structure determination of Sr1.25 Bi0.75 O3 and Sr0.4 K0.6 Bi O3 as a function of temperature from synchrotron X-ray powder diffraction data","Journal of Solid State Chemistry","2000","150","","316","323","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520878","5.96045","","5.96045","","8.4545","","90","","90","","90","","300.363","","","","","","","","","","","","","4","I 4/m c m","-I 4 2c","140","","(Sr0.4 K0.6) Bi O2.66","","- Bi K0.6 O2.66 Sr0.4 -","- Bi K0.6 O2.66 Sr0.4 -","- Bi4 K2.4 O10.64 Sr1.6 -","4","0.125","","Bougerol-Chaillout, C.; Bordet, P.; Kazakov, S.M.; Pshirkov, J.S.; Antipov, E.V.; Putilin, S.N.; Dooryhee, E.; Fitch, A.","Structure determination of Sr1.25 Bi0.75 O3 and Sr0.4 K0.6 Bi O3 as a function of temperature from synchrotron X-ray powder diffraction data","Journal of Solid State Chemistry","2000","150","","316","323","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520879","5.9655","","5.9655","","8.4581","","90","","90","","90","","301","","","","","","","","","","","","","4","I 4/m c m","-I 4 2c","140","","(Sr0.4 K0.6) Bi O2.62","","- Bi K0.6 O2.62 Sr0.4 -","- Bi K0.6 O2.62 Sr0.4 -","- Bi4 K2.4 O10.48 Sr1.6 -","4","0.125","","Bougerol-Chaillout, C.; Bordet, P.; Antipov, E.V.; Pshirkov, J.S.; Kazakov, S.M.; Dooryhee, E.; Putilin, S.N.; Fitch, A.","Structure determination of Sr1.25 Bi0.75 O3 and Sr0.4 K0.6 Bi O3 as a function of temperature from synchrotron X-ray powder diffraction data","Journal of Solid State Chemistry","2000","150","","316","323","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520880","5.97122","","5.97122","","8.4648","","90","","90","","90","","301.816","","","","","","","","","","","","","4","I 4/m c m","-I 4 2c","140","","(Sr0.4 K0.6) Bi O2.53","","- Bi K0.6 O2.53 Sr0.4 -","- Bi K0.6 O2.53 Sr0.4 -","- Bi4 K2.4 O10.12 Sr1.6 -","4","0.125","","Bougerol-Chaillout, C.; Antipov, E.V.; Kazakov, S.M.; Bordet, P.; Pshirkov, J.S.; Fitch, A.; Putilin, S.N.; Dooryhee, E.","Structure determination of Sr1.25 Bi0.75 O3 and Sr0.4 K0.6 Bi O3 as a function of temperature from synchrotron X-ray powder diffraction data","Journal of Solid State Chemistry","2000","150","","316","323","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520882","11.48","","19.89","","17.46","","90","","90","","90","","3986.77","","","","","","","","","","","","","3","F d 2 d","F -2d -2d","43","","","","- Ba8 Co7 O21 -","- Ba8 Co7 O21 -","- Ba64 Co56 O168 -","8","0.5","","Boulahya, K.; Parras, M.; Gonzalez-Calbet, J.M.; Vegas, A.","A new orthorhombic Ba8 Co7 O21 phase: polymorphism in the (Ba3 Co2 O6)alpha (Ba3 Co3 O9)-beta system","Journal of Solid State Chemistry","2000","151","","77","84","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1520892","32.535","","12.115","","3.9999","","90","","90","","90","","1576.61","","","","","","","","","","","","","4","I m m m","-I 2 2","71","","","","- La10.77 Nb5 O20 S10 -","- La10.772 Nb5 O20 S10 -","- La21.544 Nb10 O40 S20 -","2","0.125","","Boyer-Candalen, C.; Meerschaut, A.","Synthesis and structure determination of the new compound La10.8 Nb5 O20 S10","Journal of Solid State Chemistry","2000","152","","348","352","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1520893","5.4762","","7.7438","","5.4892","","90","","90","","90","","232.778","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","(Pr0.5 Sr0.5) Fe O3","","- Fe O3 Pr0.5 Sr0.5 -","- Fe O3 Pr0.5 Sr0.5 -","- Fe4 O12 Pr2 Sr2 -","4","0.5","","Brinks, H.W.; Fjellvag, H.; Kjekshus, A.; Hauback, B.C.","Structure and magnetism of Pr1-x Srx Fe O3-d","Journal of Solid State Chemistry","2000","150","","233","249","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520894","3.89264","","3.89264","","3.89264","","90","","90","","90","","58.984","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","(Pr0.333 Sr0.667) Fe O2.68","","- Fe O2.68 Pr0.333 Sr0.667 -","- Fe O2.679 Pr0.333 Sr0.667 -","- Fe O2.679 Pr0.333 Sr0.667 -","1","0.0208333","","Brinks, H.W.; Fjellvag, H.; Kjekshus, A.; Hauback, B.C.","Structure and magnetism of Pr1-x Srx Fe O3-d","Journal of Solid State Chemistry","2000","150","","233","249","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520895","22.153","","22.153","","3.9426","","90","","90","","90","","1934.85","","","","","","","","","","","","","4","I 4/m","-I 4","87","","Nd16 Ti5 S17 O17","","- Nd16 O17 S17 Ti5 -","- Nd16 O17 S17 Ti5 -","- Nd32 O34 S34 Ti10 -","2","0.125","","Boyer-Candalen, C.; Deudon, C.; Meerschaut, A.","Synthesis and structure determination of Nd16 Ti5 S17 O17","Journal of Solid State Chemistry","2000","152","","554","559","","","","","","","","","","","","","","","","","","","","","","has coordinates","140460","2020-10-21","18:00:00",""
"1520896","5.4765","","5.4765","","13.3892","","90","","90","","120","","347.769","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","(Pr Sr2) Fe3 O8.83","","- Fe3 O8.83 Pr Sr2 -","- Fe3 O8.829 Pr0.999 Sr2.001 -","- Fe6 O17.658 Pr1.998 Sr4.002 -","2","0.0555556","","Brinks, H.W.; Fjellvag, H.; Kjekshus, A.; Hauback, B.C.","Structure and magnetism of Pr1-x Srx Fe O3-d","Journal of Solid State Chemistry","2000","150","","233","249","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520898","10.9012","","10.9012","","7.6792","","90","","90","","90","","912.567","","","","","","","","","","","","","4","P 4/n n c :2","-P 4a 2bc","126","","(Pr0.1 Sr0.9) Fe O2.80","","- Fe O2.8 Pr0.1 Sr0.9 -","- Fe O2.7999 Pr0.1 Sr0.9 -","- Fe16 O44.7984 Pr1.6 Sr14.4 -","16","1","","Brinks, H.W.; Fjellvag, H.; Kjekshus, A.; Hauback, B.C.","Structure and magnetism of Pr1-x Srx Fe O3-d","Journal of Solid State Chemistry","2000","150","","233","249","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520911","5.27078","","6.46916","","4.98401","","90","","90","","90","","169.942","","","","","","","","","","","","","3","P n a 21","P 2c -2n","33","","Mg Si N2","","- Mg N2 Si -","- Mg N2 Si -","- Mg4 N8 Si4 -","4","1","","Bruls, R.J.; Loong, C.-K.; Metselaar, R.; Hintzen, H.T.","Anisotropic thermal expansion of Mg Si N2 from 10 to 300 K as measured by neutron diffraction","Journal of Physics and Chemistry of Solids","2000","61","","1285","1293","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520912","5.5192","","7.7557","","5.4858","","90","","90","","90","","234.821","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","(Pr0.8 Sr0.2) Fe O3","","- Fe O3 Pr0.8 Sr0.2 -","- Fe O3 Pr0.8 Sr0.2 -","- Fe4 O12 Pr3.2 Sr0.8 -","4","0.5","","Brinks, H.W.; Fjellvag, H.; Hauback, B.C.; Kjekshus, A.","Structure and magnetism of Pr1-x Srx Fe O3-d","Journal of Solid State Chemistry","2000","150","","233","249","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520918","12.3143","","12.9609","","8.4053","","90","","90","","90","","1341.52","","","","","","","","","","","","","4","P n a m","-P 2c 2n","62","","Sr2.82 ((U O2)4 O3.82 (O H)3.18)2 (H2 O)2","","- H10.36 O32 Sr2.82 U8 -","- O32 Sr2.82 U8 -","- O64 Sr5.64 U16 -","2","0.25","","Burns, P.C.; Hill, F.C.","Implications of the synthesis and structure of the Sr analogue of curite","Canadian Mineralogist","2000","38","","175","181","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1520922","7.82","","7.83","","7.9","","90","","90","","90","","483.722","","","","","","","","","","","","","3","C m m m","-C 2 2","65","","","","- La0.303 Nb O3 -","- La0.30355 Nb O3 -","- La2.4284 Nb8 O24 -","8","0.5","","Carrillo, L.; Villafuerte-Castrejon, M.E.; Pomes, R.; Gonzalez, G.; Sansores, L.E.; Duque, J.; Bucio, L.","Superstructure determination of the perovskite beta-(La0.33 Nb O3)","Journal of Materials Science","2000","35","","3047","3052","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1520927","8.81277","","8.9452","","12.375","","90","","90.801","","90","","975.451","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Li Zr2 (P O4)3","","- Li O12 P3 Zr2 -","- Li O12 P3 Zr2 -","- Li4 O48 P12 Zr8 -","4","1","","Catti, M.; Morgante, N.; Ibberson, R.M.","Order-disorder and mobility of Li(+) in the beta'- and beta-(Li Zr2 (P O4)3) ionic conductors: a neutron diffraction study","Journal of Solid State Chemistry","2000","152","","340","347","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520931","8.847","","8.847","","12.234","","90","","90","","90","","957.548","","","","","","","","","","","","","5","P 42/m n m","-P 4n 2n","136","","Nd2 Fe12.93 Si1.07 B H2.73","","- B Fe12.93 H2.73 Nd2 Si1.07 -","- B Fe12.93 H2.73 Nd2 Si1.07 -","- B4 Fe51.72 H10.92 Nd8 Si4.28 -","4","0.25","","Chacon, C.; Isnard, O.","Structure of Nd~2~Fe~14-x~Si~x~BHy measured by neutron diffraction","Journal of Applied Physics","2000","88","5","2342","2348","10.1063/1.1286134","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520932","8.798","","8.798","","12.158","","90","","90","","90","","941.088","","","","","","","","","","","","","5","P 42/m n m","-P 4n 2n","136","","Nd2 Fe12.05 Si1.95 B H1.83","","- B Fe12.05 H1.83 Nd2 Si1.95 -","- B Fe12.05 H1.83 Nd2 Si1.95 -","- B4 Fe48.2 H7.32 Nd8 Si7.8 -","4","0.25","","Chacon, C.; Isnard, O.","Structure of Nd~2~Fe~14-x~Si~x~BHy measured by neutron diffraction","Journal of Applied Physics","2000","88","5","2342","2348","10.1063/1.1286134","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520933","10.69994","","10.69994","","10.69994","","90","","90","","90","","1225.02","","","","","","","","","","","","","3","P m -3 n","-P 4n 2 3","223","","Sr8 Ga16 Ge30","","- Ga16 Ge30 Sr8 -","- Ga15.9988 Ge29.9966 Sr8 -","- Ga15.9988 Ge29.9966 Sr8 -","1","0.0208333","","Chakoumakos, B.C.; Sales, B.C.; Mandrus, D.; Nolas, G.S.","Structural disorder and thermal conductivity of the semiconducting clathrate Sr8 Ga16 Ge30","Journal of Alloys Compd.","2000","296","","80","86","","","","","","","","","","","","","","","","","","","","","","has coordinates","140515","2020-10-21","18:00:00",""
"1520934","4.898","","8.576","","4.351","","90","","90","","90","","182.765","","","","","","","","","","","","","2","P 21 21 21","P 2ac 2ab","19","","Te O2","","- O2 Te -","- O2 Te -","- O8 Te4 -","4","1","","Champarnaud-Mesjard, J.C.; Blanchandin, S.; Thomas, P.; Mirgorodsky, A.; Frit, B.; Merle-Mejean, T.","Crystal structure, Raman spectrum and lattice dynamics of a new metastable form of tellurium dioxide : gamma-(Te O2)","Journal of Physics and Chemistry of Solids","2000","61","","1499","1507","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520940","19.482","","8.523","","9.83","","90","","90","","90","","1632.22","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","K Hg Sb Se3","","- Hg K Sb Se3 -","- Hg K0.9995 Sb Se3 -","- Hg8 K7.996 Sb8 Se24 -","8","1","","Chen, Z.; Wang, R.-J.","Crystal structures and semiconductor properties of alkaline metal selenides MHgSbSe~3~ (M = K, Rb, Cs)","Acta Chimica Sinica","2000","58","3","326","331","","","","","","","0.077","","","0.118","","","","","","","","","","","","has coordinates","188714","2020-10-21","18:00:00",""
"1520947","5.482","","7.778","","5.5253","","90","","90","","90","","235.593","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","La (Mn O3)","","- La Mn O3 -","- La Mn O3 -","- La4 Mn4 O12 -","4","0.5","","Cherepanov, V.A.; Filonova, E.A.; Voronin, V.I.; Berger, I.F.","Phase equilibria in the (La Co O3) - (La Mn O3) -(Ba Co Oz) (Ba Mn O3) system","Journal of Solid State Chemistry","2000","153","","205","211","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520948","5.5079","","7.7948","","5.5463","","90","","90","","90","","238.119","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","La0.95 Ba0.05 Mn O3","","- Ba0.05 La0.95 Mn O3 -","- Ba0.05 La0.95 Mn O3 -","- Ba0.2 La3.8 Mn4 O12 -","4","0.5","","Cherepanov, V.A.; Filonova, E.A.; Voronin, V.I.; Berger, I.F.","Phase equilibria in the (La Co O3) - (La Mn O3) -(Ba Co Oz) (Ba Mn O3) system","Journal of Solid State Chemistry","2000","153","","205","211","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520949","5.5079","","7.816","","5.5516","","90","","90","","90","","238.995","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","La0.925 Ba0.075 Mn O3","","- Ba0.075 La0.925 Mn O3 -","- Ba0.075 La0.925 Mn O3 -","- Ba0.3 La3.7 Mn4 O12 -","4","0.5","","Cherepanov, V.A.; Filonova, E.A.; Berger, I.F.; Voronin, V.I.","Phase equilibria in the (La Co O3) - (La Mn O3) -(Ba Co Oz) (Ba Mn O3) system","Journal of Solid State Chemistry","2000","153","","205","211","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520950","5.476","","7.786","","5.523","","90","","90","","90","","235.479","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","La0.9 Ba0.1 Mn O3","","- Ba0.1 La0.9 Mn O3 -","- Ba0.1 La0.9 Mn O3 -","- Ba0.4 La3.6 Mn4 O12 -","4","0.5","","Cherepanov, V.A.; Filonova, E.A.; Berger, I.F.; Voronin, V.I.","Phase equilibria in the (La Co O3) - (La Mn O3) -(Ba Co Oz) (Ba Mn O3) system","Journal of Solid State Chemistry","2000","153","","205","211","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520951","5.5432","","5.5432","","13.425","","90","","90","","120","","357.245","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","La0.85 Ba0.15 Mn O3","","- Ba0.15 La0.85 Mn O3 -","- Ba0.15 La0.85 Mn O3 -","- Ba0.9 La5.1 Mn6 O18 -","6","0.166667","","Cherepanov, V.A.; Filonova, E.A.; Voronin, V.I.; Berger, I.F.","Phase equilibria in the (La Co O3) - (La Mn O3) -(Ba Co Oz) (Ba Mn O3) system","Journal of Solid State Chemistry","2000","153","","205","211","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520952","5.5433","","5.5433","","13.471","","90","","90","","120","","358.482","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","La0.775 Ba0.225 Mn O3","","- Ba0.225 La0.775 Mn O3 -","- Ba0.225 La0.775 Mn O3 -","- Ba1.35 La4.65 Mn6 O18 -","6","0.166667","","Cherepanov, V.A.; Voronin, V.I.; Filonova, E.A.; Berger, I.F.","Phase equilibria in the (La Co O3) - (La Mn O3) -(Ba Co Oz) (Ba Mn O3) system","Journal of Solid State Chemistry","2000","153","","205","211","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520953","12.445","","12.445","","3.935","","90","","90","","90","","609.445","","","","","","","","","","","","","4","P 4 b m","P 4 -2ab","100","","Sr0.744 Ba0.247 (Nb2 O6)","","- Ba0.247 Nb2 O6 Sr0.744 -","- Ba0.2472 Nb2 O6 Sr0.7436 -","- Ba1.236 Nb10 O30 Sr3.718 -","5","0.625","","Chernaya, T.S.; Maksimov, B.A.; Volk, T.R.; Ivleva, L.I.; Simonov, V.I.","Atomic structure of Sr0.75 Ba0.25 Nb2 O6 single crystal and composition-structure-property relation in (Sr, Ba) Nb2 O6 solid solutions","Fizika Tverdogo Tela (Leningrad) (= Solid State Physics)","2000","42","","1668","1772","","","","","","","","","","","","","","","","","","","","","","has coordinates","140538","2020-10-21","18:00:00",""
"1520963","14.262","","14.262","","29.949","","90","","90","","120","","5275.62","","","","","","","","","","","","","16","R 3 m :H","R 3 -2""","160","","Na12 K0.25 Ca6.33 Sr0.72 Ba0.03 Ce0.47 Y0.13 Fe2.55 Mn1.2 Ti0.05 Zr3.27 Nb0.8 Si25.2 O72 (O H)4.69 Cl1.3 (H2 O)0.8","","- Ba0.03 Ca6.33 Ce0.47 Cl1.3 Fe2.55 H6.29 K0.25 Mn1.2 Na12 Nb0.8 O77.49 Si25.2 Sr0.72 Ti0.05 Y0.13 Zr3.27 -","- Ba0.033 Ca6.333 Ce0.468 Cl1.3 Fe2.55 K0.249 Mn1.197 Na12 Nb0.8 O77.49 Si25.2 Sr0.717 Ti0.051 Y0.132 Zr3.27 -","- Ba0.099 Ca18.999 Ce1.404 Cl3.9 Fe7.65 K0.747 Mn3.591 Na36 Nb2.4 O232.47 Si75.6 Sr2.151 Ti0.153 Y0.396 Zr9.81 -","3","0.166667","","Ekimenkova, I.A.; Rastsvetaeva, R.K.; Khomyakov, A.P.","Crystal structure of the Fe, Cl - analogue of kentbrooksite","Doklady Akad. Nauk","2000","370","","477","480","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520964","9.12","","8.141","","15.234","","90","","90","","90","","1131.06","","","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","Rb Sr (P3 O9) (H2 O)3","","- H6 O12 P3 Rb Sr -","- H6 O12 P3 Rb Sr -","- H24 O48 P12 Rb4 Sr4 -","4","0.5","","El Kababi, K.; Sbai, K.; Vilminot, S.","Synthesis, thermal behaviour and crystal structure of Rb Sr P3 O9 . 3(H2 O)","C.R. Acad. Sci. Paris, T. 1, Serie II","2000","3","","693","701","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520968","6.4662","","6.4662","","6.717","","90","","90","","120","","243.223","","","","","","","","","","","","","2","P -3 c 1","-P 3 2""c","165","","","","- Gd H3 -","- Gd H3 -","- Gd6 H18 -","6","0.5","","Ellner, M.; Mittemeijer, E.J.; Reule, H.","The structure of the trihydride Gd H3","Journal of Alloys Compd.","2000","309","","127","131","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1520975","4.38","","4.38","","5.725","","90","","90","","120","","95.116","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","Fe0.67 Zn1.33 Sb2","","- Fe0.67 Sb2 Zn1.33 -","- Fe0.66 Sb2 Zn1.34 -","- Fe0.66 Sb2 Zn1.34 -","1","0.0416667","","Chumak, I.V.; Pavlyuk, V.V.; Dmytriv, G.S.; Stepien-Damm, Yu.","Phase equilibria and crystal structure of compounds in the Fe - Zn - Sb system at 570 K","Journal of Alloys Compd.","2000","307","","223","225","","","","","","","","","","","","","","","","","","","","","","has coordinates","140585","2020-10-21","18:00:00",""
"1520976","5.564","","5.564","","5.564","","90","","90","","90","","172.251","","","","","","","","","","","","","3","F -4 3 m","F -4 2 3","216","","Fe Zn Sb","","- Fe Sb Zn -","- Fe Sb Zn -","- Fe4 Sb4 Zn4 -","4","0.0416667","","Chumak, I.V.; Pavlyuk, V.V.; Stepien-Damm, Yu.; Dmytriv, G.S.","Phase equilibria and crystal structure of compounds in the Fe - Zn - Sb system at 570 K","Journal of Alloys Compd.","2000","307","","223","225","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520977","3.083","","3.083","","23.47","","90","","90","","120","","193.193","","","","","","","","","","","","","5","R -3 m :H","-R 3 2""","166","","Zn0.667 Al0.333 (O H)2 Cl0.333 (H2 O)0.667","","- Al0.333 Cl0.333 H3.334 O2.667 Zn0.667 -","- Al0.333 Cl0.333 O2.6666 Zn0.667 -","- Al0.999 Cl0.999 O7.9998 Zn2.001 -","3","0.0833333","","Ennadi, A.; Legrouri, A.; de Roy, A.; Besse, J.P.","X-ray diffraction pattern simulation for thermally treated (Zn - Al - Cl) layered double hydroxide","Journal of Solid State Chemistry","2000","152","","568","572","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520978","10.901","","9.765","","6.382","","112.43","","99.64","","107.53","","567.233","","","","","","","","","","","","","4","P -1","-P 1","2","","Na3.64 Mg2.18 (P2 O7)2","","- Mg2.18 Na3.64 O14 P4 -","- Mg2.18 Na3.64 O14 P4 -","- Mg4.36 Na7.28 O28 P8 -","2","1","","Erragh, F.; Boukhari, A.; Abraham, F.; Elouadi, B.","Study of the crystal structures of sodium magnesium and sodium nickel diphosphates","Journal of Solid State Chemistry","2000","152","","323","331","","","","","","","","","","","","","","","","","","","","","","has coordinates","140589","2020-10-21","18:00:00",""
"1520979","10.889","","9.705","","6.358","","112.46","","99.92","","107.54","","559.686","","","","","","","","","","","","","4","P -1","-P 1","2","","Na3.64 Ni2.18 (P2 O7)2","","- Na3.64 Ni2.18 O14 P4 -","- Na3.64 Ni2.18 O14 P4 -","- Na7.28 Ni4.36 O28 P8 -","2","1","","Erragh, F.; Abraham, F.; Boukhari, A.; Elouadi, B.","Study of the crystal structures of sodium magnesium and sodium nickel diphosphates","Journal of Solid State Chemistry","2000","152","","323","331","","","","","","","","","","","","","","","","","","","","","","has coordinates","140590","2020-10-21","18:00:00",""
"1520981","4.395","","4.395","","4.395","","90","","90","","90","","84.894","","","","","","","","","","","","","3","I m -3 m","-I 4 2 3","229","","(Ba0.5 Bi1.5) O2.16","","- Ba0.5 Bi1.5 O2.16 -","- Ba0.5 Bi1.5 O2.16 -","- Ba0.5 Bi1.5 O2.16 -","1","0.0104167","","Esmaeilzadeh, S.; Berastegui, P.; Grins, J.; Rundlof, H.","Crystal growth and structural investigations of the oxygen ion conductor Ba Bi3 O5.5","Journal of Solid State Chemistry","2000","152","","435","440","","","","","","","","","","","","","","","","","","","","","","has coordinates","140593","2020-10-21","18:00:00",""
"1520983","5.823","","6.523","","3.194","","90","","90","","90","","121.319","","","","","","","","","","","","","2","P n n m","-P 2 2n","58","","","","- Fe Sb2 -","- Fe Sb2 -","- Fe2 Sb4 -","2","0.25","","Chumak, I.V.; Pavlyuk, V.V.; Dmytriv, G.S.; Stepien-Damm, Yu.","Phase equilibria and crystal structure of compounds in the Fe - Zn - Sb system at 570 K","Journal of Alloys Compd.","2000","307","","223","225","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1520986","12.239","","12.239","","12.239","","90","","90","","90","","1833.32","","","","","","","","","","","","","5","P a -3","-P 2ac 2ab 3","205","","Cs3 Mg2 (P6 O17 N)","","- Cs3 Mg2 N O17 P6 -","- Cs3 Mg2 N1.0002 O16.9998 P6 -","- Cs12 Mg8 N4.0008 O67.9992 P24 -","4","0.166667","","Feldmann, W.; l'Haridon, P.; Marchand, R.","Synthesis and crystal structure determination of Cs3 Mg2 P6 O17 N : the first example of a nitrido-oxo-cyclo-hexa phosphate","Journal of Solid State Chemistry","2000","153","","185","191","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520991","3.6648","","3.6648","","10.2305","","90","","90","","120","","118.995","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Cd (O H) Cl","","- Cd Cl H O -","- Cd Cl H O -","- Cd2 Cl2 H2 O2 -","2","0.166667","","Cudennec, Y.; Riou, A.; Gerault, Y.; Lecerf, A.","Synthesis and crystal structures of Cd (O H) Cl and Cu (O H) Cl and relationship to brucite type","Journal of Solid State Chemistry","2000","151","","308","312","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520992","6.2953","","6.6649","","5.558","","90","","118.138","","90","","205.639","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Cu (O H) Cl","","- Cl Cu H O -","- Cl Cu H O -","- Cl4 Cu4 H4 O4 -","4","1","","Cudennec, Y.; Riou, A.; Lecerf, A.; Gerault, Y.","Synthesis and crystal structures of Cd (O H) Cl and Cu (O H) Cl and relationship to brucite type","Journal of Solid State Chemistry","2000","151","","308","312","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520994","11.716","","11.574","","6.7","","90","","90","","90","","908.527","","","","","","","","","","","","","5","P n n 2","P 2 -2n","34","","Ba2 (B5 O9) Cl (H2 O)0.5","","- B5 Ba2 Cl H O9.5 -","- B5 Ba2 Cl O9.5 -","- B20 Ba8 Cl4 O38 -","4","1","","Ferro, O.; Pushcharovskii, D.Yu.; Merlino, S.; Vinogradova, S.A.; Dimitrova, O.V.","Crystal structures of two new Ba borates pentaborate, Ba2 (B5 O9) Cl . 0.5(H2 O) and Ba2 (B5 O8 (O H)2) (O H)","Journal of Alloys Compd.","2000","305","","63","71","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520995","6.713","","16.48","","8.387","","90","","106.8","","90","","888.254","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ba2 (B5 O8 (O H)2) (O H)","","- B5 Ba2 H3 O11 -","- B5 Ba2 O11 -","- B20 Ba8 O44 -","4","1","","Ferro, O.; Merlino, S.; Pushcharovskii, D.Yu.; Vinogradova, S.A.; Dimitrova, O.V.","Crystal structures of two new Ba borates pentaborate, Ba2 (B5 O9) Cl . 0.5(H2 O) and Ba2 (B5 O8 (O H)2) (O H)","Journal of Alloys Compd.","2000","305","","63","71","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520996","10.3038","","10.3038","","10.3038","","90","","90","","90","","1093.94","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","(Bi1.75 Nd0.25) Ru2 O6.907","","- Bi1.75 Nd0.25 O6.907 Ru2 -","- Bi1.75 Nd0.25 O6.907 Ru2 -","- Bi14 Nd2 O55.256 Ru16 -","8","0.0416667","","Field, M.; Kennedy, B.J.; Hunter, B.A.","Structural studies of the metal-nonmetal transition in Ru pyrochlores","Journal of Solid State Chemistry","2000","151","","25","30","","","","","","","","","","","","","","","","","","","","","","has coordinates","140617","2020-10-21","18:00:00",""
"1520997","10.3175","","10.3175","","10.3175","","90","","90","","90","","1098.31","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","(Bi1.25 Nd0.75) Ru2 O6.955","","- Bi1.25 Nd0.75 O6.955 Ru2 -","- Bi1.25 Nd0.75 O6.955 Ru2 -","- Bi10 Nd6 O55.64 Ru16 -","8","0.0416667","","Field, M.; Hunter, B.A.; Kennedy, B.J.","Structural studies of the metal-nonmetal transition in Ru pyrochlores","Journal of Solid State Chemistry","2000","151","","25","30","","","","","","","","","","","","","","","","","","","","","","has coordinates","140619","2020-10-21","18:00:00",""
"1521000","9.555","","9.555","","9.16","","90","","90","","120","","724.248","","","","","","","","","","","","","9","P 6/m c c","-P 6 2c","192","","Na0.36 (Cs0.14 (H2 O)0.87) (Sc0.68 Fe0.26 Al0.06)2 Be3 Si6 O18","","- Al0.12 Be3 Cs0.14 Fe0.52 H1.74 Na0.36 O18.87 Sc1.36 Si6 -","- Al0.12 Be3 Cs0.14 Fe0.52 Na0.36 O18.87 Sc1.36 Si6 -","- Al0.24 Be6 Cs0.28 Fe1.04 Na0.72 O37.74 Sc2.72 Si12 -","2","0.0833333","","Demartin, F.; Gramaccioli, C.M.; Pilati, T.","Structure refinement of bazzite from pegmatitic and miarolitic occurrences","Canadian Mineralogist","2000","38","","1419","1424","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521001","4.157","","4.157","","4.162","","90","","90","","120","","62.286","","","","","","","","","","","","","3","P 6/m m m","-P 6 2","191","","Nd Zn Si","","- Nd Si Zn -","- Nd Si Zn -","- Nd Si Zn -","1","0.0416667","","Demchenko, P.; Bodak, O.","Crystal structure of the Nd Zn Si, Nd Zn0.3 Si1.7 and Nd Zn Sn ternary compounds","Journal of Alloys Compd.","2000","307","","215","217","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521002","4.1478","","4.1478","","14.214","","90","","90","","90","","244.541","","","","","","","","","","","","","3","I 41/a m d :2","-I 4bd 2","141","","Nd Zn0.3 Si1.7","","- Nd Si1.7 Zn0.3 -","- Nd Si1.7 Zn0.3 -","- Nd4 Si6.8 Zn1.2 -","4","0.125","","Demchenko, P.; Bodak, O.","Crystal structure of the Nd Zn Si, Nd Zn0.3 Si1.7 and Nd Zn Sn ternary compounds","Journal of Alloys Compd.","2000","307","","215","217","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521007","10.3296","","10.3296","","10.3296","","90","","90","","90","","1102.18","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","(Bi1.175 Nd0.825) Ru2 O6.996","","- Bi1.175 Nd0.825 O6.996 Ru2 -","- Bi1.175 Nd0.825 O6.996 Ru2 -","- Bi9.4 Nd6.6 O55.968 Ru16 -","8","0.0416667","","Field, M.; Kennedy, B.J.; Hunter, B.A.","Structural studies of the metal-nonmetal transition in Ru pyrochlores","Journal of Solid State Chemistry","2000","151","","25","30","","","","","","","","","","","","","","","","","","","","","","has coordinates","140632","2020-10-21","18:00:00",""
"1521008","8.1401","","8.1401","","8.1401","","90","","90","","90","","539.373","","","","","","","","","","","","","4","F m -3 m","-F 4 2 3","225","","Pb (Sc0.5 Ta0.5) O3","","- O3 Pb Sc0.5 Ta0.5 -","- O3 Pb Sc0.5 Ta0.5 -","- O24 Pb8 Sc4 Ta4 -","8","0.0416667","","Dmowski, W.; Akbas, M.A.; Egami, T.; Davies, P.K.","Local structure of Pb (Sc1/2 Ta1/2) O3 and related compounds","Journal of Physics and Chemistry of Solids","2000","61","","229","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521009","10.3303","","10.3303","","10.3303","","90","","90","","90","","1102.4","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","(Bi Nd) Ru2 O6.963","","- Bi Nd O6.963 Ru2 -","- Bi Nd O6.963 Ru2 -","- Bi8 Nd8 O55.704 Ru16 -","8","0.0416667","","Field, M.; Kennedy, B.J.; Hunter, B.A.","Structural studies of the metal-nonmetal transition in Ru pyrochlores","Journal of Solid State Chemistry","2000","151","","25","30","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521010","6.4163","","9.4798","","11.667","","90","","102.149","","90","","693.755","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Na Ba V S4","","- Ba Na S4 V -","- Ba Na S4 V -","- Ba4 Na4 S16 V4 -","4","1","","Figueroa, E.; Leman, J.T.; Evans, W.J.; Ziller, J.W.; Lawrence, J.M.; Thompson, J.D.","Crystal growth and physical characterisation of Na Ba V S4 obtained from sodium polysulfide flux","Journal of Physics and Chemistry of Solids","2000","61","","773","778","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521011","4.4449","","4.6648","","6.4544","","90","","90","","90","","133.829","","","","","","","","","","","","","3","P b n m","-P 2c 2ab","62","","Mg (Si O3)","","- Mg O3 Si -","- Mg O3 Si -","- Mg4 O12 Si4 -","4","0.5","","Fiquet, G.; Dewaele, A.; Andrault, D.; Kunz, M.; le Bihan, M.T.","Thermoelastic properties and crystal structure of Mg Si O3 perovskite at lower mantle pressure and temperature conditions","Geophysical Research Letters","2000","27","","21","24","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521013","25.756","","8.556","","15.356","","90","","126.592","","90","","2717","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","(Xe2 F3) (As F6)","","- As F9 Xe2 -","- As F9 Xe2 -","- As12 F108 Xe24 -","12","1.5","","Fir, B.A.; Schrobilgen, G.J.D.; Gerken, M.; Pointner, B.E.; Mercier, H.P.A.; Dixon, D.A.","An X-ray crystallographic study of (Xe2 F3) (Sb F6) and dimorphism in (Xe2 F3) (As F6): and a density functional theory study of the (Xe2 F3)(+) cation","Journal of Fluorine Chemistry","2000","105","","159","167","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521020","8.602","","8.602","","10.665","","90","","90","","120","","683.424","","","","","","","","","","","","","3","P 32 2 1","P 32 2""","154","","(Xe2 F3) (As F6)","","- As F9 Xe2 -","- As F9 Xe2 -","- As3 F27 Xe6 -","3","0.5","","Fir, B.A.; Schrobilgen, G.J.D.; Pointner, B.E.; Mercier, H.P.A.; Gerken, M.; Dixon, D.A.","An X-ray crystallographic study of (Xe2 F3) (Sb F6) and dimorphism in (Xe2 F3) (As F6): and a density functional theory study of the (Xe2 F3)(+) cation","Journal of Fluorine Chemistry","2000","105","","159","167","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521022","14.575","","8.1081","","9.9926","","90","","130.36","","90","","899.82","","","","","","","","","","","","","3","C 1 c 1","C -2yc","9","","(Xe2 F3) (Sb F6)","","- F9 Sb Xe2 -","- F9 Sb Xe2 -","- F36 Sb4 Xe8 -","4","1","","Fir, B.A.; Gerken, M.; Dixon, D.A.; Mercier, H.P.A.; Pointner, B.E.; Schrobilgen, G.J.D.","An X-ray crystallographic study of (Xe2 F3) (Sb F6) and dimorphism in (Xe2 F3) (As F6): and a density functional theory study of the (Xe2 F3)(+) cation","Journal of Fluorine Chemistry","2000","105","","159","167","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521025","6.12382","","10.28083","","3.58963","","90","","90","","90","","225.996","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Sr2 Pr O4","","- O4 Pr Sr2 -","- O4 Pr Sr2 -","- O8 Pr2 Sr4 -","2","0.25","","Fiscus, J.E.; zur Loye, H.C.","Synthesis of Sr2 Pr O4: a Pr(4+)-containing oxide in the Sr2 Pb O4 structure type","Journal of Alloys Compd.","2000","306","","141","145","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521028","7.463","","14.742","","7.778","","90","","90","","90","","855.732","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Ce Y4 Si4","","- Ce Si4 Y4 -","- Ce Si4 Y4 -","- Ce4 Si16 Y16 -","4","0.5","","Flandorfer, H.; Godart, C.; Groebner, J.; Kostikas, A.; Rogl, P.; Psicharis, V.; Effenberg, G.; Ferro, R.; Saccone, A.","The ternary system Ce - Si - Y. Phase relations, crystallographic and magnetic properties","Journal of Alloys Compd.","2000","297","","129","136","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521029","9.6499","","9.6499","","6.7725","","90","","90","","120","","546.167","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","(Ca9.8 Na0.1 La0.1) (P O4)6 Cl2","","- Ca9.8 Cl2 La0.1 Na0.1 O24 P6 -","- Ca9.798 Cl2 La0.1038 Na0.1 O24 P6 -","- Ca9.798 Cl2 La0.1038 Na0.1 O24 P6 -","1","0.0833333","","Fleet, M.E.; Liu, X.-Y.; Pan, Y.-M.","Rare-earth elements in chlorapatite (Ca10 (P O4)6 Cl2): uptake, site preference, and degradation of monoclinic structure","American Mineralogist","2000","85","","1437","1446","","","","","","","","","","","","","","","","","","","","","","has coordinates","140656","2020-10-21","18:00:00",""
"1521031","9.6474","","9.6474","","6.7747","","90","","90","","120","","546.061","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","(Ca9.64 Na0.18 Nd0.18) (P O4)6 Cl2","","- Ca9.64 Cl2 Na0.18 Nd0.18 O24 P6 -","- Ca9.644 Cl2 Na0.174 Nd0.1834 O24 P6 -","- Ca9.644 Cl2 Na0.174 Nd0.1834 O24 P6 -","1","0.0833333","","Fleet, M.E.; Liu, X.-Y.; Pan, Y.-M.","Rare-earth elements in chlorapatite (Ca10 (P O4)6 Cl2): uptake, site preference, and degradation of monoclinic structure","American Mineralogist","2000","85","","1437","1446","","","","","","","","","","","","","","","","","","","","","","has coordinates","140658","2020-10-21","18:00:00",""
"1521032","9.6492","","9.6492","","6.7668","","90","","90","","120","","545.628","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","(Ca9.66 Na0.17 Sm0.17) (P O4)6 Cl2","","- Ca9.66 Cl2 Na0.17 O24 P6 Sm0.17 -","- Ca9.666 Cl2 Na0.164 O24 P6 Sm0.1702 -","- Ca9.666 Cl2 Na0.164 O24 P6 Sm0.1702 -","1","0.0833333","","Fleet, M.E.; Liu, X.-Y.; Pan, Y.-M.","Rare-earth elements in chlorapatite (Ca10 (P O4)6 Cl2): uptake, site preference, and degradation of monoclinic structure","American Mineralogist","2000","85","","1437","1446","","","","","","","","","","","","","","","","","","","","","","has coordinates","140659","2020-10-21","18:00:00",""
"1521033","9.6487","","9.6487","","6.7652","","90","","90","","120","","545.442","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","(Ca9.72 Na0.14 Dy0.14) (P O4)6 Cl2","","- Ca9.72 Cl2 Dy0.14 Na0.14 O24 P6 -","- Ca9.714 Cl2 Dy0.138 Na0.144 O24 P6 -","- Ca9.714 Cl2 Dy0.138 Na0.144 O24 P6 -","1","0.0833333","","Fleet, M.E.; Liu, X.-Y.; Pan, Y.-M.","Rare-earth elements in chlorapatite (Ca10 (P O4)6 Cl2): uptake, site preference, and degradation of monoclinic structure","American Mineralogist","2000","85","","1437","1446","","","","","","","","","","","","","","","","","","","","","","has coordinates","140660","2020-10-21","18:00:00",""
"1521034","9.4179","","18.8357","","6.8793","","90","","90","","120","","1056.84","","","","","","","","","","","","","6","P 1 1 21/b","-P 2bc","14","","(Ca9.576 Na0.212 Dy0.212) (P O4)6 (O H)2","","- Ca9.576 Dy0.212 H2 Na0.212 O26 P6 -","- Ca9.574 Dy0.212 H2 Na0.212 O26 P6 -","- Ca19.148 Dy0.424 H4 Na0.424 O52 P12 -","2","0.5","","Fleet, M.E.; Liu, X.-Y.; Pan, Y.-M.","Rare-earth elements in chlorapatite (Ca10 (P O4)6 Cl2): uptake, site preference, and degradation of monoclinic structure","American Mineralogist","2000","85","","1437","1446","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521036","9.4341","","9.4341","","6.8951","","90","","90","","120","","531.462","","","","","","","","","","","","","7","P 63/m","-P 6c","176","","Ca9.674 Na0.045 La0.286 (P0.964 Si0.036 O4)6 (O H)2","","- Ca9.674 H2 La0.286 Na0.045 O26 P5.784 Si0.216 -","- Ca9.674 H2 La0.286 Na0.04 O26 P5.784 Si0.216 -","- Ca9.674 H2 La0.286 Na0.04 O26 P5.784 Si0.216 -","1","0.0833333","","Fleet, M.E.; Liu, X.-Y.; Pan, Y.-M.","Site preference of rare earth elements in hydroxyapatite Ca10 (P O4)6 (O H)2","Journal of Solid State Chemistry","2000","149","","391","398","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521037","9.4205","","9.4205","","6.8846","","90","","90","","120","","529.124","","","","","","","","","","","","","7","P 63/m","-P 6c","176","","Ca9.616 Na0.064 Nd0.317 (P0.952 Si0.048 O4)6 (O H)2","","- Ca9.616 H2 Na0.064 Nd0.317 O26 P5.712 Si0.288 -","- Ca9.616 H2 Na0.064 Nd0.3168 O26 P5.712 Si0.288 -","- Ca9.616 H2 Na0.064 Nd0.3168 O26 P5.712 Si0.288 -","1","0.0833333","","Fleet, M.E.; Liu, X.-Y.; Pan, Y.-M.","Site preference of rare earth elements in hydroxyapatite Ca10 (P O4)6 (O H)2","Journal of Solid State Chemistry","2000","149","","391","398","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521038","9.4202","","9.4202","","6.8832","","90","","90","","120","","528.982","","","","","","","","","","","","","7","P 63/m","-P 6c","176","","Ca9.692 Na0.04 Sm0.271 (P0.963 Si0.037 O4)6 (O H)2","","- Ca9.692 H2 Na0.04 O26 P5.778 Si0.222 Sm0.271 -","- Ca9.692 H2 Na0.04 O26 P5.778 Si0.222 Sm0.2708 -","- Ca9.692 H2 Na0.04 O26 P5.778 Si0.222 Sm0.2708 -","1","0.0833333","","Fleet, M.E.; Liu, X.-Y.; Pan, Y.-M.","Site preference of rare earth elements in hydroxyapatite Ca10 (P O4)6 (O H)2","Journal of Solid State Chemistry","2000","149","","391","398","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521042","4.0043","","4.0043","","4.14964","","90","","90","","90","","66.537","","","","","","","","","","","","","4","P 4 m m","P 4 -2","99","","Pb (Zr0.4 Ti0.6) O3","","- O3 Pb Ti0.6 Zr0.4 -","- O3 Pb Ti0.6 Zr0.4 -","- O3 Pb Ti0.6 Zr0.4 -","1","0.125","","Frantti, J.; Lappalainen, J.; Lantto, V.; Rundlof, H.; Nishio, S.; Eriksson, S.; Ivanov, S.; Kakihana, M.","Neutron diffraction studies of Pb (Zrx Ti1-x) O3 ceramics","Japanese Journal of Applied Physics, Part 1","2000","39","","5697","5703","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521043","4.03034","","4.03034","","4.1449","","90","","90","","90","","67.328","","","","","","","","","","","","","4","P 4 m m","P 4 -2","99","","Pb (Zr0.5 Ti0.5) O3","","- O3 Pb Ti0.5 Zr0.5 -","- O3 Pb Ti0.5 Zr0.5 -","- O3 Pb Ti0.5 Zr0.5 -","1","0.125","","Frantti, J.; Nishio, S.; Lappalainen, J.; Eriksson, S.; Lantto, V.; Ivanov, S.; Kakihana, M.; Rundlof, H.","Neutron diffraction studies of Pb (Zrx Ti1-x) O3 ceramics","Japanese Journal of Applied Physics, Part 1","2000","39","","5697","5703","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521044","4.055","","4.055","","4.1097","","90","","90","","90","","67.576","","","","","","","","","","","","","4","P 4 m m","P 4 -2","99","","Pb (Zr0.52 Ti0.48) O3","","- O3 Pb Ti0.48 Zr0.52 -","- O3 Pb Ti0.48 Zr0.52 -","- O3 Pb Ti0.48 Zr0.52 -","1","0.125","","Frantti, J.; Ivanov, S.; Eriksson, S.; Lappalainen, J.; Kakihana, M.; Lantto, V.; Nishio, S.; Rundlof, H.","Neutron diffraction studies of Pb (Zrx Ti1-x) O3 ceramics","Japanese Journal of Applied Physics, Part 1","2000","39","","5697","5703","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521045","5.76907","","5.74266","","4.089","","90","","90.497","","90","","135.463","","","","","","","","","","","","","4","C 1 m 1","C -2y","8","","Pb (Zr0.54 Ti0.46) O3","","- O3 Pb Ti0.46 Zr0.54 -","- O3 Pb Ti0.46 Zr0.54 -","- O6 Pb2 Ti0.92 Zr1.08 -","2","0.5","","Frantti, J.; Rundlof, H.; Lappalainen, J.; Ivanov, S.; Eriksson, S.; Lantto, V.; Nishio, S.; Kakihana, M.","Neutron diffraction studies of Pb (Zrx Ti1-x) O3 ceramics","Japanese Journal of Applied Physics, Part 1","2000","39","","5697","5703","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521047","11.108","","10.955","","11.666","","90","","103.32","","90","","1381.42","","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(Ni (S2 O3)) (C14 H12 N2)","","- C14 H12 N2 Ni O3 S2 -","- C14 N2 Ni O3 S2 -","- C56 N8 Ni4 O12 S8 -","4","1","","Freire, E.; Baggio, S.; Suescun, L.; Baggio, R.","X-ray study of two nickel(II)-thiosulfate compounds","Australian Journal of Chemistry","2000","53","","785","790","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521050","7.5916","","6.4713","","7.4216","","90","","90","","90","","364.605","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Li (V O) (As O4)","","- As Li O5 V -","- As Li O5 V -","- As4 Li4 O20 V4 -","4","0.5","","Gaubicher, J.; Villesuzanne, A.; Orsini, F.; Angenault, J.; Llorente, S.; le Mercier, T.; Quarton, M.","Synthesis, structure and physical studies of the new beta-(Li V O As O4) compound","Journal of Solid State Chemistry","2000","150","","250","257","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521052","3.987","","3.987","","9.672","","90","","90","","90","","153.748","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","","","- Ca Ni2 Si2 -","- Ca Ni2 Si2 -","- Ca2 Ni4 Si4 -","2","0.0625","","Gavoille, G.; Hansen, N.K.; Welter, R.; Krane, H.G.; Malaman, B.; Herzig, P.","Electron density of Ca Ni2 Si2 studied using synchrotron X-ray diffraction and first-principles calculations","Journal of Physics: Condensed Matter","2000","12","","2667","2679","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521060","14.5635","","14.5635","","14.5635","","90","","90","","90","","3088.85","","","","","","","","","","","","","2","P 41 3 2","P 4bd 2ab 3","213","","","","- Ba24 Ge100 -","- Ba24 Ge100 -","- Ba24 Ge100 -","1","0.0416667","","Fukuoka, H.; Iwai, K.; Yamanaka, S.; Abe, H.; Yoza, K.; Haeming, L.","Preparation and structure of a new germanium clathrate, Ba24 Ge100","Journal of Solid State Chemistry","2000","151","","117","121","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521061","3.8802","","29.508","","7.714","","90","","90","","90","","883.229","","","","","","","","","","","","","4","C m c m","-C 2c 2","63","","K Ca2 (Nb3 O10)","","- Ca2 K Nb3 O10 -","- Ca2 K Nb3 O10 -","- Ca8 K4 Nb12 O40 -","4","0.25","","Fukuoka, H.; Isami, T.; Yamanaka, S.","Crystal structure of a layered perovskite niobate K Ca2 Nb3 O10","Journal of Solid State Chemistry","2000","151","","40","45","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521067","12.763","","7.31","","30.19","","90","","94.09","","90","","2809.48","","","","","","","","","","","","","5","C 1 2 1","C 2y","5","","(Ca1.747 Sm0.253) (Ta1.84 Ti0.16) O7","","- Ca1.747 O7 Sm0.253 Ta1.84 Ti0.16 -","- Ca1.7468 O7 Sm0.2532 Ta1.8396 Ti0.1602 -","- Ca34.936 O140 Sm5.064 Ta36.792 Ti3.204 -","20","5","","Grey, I.E.; Roth, R.S.","New calcium tantalate polytypes in the system Ca2 Ta2 O7 Sm2 Ti2 O7","Journal of Solid State Chemistry","2000","150","","167","177","","","","","","","","","","","","","","","","","","","","","","has coordinates","140701","2020-10-21","18:00:00",""
"1521068","7.353","","7.353","","30.264","","90","","90","","120","","1417.05","","","","","","","","","","","","","5","P 31","P 31","144","","(Ca1.89 Sm0.11) (Ta1.86 Sm0.05 Ti0.10) O7","","- Ca1.89 O7 Sm0.16 Ta1.86 Ti0.1 -","- Ca1.89 O7 Sm0.155 Ta1.86025 Ti0.09475 -","- Ca22.68 O84 Sm1.86 Ta22.323 Ti1.137 -","12","4","","Grey, I.E.; Roth, R.S.","New calcium tantalate polytypes in the system Ca2 Ta2 O7 Sm2 Ti2 O7","Journal of Solid State Chemistry","2000","150","","167","177","","","","","","","","","","","","","","","","","","","","","","has coordinates","140702","2020-10-21","18:00:00",""
"1521069","7.223","","7.223","","8.614","","90","","90","","120","","389.198","","","","","","","","","","","","","4","P -3","-P 3","147","","Ca (Al12 Si4 O27)","","- Al12 Ca O27 Si4 -","- Al12 Ca O27 Si4 -","- Al12 Ca O27 Si4 -","1","0.166667","","Grey, I.E.; Hibberson, W.O.; Madsen, I.C.; O'Neill, H.S.C.","Ca Al12 Si4 O27, a new high-pressure phase containing Al6 O19 clusters","Journal of Solid State Chemistry","2000","153","","391","397","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521070","6.2592","","13.0838","","13.2271","","91.13","","103.554","","90.188","","1052.81","","","","","","","","","","","","","5","P -1","-P 1","2","","Na Y (C O3)2 (H2 O)6","","- C2 H12 Na O12 Y -","- C2 Na O12 Y -","- C8 Na4 O48 Y4 -","4","2","","Grice, J.D.; Gault, R.A.; Cooper, M.A.; Roberts, A.C.","Adamsite-(Y), a new sodium-yttrium carbonate mineral species from Mont Saint-Hilaire, Quebec","Canadian Mineralogist","2000","38","","1457","1466","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521072","5.4448","","5.4448","","8.8915","","90","","90","","120","","228.281","","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","Ce (Mn1.5 Al0.5) D0.086","","- Al0.5 Ce D0.086 Mn1.5 -","- Al0.49985 Ce D0.0864 Mn1.49995 -","- Al1.9994 Ce4 D0.3456 Mn5.9998 -","4","0.166667","","Gross, K.J.; Chartouni, D.; Fauth, F.","A new hexagonal Laves phase deuteride Ce Mn1.5 Al0.5 Dx (0<x<4) investigated by in situ neutron diffraction","Journal of Alloys Compd.","2000","306","","203","218","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521073","5.8462","","5.8462","","9.6452","","90","","90","","120","","285.489","","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","Ce (Mn1.5 Al0.5) D2.997","","- Al0.5 Ce D2.997 Mn1.5 -","- Al0.49985 Ce D2.997 Mn1.49995 -","- Al1.9994 Ce4 D11.988 Mn5.9998 -","4","0.166667","","Gross, K.J.; Chartouni, D.; Fauth, F.","A new hexagonal Laves phase deuteride Ce Mn1.5 Al0.5 Dx (0<x<4) investigated by in situ neutron diffraction","Journal of Alloys Compd.","2000","306","","203","218","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521074","5.9376","","5.9376","","9.7278","","90","","90","","120","","297.007","","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","Ce (Mn1.5 Al0.5) D3.63","","- Al0.5 Ce D3.63 Mn1.5 -","- Al0.49985 Ce D3.6315 Mn1.49995 -","- Al1.9994 Ce4 D14.526 Mn5.9998 -","4","0.166667","","Gross, K.J.; Chartouni, D.; Fauth, F.","A new hexagonal Laves phase deuteride Ce Mn1.5 Al0.5 Dx (0<x<4) investigated by in situ neutron diffraction","Journal of Alloys Compd.","2000","306","","203","218","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521075","10.098","","5.238","","10.595","","90","","96.31","","90","","557.01","","","","","","","","","","","","","4","P 1 2/n 1","-P 2yac","13","","Ba Fe2 (Se O3)4","","- Ba Fe2 O12 Se4 -","- Ba Fe2 O12 Se4 -","- Ba2 Fe4 O24 Se8 -","2","0.5","","Giester, G.","Syntheses and crystal structures of the new compounds Ba Fe2 (Se O3)4, Ag Fe (Se O3)2 and Rb Fe (Se O4) (Se O3)","Journal of Alloys Compd.","2000","308","","71","76","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521076","5.339","","5.339","","41.206","","90","","90","","120","","1017.21","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","Rb Fe (Se O3) (Se O4)","","- Fe O7 Rb Se2 -","- Fe O7 Rb Se2 -","- Fe6 O42 Rb6 Se12 -","6","0.166667","","Giester, G.","Syntheses and crystal structures of the new compounds Ba Fe2 (Se O3)4, Ag Fe (Se O3)2 and Rb Fe (Se O4) (Se O3)","Journal of Alloys Compd.","2000","308","","71","76","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521077","6.0067","","6.0067","","9.786","","90","","90","","120","","305.779","","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","Ce (Mn1.5 Al0.5) D3.975","","- Al0.5 Ce D3.975 Mn1.5 -","- Al0.49985 Ce D3.975 Mn1.49995 -","- Al1.9994 Ce4 D15.9 Mn5.9998 -","4","0.166667","","Gross, K.J.; Chartouni, D.; Fauth, F.","A new hexagonal Laves phase deuteride Ce Mn1.5 Al0.5 Dx (0<x<4) investigated by in situ neutron diffraction","Journal of Alloys Compd.","2000","306","","203","218","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521079","4.5253","","4.5253","","4.7214","","90","","90","","120","","83.733","","","","","","","","","","","","","3","P -3 m 1","-P 3 2""","164","","Sr Al2 D2","","- Al2 D2 Sr -","- Al2 D2 Sr -","- Al2 D2 Sr -","1","0.0833333","","Gingl, F.; Vogt, T.; Akiba, E.","Trigonal Sr Al2 H2: the first Zintl phase hydride","Journal of Alloys Compd.","2000","306","","127","132","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521080","5.5073","","5.5073","","9.9374","","90","","90","","90","","301.405","","","","","","","","","","","","","2","I -4","I -4","82","","","","- Ge Se2 -","- Ge Se2 -","- Ge4 Se8 -","4","0.5","","Grzechnik, A.; Mezouar, M.; Stolen, S.; Bakken, E.; Grande, T.","Structural transformations in three-dimensional crystalline Ge Se2 at high pressures and high temperatures","Journal of Solid State Chemistry","2000","150","","121","127","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521081","11.885","","11.54","","15.636","","90","","90.23","","90","","2144.5","","","","","","","","","","","","","4","I 1 2/m 1","-I 2y","12","","Pb5 Bi18 P4 O42","","- Bi18 O42 P4 Pb5 -","- Bi18 O42.02 P4 Pb5 -","- Bi36 O84.04 P8 Pb10 -","2","0.25","","Giraud, S.; Steinfink, H.; Swinnea, S.; Wignacourt, J.P.; Harlow, R.","Crystal structure of Pb5 Bi18 P4 O42: a fluorite-related superstructure","Journal of Solid State Chemistry","2000","151","","181","189","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521082","4.3223","","4.3223","","4.2585","","90","","90","","120","","68.9","","","","","","","","","","","","","3","P 6/m m m","-P 6 2","191","","Pr (Al1.476 Ge0.524)","","- Al1.476 Ge0.524 Pr -","- Al1.476 Ge0.524 Pr -","- Al1.476 Ge0.524 Pr -","1","0.0416667","","Gladyshevskii, E.I.; Nakonechna, N.Z.; Cenzual, K.; Gladyshevskii, R.E.; Jorda, J.L.; Hladyshevskii, E.I.","Crystal structures of Pr Alx Ge2-x compounds","Journal of Alloys Compd.","2000","296","","265","271","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521083","4.2534","","4.2534","","14.641","","90","","90","","90","","264.876","","","","","","","","","","","","","3","I 41 m d","I 4bw -2","109","","Pr Al Ge","","- Al Ge Pr -","- Al Ge Pr -","- Al4 Ge4 Pr4 -","4","0.25","","Gladyshevskii, E.I.; Cenzual, K.; Nakonechna, N.Z.; Gladyshevskii, R.E.; Jorda, J.L.; Hladyshevskii, E.I.","Crystal structures of Pr Alx Ge2-x compounds","Journal of Alloys Compd.","2000","296","","265","271","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521084","3.8359","","3.8359","","9.7539","","90","","90","","120","","124.292","","","","","","","","","","","","","5","P 63/m m c","-P 6c 2c","194","","Y2 (Si Al O5 N)","","- Al N O5 Si Y2 -","- Al1.0002 N1.0004 O5 Si1.0002 Y2 -","- Al1.0002 N1.0004 O5 Si1.0002 Y2 -","1","0.0416667","","Gonon, M.F.; Descamps, J.C.; Cambier, F.; Thompson, D.P.","Determination and refinement of the crystal structure of M2 Si Al O5 N ""B-phase"" (M= Y, Er, Yb)","Ceramics International","2000","26","","105","111","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521085","5.6793","","12.3841","","5.6793","","90","","90","","90","","399.442","","","","","","","","","","","","","4","P c c a","-P 2a 2ac","54","","La K O (C O3)","","- C K La O4 -","- C K La O4 -","- C4 K4 La4 O16 -","4","0.5","","Guenther, W.; Paulus, W.; Schoellhorn, R.","Stacking disorder in a layered carbonate phase: the structure of LaK O C O3","Journal of Physics and Chemistry of Solids","2000","61","","1945","1953","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521086","4.0154","","4.0154","","12.3843","","90","","90","","90","","199.677","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","La K O (C O3)","","- C K La O4 -","- C K La O4 -","- C2 K2 La2 O8 -","2","0.125","","Guenther, W.; Paulus, W.; Schoellhorn, R.","Stacking disorder in a layered carbonate phase: the structure of La K O C O3","Journal of Physics and Chemistry of Solids","2000","61","","1945","1953","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521092","16.823","","6.222","","4.795","","90","","90","","90","","501.906","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Tl Te F5","","- F5 Te Tl -","- F5 Te Tl -","- F20 Te4 Tl4 -","4","0.5","","Guillet, L.; Frit, B.; Laval, J.P.","Crystal structure of Tl Te F5","Journal of Fluorine Chemistry","2000","103","","13","16","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521093","5.69857","","5.69744","","8.05187","","90","","90","","90","","261.422","","","","","","","","","","","","","3","P b n m","-P 2c 2ab","62","","Sr Sn O3","","- O3 Sn Sr -","- O3 Sn Sr -","- O12 Sn4 Sr4 -","4","0.5","","Green, M.A.; Prassides, K.; Day, P.; Neumann, D.A.","Structure of the n=2 and n=infinity member of the Ruddlesden-Popper series, Srn+1 Snn O3n+1","International Journal of Inorganic Materials","2000","2","","35","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521094","20.688","","5.736","","5.71","","90","","90","","90","","677.585","","","","","","","","","","","","","3","C m c m","-C 2c 2","63","","Sr3 Sn2 O7","","- O7 Sn2 Sr3 -","- O7 Sn2 Sr3 -","- O28 Sn8 Sr12 -","4","0.25","","Green, M.A.; Day, P.; Prassides, K.; Neumann, D.A.","Structure of the n=2 and n=infinity member of the Ruddlesden-Popper series, Srn+1 Snn O3n+1","International Journal of Inorganic Materials","2000","2","","35","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","140735","2020-10-21","18:00:00",""
"1521095","9.946","","3.744","","20.994","","90","","93.3","","90","","780.475","","","","","","","","","","","","","2","C 1 2/m 1","-C 2y","12","","Ti6 O11","","- O11 Ti6 -","- O11 Ti6 -","- O44 Ti24 -","4","0.5","","Grey, I.E.; Cranswick, L.M.D.; Li, C.; White, T.J.; Bursill, L.A.","New M3 O5 - anatase intergrowth structures formed during low-temperature oxidation of anosovite","Journal of Solid State Chemistry","2000","150","","128","138","","","","","","","","","","","","","","","","","","","","","","has coordinates","140737","2020-10-21","18:00:00",""
"1521096","5.492","","5.472","","7.734","","90","","90","","90","","232.424","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","La0.65 Ca0.325 Mn O2.975","","- Ca0.325 La0.65 Mn O2.975 -","- Ca0.33 La0.65 Mn O2.975 -","- Ca1.32 La2.6 Mn4 O11.9 -","4","0.5","","Guo, Y.-Q.; Tao, K.; Liu, Y.-C.; Wappling, R.; Zhou, H.-P.","Crystal structures and giant magnetoresistance of fluoride La2/3 Ca1/3 Mn O3 compounds","Journal of Alloys Compd.","2000","296","","33","38","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521097","5.49","","5.471","","7.731","","90","","90","","90","","232.207","","","","","","","","","","","","","5","P b n m","-P 2c 2ab","62","","(La0.625 Ca0.35) Mn O (O1.9 F0.05)","","- Ca0.35 F0.05 La0.625 Mn O2.9 -","- Ca0.35 F0.05 La0.63 Mn O2.9 -","- Ca1.4 F0.2 La2.52 Mn4 O11.6 -","4","0.5","","Guo, Y.-Q.; Tao, K.; Liu, Y.-C.; Zhou, H.-P.; Wappling, R.","Crystal structures and giant magnetoresistance of fluoride La2/3 Ca1/3 Mn O3 compounds","Journal of Alloys Compd.","2000","296","","33","38","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521098","5.463","","5.455","","7.713","","90","","90","","90","","229.853","","","","","","","","","","","","","5","P b n m","-P 2c 2ab","62","","(La0.6 Ca0.4) Mn O (O1.775 F0.175)","","- Ca0.4 F0.175 La0.6 Mn O2.775 -","- Ca0.4 F0.174 La0.6 Mn O2.774 -","- Ca1.6 F0.696 La2.4 Mn4 O11.096 -","4","0.5","","Guo, Y.-Q.; Liu, Y.-C.; Tao, K.; Zhou, H.-P.; Wappling, R.","Crystal structures and giant magnetoresistance of fluoride La2/3 Ca1/3 Mn O3 compounds","Journal of Alloys Compd.","2000","296","","33","38","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521105","5.5235","","5.5235","","13.398","","90","","90","","120","","353.997","","","","","","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","(La0.7 Pb0.3) (Mn0.9 Fe0.1) O3","","- Fe0.1 La0.7 Mn0.9 O3 Pb0.3 -","- Fe0.1 La0.7 Mn0.9 O3 Pb0.3 -","- Fe0.6 La4.2 Mn5.4 O18 Pb1.8 -","6","0.166667","","Gutierrez, J.; Pena, A.; Barandiaran, J.M.; Pizarro, J.L.; Lezama, L.; Insausti, M.; Rojo, T.","Structural, magnetic and magnetotransport properties of La0.7 Pb0.3 Mn0.9 TM0.1 O3 (TM = Fe, Co, Ni) CMR perovskites","Journal of Physics: Condensed Matter","2000","12","","10523","10534","","","","","","","","","","","","","","","","","","","","","","has coordinates","140748","2020-10-21","18:00:00",""
"1521106","5.492","","5.492","","13.331","","90","","90","","120","","348.221","","","","","","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","(La0.7 Pb0.3) (Mn0.9 Ni0.1) O3","","- La0.7 Mn0.9 Ni0.1 O3 Pb0.3 -","- La0.7 Mn0.9 Ni0.1 O3 Pb0.3 -","- La4.2 Mn5.4 Ni0.6 O18 Pb1.8 -","6","0.166667","","Gutierrez, J.; Barandiaran, J.M.; Pena, A.; Rojo, T.; Pizarro, J.L.; Insausti, M.; Lezama, L.","Structural, magnetic and magnetotransport properties of La0.7 Pb0.3Mn0.9 TM0.1 O3 (TM = Fe, Co, Ni) CMR perovskites","Journal of Physics: Condensed Matter","2000","12","","10523","10534","","","","","","","","","","","","","","","","","","","","","","has coordinates","140749","2020-10-21","18:00:00",""
"1521113","10.0082","","3.3771","","11.8173","","90","","90","","90","","399.409","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Sr Tm2 O4","","- O4 Sr Tm2 -","- O4 Sr Tm2 -","- O16 Sr4 Tm8 -","4","0.5","","Han, C.Q.; Chen, X.L.; Liang, J.K.; Chen, Y.; Liu, Q.L.; Rao, G.-H.","The ternary system Tm2 O3 - Sr O - Cu O : compounds and phase relations","Journal of Alloys Compd.","2000","309","","95","99","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521115","5.8341","","5.8436","","8.2559","","90","","90.195","","90","","281.46","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Sr2 (Ce Ir O6)","","- Ce Ir O6 Sr2 -","- Ce Ir O6 Sr2 -","- Ce2 Ir2 O12 Sr4 -","2","0.5","","Harada, D.; Hinatsu, Y.; Wakeshima, M.; Ohoyama, K.; Yamaguchi, Y.","Magnetic and neutron diffraction study on iridium(IV) perovskites Sr2 Ln Ir O6 (Ln = Ce, Tb)","Journal of Physics: Condensed Matter","2000","12","","3229","3239","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521116","5.7604","","5.7506","","8.1371","","90","","90.089","","90","","269.547","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Sr2 (Tb Ir O6)","","- Ir O6 Sr2 Tb -","- Ir O6 Sr2 Tb -","- Ir2 O12 Sr4 Tb2 -","2","0.5","","Harada, D.; Wakeshima, M.; Hinatsu, Y.; Ohoyama, K.; Yamaguchi, Y.","Magnetic and neutron diffraction study on iridium(IV) perovskites Sr2 Ln Ir O6 (Ln = Ce, Tb)","Journal of Physics: Condensed Matter","2000","12","","3229","3239","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521117","10.9459","","6.3197","","16.839","","90","","104.943","","90","","1125.44","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- Ca5 Cu6 O12 -","- Ca5 Cu6 O12 -","- Ca20 Cu24 O48 -","4","1","","Galez, P.; Lomello-Tafin, M.; Opagiste, C.; Bertrand, C.; Hopfinger, T.","Crystal structure of Ca4.78 Cu6 O11.60","Journal of Solid State Chemistry","2000","151","","170","180","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521118","10.9456","","6.3192","","16.84079","","90","","104.952","","90","","1125.4","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- Ca4.78 Cu6 O11.6 -","- Ca4.78 Cu6 O11.6 -","- Ca19.12 Cu24 O46.4 -","4","1","","Galez, P.; Lomello-Tafin, M.; Hopfinger, T.; Opagiste, C.; Bertrand, C.","Crystal structure of Ca4.78 Cu6 O11.60","Journal of Solid State Chemistry","2000","151","","170","180","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521125","12.018","","12.565","","6.415","","90","","114.33","","90","","882.672","","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Na1.304 Mn0.968 Fe1.9 (P2.842 O11.86)","","- Fe1.9 Mn0.968 Na1.304 O11.86 P2.842 -","- Fe1.9 Mn0.968 Na1.304 O11.86 P2.842 -","- Fe7.6 Mn3.872 Na5.216 O47.44 P11.368 -","4","0.5","","Hatert, F.; Keller, P.; Lissner, F.; Antenucci, D.; Fransolet, A.M.","First experimental evidence of alluaudite-like phosphates with high Li-content: the (Na1-x Lix) Mn Fe2 (P O4)3 series (x=0 to 1)","European Journal of Mineralogy (1,1989-)","2000","12","","847","857","","","","","","","","","","","","","","","","","","","","","","has coordinates","140772","2020-10-21","18:00:00",""
"1521126","5.442","","5.4538","","7.6792","","90","","90","","90","","227.915","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","(La0.6 Ca0.4) Mn O3","","- Ca0.4 La0.6 Mn O3 -","- Ca0.4 La0.6 Mn O3 -","- Ca1.6 La2.4 Mn4 O12 -","4","0.5","","Ganguly, R.; Siruguri, V.; Gopalakrishnan, I.K.; Yakhmi, J.V.","Stability of the layered Sr3 Ti2 O7 structure in La1.2 (Sr1-x Cax)1.8 Mn2 O7","Journal of Physics: Condensed Matter","2000","12","","1683","1689","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521127","11.988","","12.5","","6.392","","90","","114.67","","90","","870.416","","","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Na0.712 Li0.508 Mn0.908 Fe1.8 (P2.732 O11.4)","","- Fe1.8 Li0.508 Mn0.908 Na0.712 O11.4 P2.732 -","- Fe1.8 Li0.508 Mn0.908 Na0.712 O11.4 P2.732 -","- Fe7.2 Li2.032 Mn3.632 Na2.848 O45.6 P10.928 -","4","0.5","","Hatert, F.; Keller, P.; Lissner, F.; Antenucci, D.; Fransolet, A.M.","First experimental evidence of alluaudite-like phosphates with high Li-content: the (Na1-x Lix) Mn Fe2 (P O4)3 series (x=0 to 1)","European Journal of Mineralogy (1,1989-)","2000","12","","847","857","","","","","","","","","","","","","","","","","","","","","","has coordinates","140774","2020-10-21","18:00:00",""
"1521128","3.815","","3.815","","13.305","","90","","90","","90","","193.644","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","(La1.85 Sr0.15) (Cu0.87 Zn0.13) O3.91","","- Cu0.87 La1.85 O3.91 Sr0.15 Zn0.13 -","- Cu0.87 La1.85 O3.91 Sr0.15 Zn0.13 -","- Cu1.74 La3.7 O7.82 Sr0.3 Zn0.26 -","2","0.0625","","Ganguly, R.; Rajagopal, H.; Sequeira, A.; Yakhmi, J.V.","Structural features of La1.85 Sr0.15 Cu O4 as influenced by substitution of Zn: neutron diffraction studies","Journal of Superconductivity","2000","13","","163","170","","","","","","","","","","","","","","","","","","","","","","has coordinates","140775","2020-10-21","18:00:00",""
"1521130","3.8213","","3.8213","","13.242","","90","","90","","90","","193.364","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","(La1.85 Sr0.15) (Cu0.84 Zn0.16) O3.94","","- Cu0.84 La1.85 O3.94 Sr0.15 Zn0.16 -","- Cu0.84 La1.85 O3.94 Sr0.15 Zn0.16 -","- Cu1.68 La3.7 O7.88 Sr0.3 Zn0.32 -","2","0.0625","","Ganguly, R.; Rajagopal, H.; Sequeira, A.; Yakhmi, J.V.","Structural features of La1.85 Sr0.15 Cu O4 as influenced by substitution of Zn: neutron diffraction studies","Journal of Superconductivity","2000","13","","163","170","","","","","","","","","","","","","","","","","","","","","","has coordinates","140777","2020-10-21","18:00:00",""
"1521132","5.389","","5.417","","13.238","","90","","90","","90","","386.447","","","","","","","","","","","","","5","B m a b","-B 2ab 2","64","","(La1.84 Sr0.15) (Cu0.84 Zn0.16) O3.96","","- Cu0.84 La1.84 O3.96 Sr0.15 Zn0.16 -","- Cu0.84 La1.84 O3.96 Sr0.15 Zn0.16 -","- Cu3.36 La7.36 O15.84 Sr0.6 Zn0.64 -","4","","","Ganguly, R.; Rajagopal, H.; Sequeira, A.; Yakhmi, J.V.","Structural features of La1.85 Sr0.15 Cu O4 as influenced by substitution of Zn: neutron diffraction studies","Journal of Superconductivity","2000","13","","163","170","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521133","5.425","","5.455","","13.123","","90","","90","","90","","388.354","","","","","","","","","","","","","5","B m a b","-B 2ab 2","64","","(La1.82 Sr0.15) (Cu0.59 Zn0.41) O3.96","","- Cu0.59 La1.82 O3.96 Sr0.15 Zn0.41 -","- Cu0.59 La1.82 O3.96 Sr0.15 Zn0.41 -","- Cu2.36 La7.28 O15.84 Sr0.6 Zn1.64 -","4","","","Ganguly, R.; Rajagopal, H.; Sequeira, A.; Yakhmi, J.V.","Structural features of La1.85 Sr0.15 Cu O4 as influenced by substitution of Zn: neutron diffraction studies","Journal of Superconductivity","2000","13","","163","170","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521135","9.776","","17.919","","5.292","","90","","104.05","","90","","899.299","","","","","","","","","","","","","11","C 1 2/m 1","-C 2y","12","","(Na0.82 K0.18) (Na1.84 Fe0.06 Ca0.08) (Mg3.09 Mn0.37 Fe0.65 Ti0.86 Al0.03) Si8 O22 (O1.54 (O H)0.46)","","- Al0.03 Ca0.08 Fe0.71 H0.46 K0.18 Mg3.09 Mn0.37 Na2.66 O24 Si8 Ti0.86 -","- Al0.03 Ca0.08 Fe0.71 K0.18 Mg3.09 Mn0.37 Na2.66 O24 Si8 Ti0.86 -","- Al0.06 Ca0.16 Fe1.42 K0.36 Mg6.18 Mn0.74 Na5.32 O48 Si16 Ti1.72 -","2","0.25","","Hawthorne, F.C.; Cooper, M.A.; Grice, J.D.; Ottolini, L.","A new anhydrous amphibole from the Eifel region, Germany: description and crystal structure of obertiite, Na Na2 (Mg3 Fe(3+) Ti(4+)) Si8 O22 O2","American Mineralogist","2000","85","","236","241","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521149","24.913","","24.913","","24.913","","90","","90","","90","","15462.4","","","","","","","","","","","","","4","F d -3 :2","-F 2uv 2vw 3","203","","In88 (Al92 Si100 O384)","","- Al92 In88 O384 Si100 -","- Al91.9968 In87.9968 O384 Si100.003 -","- Al91.9968 In87.9968 O384 Si100.003 -","1","0.0104167","","Heo, N.-H.; Jung, S.W.; Lim, W.T.; Park, S.W.; Seff, K.","Crystal structures of fully indium-exchanged zeolite X","J. Phys. Chem. B","2000","104","","8372","8381","","","","","","","","","","","","","","","","","","","","","","has coordinates","140816","2020-10-21","18:00:00",""
"1521150","10.6249","","10.3414","","7.5536","","90","","130.745","","90","","628.797","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","K Y (W2 O8)","","- K O8 W2 Y -","- K O8 W2 Y -","- K4 O32 W8 Y4 -","4","0.5","","Gallucci, E.; Goutaudier, C.; Hansen, T.; Cohen-Addad, M.T.; Mentzen, U.O.F.","A neutron diffraction study of nonstoichiometric alpha-(K Y W2 O8)","Journal of Alloys Compd.","2000","306","","227","234","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521151","24.916","","24.916","","24.916","","90","","90","","90","","15468","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","In87 (Al92 Si100 O384)","","- Al92 In87 O384 Si100 -","- Al92.0064 In87.0056 O384 Si99.9936 -","- Al92.0064 In87.0056 O384 Si99.9936 -","1","0.00520833","","Heo, N.-H.; Jung, S.W.; Park, S.W.; Lim, W.T.; Seff, K.","Crystal structures of fully indium-exchanged zeolite X","J. Phys. Chem. B","2000","104","","8372","8381","","","","","","","","","","","","","","","","","","","","","","has coordinates","140818","2020-10-21","18:00:00",""
"1521152","3.9012","","3.9012","","33.292","","90","","90","","90","","506.683","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","(Bi1.8 Sr2.2) (Ti0.8 Nb2.2) O12","","- Bi1.8 Nb2.2 O12 Sr2.2 Ti0.8 -","- Bi1.8 Nb2.2 O12 Sr2.2 Ti0.8 -","- Bi3.6 Nb4.4 O24 Sr4.4 Ti1.6 -","2","0.0625","","Hervoches, C.H.; Lightfoot, P.","Cation disorder in three-layer Aurivillius phases: structural studies of Bi2-x Sr2+x Ti1-x Nb2+x O12 (0 < x <0.8) and Bi4-x Lax Ti3 O12 (x = 1 and 2)","Journal of Solid State Chemistry","2000","153","","66","73","","","","","","","","","","","","","","","","","","","","","","has coordinates","140819","2020-10-21","18:00:00",""
"1521158","20.062","","19.88","","13.387","","90","","90","","90","","5339.17","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Ti0.309 Si11.691 O24","","- O24 Si11.691 Ti0.309 -","- O24 Si11.691 Ti0.309 -","- O192 Si93.528 Ti2.472 -","8","1","","Hijar, C.A.; Jacubinas, R.M.; Henson, N.J.; Eckert, J.; Hay, P.J.; Ott, K.C.","The siting of Ti in TS-1 is non-random. Powder neutron diffraction studies and theoretical calculations of TS-1 and FeS=1","J. Phys. Chem. B","2000","104","","12157","12164","","","","","","","","","","","","","","","","","","","","","","has coordinates","140825","2020-10-21","18:00:00",""
"1521159","4.6085","","4.6085","","2.9817","","90","","90","","90","","63.326","","","","","","","","","","","","","3","P 42/m n m","-P 4n 2n","136","","(Ti0.9 Sn0.1) O2","","- O2 Sn0.1 Ti0.9 -","- O2 Sn0.1 Ti0.9 -","- O4 Sn0.2 Ti1.8 -","2","0.125","","Hirata, T.","Oxygen position, octahedral distortion, and bond-valence parameter from bond lengths in Ti1-x Snx O2 (0<x<1)","Journal of the American Ceramic Society","2000","83","","3205","3207","","","","","","","","","","","","","","","","","","","","","","has coordinates","140826","2020-10-21","18:00:00",""
"1521160","4.6229","","4.6229","","3.0044","","90","","90","","90","","64.208","","","","","","","","","","","","","3","P 42/m n m","-P 4n 2n","136","","(Ti0.8 Sn0.2) O2","","- O2 Sn0.2 Ti0.8 -","- O2 Sn0.2 Ti0.8 -","- O4 Sn0.4 Ti1.6 -","2","0.125","","Hirata, T.","Oxygen position, octahedral distortion, and bond-valence parameter from bond lengths in Ti1-x Snx O2 (0<x<1)","Journal of the American Ceramic Society","2000","83","","3205","3207","","","","","","","","","","","","","","","","","","","","","","has coordinates","140827","2020-10-21","18:00:00",""
"1521161","4.6372","","4.6372","","3.0272","","90","","90","","90","","65.096","","","","","","","","","","","","","3","P 42/m n m","-P 4n 2n","136","","(Ti0.7 Sn0.3) O2","","- O2 Sn0.3 Ti0.7 -","- O2 Sn0.3 Ti0.7 -","- O4 Sn0.6 Ti1.4 -","2","0.125","","Hirata, T.","Oxygen position, octahedral distortion, and bond-valence parameter from bond lengths in Ti1-x Snx O2 (0<x<1)","Journal of the American Ceramic Society","2000","83","","3205","3207","","","","","","","","","","","","","","","","","","","","","","has coordinates","140828","2020-10-21","18:00:00",""
"1521162","4.6517","","4.6517","","3.0499","","90","","90","","90","","65.995","","","","","","","","","","","","","3","P 42/m n m","-P 4n 2n","136","","(Ti0.6 Sn0.4) O2","","- O2 Sn0.4 Ti0.6 -","- O2 Sn0.4 Ti0.6 -","- O4 Sn0.8 Ti1.2 -","2","0.125","","Hirata, T.","Oxygen position, octahedral distortion, and bond-valence parameter from bond lengths in Ti1-x Snx O2 (0<x<1)","Journal of the American Ceramic Society","2000","83","","3205","3207","","","","","","","","","","","","","","","","","","","","","","has coordinates","140829","2020-10-21","18:00:00",""
"1521163","4.6661","","4.6661","","3.0727","","90","","90","","90","","66.9","","","","","","","","","","","","","3","P 42/m n m","-P 4n 2n","136","","(Ti0.5 Sn0.5) O2","","- O2 Sn0.5 Ti0.5 -","- O2 Sn0.5 Ti0.5 -","- O4 Sn Ti -","2","0.125","","Hirata, T.","Oxygen position, octahedral distortion, and bond-valence parameter from bond lengths in Ti1-x Snx O2 (0<x<1)","Journal of the American Ceramic Society","2000","83","","3205","3207","","","","","","","","","","","","","","","","","","","","","","has coordinates","140830","2020-10-21","18:00:00",""
"1521164","4.6804","","4.6804","","3.0955","","90","","90","","90","","67.81","","","","","","","","","","","","","3","P 42/m n m","-P 4n 2n","136","","(Ti0.4 Sn0.6) O2","","- O2 Sn0.6 Ti0.4 -","- O2 Sn0.6 Ti0.4 -","- O4 Sn1.2 Ti0.8 -","2","0.125","","Hirata, T.","Oxygen position, octahedral distortion, and bond-valence parameter from bond lengths in Ti1-x Snx O2 (0<x<1)","Journal of the American Ceramic Society","2000","83","","3205","3207","","","","","","","","","","","","","","","","","","","","","","has coordinates","140831","2020-10-21","18:00:00",""
"1521165","4.6948","","4.6948","","3.1182","","90","","90","","90","","68.729","","","","","","","","","","","","","3","P 42/m n m","-P 4n 2n","136","","(Ti0.3 Sn0.7) O2","","- O2 Sn0.7 Ti0.3 -","- O2 Sn0.7 Ti0.3 -","- O4 Sn1.4 Ti0.6 -","2","0.125","","Hirata, T.","Oxygen position, octahedral distortion, and bond-valence parameter from bond lengths in Ti1-x Snx O2 (0<x<1)","Journal of the American Ceramic Society","2000","83","","3205","3207","","","","","","","","","","","","","","","","","","","","","","has coordinates","140832","2020-10-21","18:00:00",""
"1521166","4.7236","","4.7236","","3.1637","","90","","90","","90","","70.59","","","","","","","","","","","","","3","P 42/m n m","-P 4n 2n","136","","(Ti0.1 Sn0.9) O2","","- O2 Sn0.9 Ti0.1 -","- O2 Sn0.9 Ti0.1 -","- O4 Sn1.8 Ti0.2 -","2","0.125","","Hirata, T.","Oxygen position, octahedral distortion, and bond-valence parameter from bond lengths in Ti1-x Snx O2 (0<x<1)","Journal of the American Ceramic Society","2000","83","","3205","3207","","","","","","","","","","","","","","","","","","","","","","has coordinates","140833","2020-10-21","18:00:00",""
"1521167","4.7092","","4.7092","","3.141","","90","","90","","90","","69.657","","","","","","","","","","","","","3","P 42/m n m","-P 4n 2n","136","","(Ti0.2 Sn0.8) O2","","- O2 Sn0.8 Ti0.2 -","- O2 Sn0.8 Ti0.2 -","- O4 Sn1.6 Ti0.4 -","2","0.125","","Hirata, T.","Oxygen position, octahedral distortion, and bond-valence parameter from bond lengths in Ti1-x Snx O2 (0<x<1)","Journal of the American Ceramic Society","2000","83","","3205","3207","","","","","","","","","","","","","","","","","","","","","","has coordinates","140834","2020-10-21","18:00:00",""
"1521169","15.537","","15.537","","4.799","","90","","90","","90","","1158.47","","","","","","","","","","","","","3","I 41/a m d :2","-I 4bd 2","141","","Cu Cl Te","","- Cl Cu Te -","- Cl Cu Te -","- Cl16 Cu16 Te16 -","16","0.5","","Hirota, M.; Arai, M.; Sakuma, T.; Ishii, Y.","Neutron diffraction study of Cu Cl Te","Electrochemistry (Tokyo)","2000","68","","522","525","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521170","10.929","","10.929","","7.698","","90","","90","","90","","919.473","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","Sr8 Fe8 O23","","- Fe8 O23 Sr8 -","- Fe8 O23 Sr8 -","- Fe16 O46 Sr16 -","2","0.0625","","Hodges, J.P.; Short, S.; Mini, S.M.; Jorgensen, J.D.; Xiong, X.; Kimball, C.W.; Dabrowski, B.","Evolution of oxygen-vacancy ordered crystal structures in the perovskite series Srn Fen O3n-1 (n = 2, 4, 8 and infinity), and the relationship to electronic and magnetic properties","Journal of Solid State Chemistry","2000","151","","190","209","","","","","","","","","","","","","","","","","","","","","","has coordinates","140837","2020-10-21","18:00:00",""
"1521171","10.974","","7.702","","5.473","","90","","90","","90","","462.588","","","","","","","","","","","","","3","C m m m","-C 2 2","65","","Sr4 Fe4 O11","","- Fe4 O11 Sr4 -","- Fe4 O11 Sr4 -","- Fe8 O22 Sr8 -","2","0.125","","Hodges, J.P.; Kimball, C.W.; Short, S.; Jorgensen, J.D.; Dabrowski, B.; Xiong, X.; Mini, S.M.","Evolution of oxygen-vacancy ordered crystal structures in the perovskite series Srn Fen O3n-1 (n = 2, 4, 8 and infinity), and the relationship to electronic and magnetic properties","Journal of Solid State Chemistry","2000","151","","190","209","","","","","","","","","","","","","","","","","","","","","","has coordinates","140838","2020-10-21","18:00:00",""
"1521173","4.0432","","4.0432","","10.9408","","90","","90","","90","","178.854","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","Yb Mn2 Ge2","","- Ge2 Mn2 Yb -","- Ge2 Mn2 Yb -","- Ge4 Mn4 Yb2 -","2","0.0625","","Hofmann, M.; Campbell, S.J.; Szytula, A.","Antiferromagnetism in Yb Mn2 Ge2 - Mn magnetic sublattice","Journal of Alloys Compd.","2000","311","","137","142","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521175","5.3504","","5.3504","","13.0474","","90","","90","","120","","323.465","","","","","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","Pr (Al O3)","","- Al O3 Pr -","- Al O3 Pr -","- Al6 O18 Pr6 -","6","0.166667","","Howard, C.J.; Kennedy, B.J.; Chakoumakos, B.C.","Neutron powder diffraction study of rhombohedral rare-earth aluminates and the rhombohedral to cubic phase transition","Journal of Physics: Condensed Matter","2000","12","","349","365","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521176","5.623","","5.623","","7.964","","90","","90","","90","","251.807","","","","","","","","","","","","","5","I 4/m","-I 4","87","","Ba La Mg Ru O6","","- Ba La Mg O6 Ru -","- Ba La Mg O6 Ru -","- Ba2 La2 Mg2 O12 Ru2 -","2","0.125","","Hong, K.-P.; Choi, Y.-H.; Jung, D.-Y.; Kwon, Y.-U.; Lee, J.-S.; Lee, C.-H.; Shim, H.-S.","Atomic and magnetic long-range orderings in Ba La M Ru O6 (M = Mg and Zn)","Journal of Solid State Chemistry","2000","150","","383","390","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521177","5.6521","","5.6521","","7.9987","","90","","90","","90","","255.528","","","","","","","","","","","","","5","I 4/m","-I 4","87","","Ba La Zn Ru O6","","- Ba La O6 Ru Zn -","- Ba La O6 Ru Zn -","- Ba2 La2 O12 Ru2 Zn2 -","2","0.125","","Hong, K.-P.; Choi, Y.-H.; Jung, D.-Y.; Kwon, Y.-U.; Shim, H.-S.; Lee, J.-S.; Lee, C.-H.","Atomic and magnetic long-range orderings in Ba La M Ru O6 (M = Mg and Zn)","Journal of Solid State Chemistry","2000","150","","383","390","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521178","5.3391","","5.3391","","12.9958","","90","","90","","120","","320.826","","","","","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","Nd (Al O3)","","- Al Nd O3 -","- Al Nd O3 -","- Al6 Nd6 O18 -","6","0.166667","","Howard, C.J.; Chakoumakos, B.C.; Kennedy, B.J.","Neutron powder diffraction study of rhombohedral rare-earth aluminates and the rhombohedral to cubic phase transition","Journal of Physics: Condensed Matter","2000","12","","349","365","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521184","16.95679","","18.8631","","24.16399","","100.11","","92.33","","113.368","","6932.7","","","","","","","","","","","","","5","P -1","-P 1","2","","(N H4)11 Gd (Gd4 Mo29 O100 (H2 O)23) (H2 O)25.75","","- Gd5 H141.5 Mo29 N11 O148.75 -","- Gd5 Mo29 N11 O148.75 -","- Gd10 Mo58 N22 O297.5 -","2","1","","Huang, J.-F.; Cai, X.Z.; Lin, S.; Wang, S.-M.; Lin, X.","Synthesis and crystal structure of lanthanide heteromolybdate complex (N H4)11 Gd (Gd4 Mo29 O100 (H2 O)23) . 25.75(H2 O)","Jiegon Huaxue","2000","19","","432","439","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521185","4.1834","","14.308","","14.439","","90","","90","","90","","864.262","","","","","","","","","","","","","4","C m c m","-C 2c 2","63","","Rb Sm2 Cu Se4","","- Cu Rb Se4 Sm2 -","- Cu Rb Se4 Sm2 -","- Cu4 Rb4 Se16 Sm8 -","4","0.25","","Huang, F.Q.; Ibers, J.A.","Syntheses and structures of the new quaternary rubidium selenides Rb Ln2 Cu Se4 (Ln = Sm, Gd, Dy), Rb1.5 Ln2 Cu2.5 Se5 (Ln = Gd, Dy),and Rb Sm2 Ag3 Se5","Journal of Solid State Chemistry","2000","151","","317","322","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521186","4.1568","","14.227","","14.409","","90","","90","","90","","852.131","","","","","","","","","","","","","4","C m c m","-C 2c 2","63","","Rb Gd2 Cu Se4","","- Cu Gd2 Rb Se4 -","- Cu Gd2 Rb Se4 -","- Cu4 Gd8 Rb4 Se16 -","4","0.25","","Huang, F.Q.; Ibers, J.A.","Syntheses and structures of the new quaternary rubidium selenides Rb Ln2 Cu Se4 (Ln = Sm, Gd, Dy), Rb1.5 Ln2 Cu2.5 Se5 (Ln = Gd, Dy),and Rb Sm2 Ag3 Se5","Journal of Solid State Chemistry","2000","151","","317","322","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521188","4.1237","","14.083","","14.291","","90","","90","","90","","829.936","","","","","","","","","","","","","4","C m c m","-C 2c 2","63","","Rb Dy2 Cu Se4","","- Cu Dy2 Rb Se4 -","- Cu Dy2 Rb Se4 -","- Cu4 Dy8 Rb4 Se16 -","4","0.25","","Huang, F.Q.; Ibers, J.A.","Syntheses and structures of the new quaternary rubidium selenides Rb Ln2 Cu Se4 (Ln = Sm, Gd, Dy), Rb1.5 Ln2 Cu2.5 Se5 (Ln = Gd, Dy),and Rb Sm2 Ag3 Se5","Journal of Solid State Chemistry","2000","151","","317","322","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521189","16.243","","16.449","","4.098","","90","","90","","90","","1094.91","","","","","","","","","","","","","4","P n n m","-P 2 2n","58","","Rb1.5 Gd2 Cu2.5 Se5","","- Cu2.5 Gd2 Rb1.5 Se5 -","- Cu2.497 Gd2 Rb1.5 Se5 -","- Cu9.988 Gd8 Rb6 Se20 -","4","0.5","","Huang, F.Q.; Ibers, J.A.","Syntheses and structures of the new quaternary rubidium selenides Rb Ln2 Cu Se4 (Ln = Sm, Gd, Dy), Rb1.5 Ln2 Cu2.5 Se5 (Ln = Gd, Dy),and Rb Sm2 Ag3 Se5","Journal of Solid State Chemistry","2000","151","","317","322","","","","","","","","","","","","","","","","","","","","","","has coordinates","140866","2020-10-21","18:00:00",""
"1521190","5.3598","","5.3598","","13.0859","","90","","90","","120","","325.56","","","","","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","La (Al O3)","","- Al La O3 -","- Al La O3 -","- Al6 La6 O18 -","6","0.166667","","Howard, C.J.; Kennedy, B.J.; Chakoumakos, B.C.","Neutron powder diffraction study of rhombohedral rare-earth aluminates and the rhombohedral to cubic phase transition","Journal of Physics: Condensed Matter","2000","12","","349","365","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521191","16.12","","16.292","","4.061","","90","","90","","90","","1066.53","","","","","","","","","","","","","4","P n n m","-P 2 2n","58","","Rb1.5 Dy2 Cu2.5 Se5","","- Cu2.5 Dy2 Rb1.5 Se5 -","- Cu2.512 Dy2 Rb1.5 Se5 -","- Cu10.048 Dy8 Rb6 Se20 -","4","0.5","","Huang, F.Q.; Ibers, J.A.","Syntheses and structures of the new quaternary rubidium selenides Rb Ln2 Cu Se4 (Ln = Sm, Gd, Dy), Rb1.5 Ln2 Cu2.5 Se5 (Ln = Gd, Dy),and Rb Sm2 Ag3 Se5","Journal of Solid State Chemistry","2000","151","","317","322","","","","","","","","","","","","","","","","","","","","","","has coordinates","140868","2020-10-21","18:00:00",""
"1521192","5.4044","","14.5145","","4.7052","","90","","102.798","","90","","359.917","","","","","","","","","","","","","8","P 1 21/a 1","-P 2yab","14","","(Mn0.776 Fe0.229 Mg0.007) Be (P O4) ((O H)0.92 F0.08)","","- Be F0.08 Fe0.229 H0.92 Mg0.007 Mn0.776 O4.92 P -","- Be F0.08 Fe0.229 H0.92 Mg0.007 Mn0.776 O4.92 P -","- Be4 F0.32 Fe0.916 H3.68 Mg0.028 Mn3.104 O19.68 P4 -","4","1","","Huminicki, D.M.C.; Hawthorne, F.C.","Refinement of the crystal structure of vayrynenite","Canadian Mineralogist","2000","38","","1425","1432","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521195","3.8116","","3.8116","","3.8116","","90","","90","","90","","55.376","","","","","","","","","","","","","3","P m -3 m","-P 4 2 3","221","","La (Al O3)","","- Al La O3 -","- Al La O3 -","- Al La O3 -","1","0.0208333","","Howard, C.J.; Kennedy, B.J.; Chakoumakos, B.C.","Neutron powder diffraction study of rhombohedral rare-earth aluminates and the rhombohedral to cubic phase transition","Journal of Physics: Condensed Matter","2000","12","","349","365","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521212","5.4284","","5.4284","","8.8826","","90","","90","","120","","226.681","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","Zr Cr2 D3.83","","- Cr2 D3.83 Zr -","- Cr2 D3.83 Zr -","- Cr8 D15.32 Zr4 -","4","0.166667","","Irodova, A.V.; Suard, E.","Order-disorder phase transition in the deuterated hexagonal (C14-type) Laves phase Zr Cr2 D3.8","Journal of Alloys Compd.","2000","299","","32","38","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521213","4.172","","4.172","","12.244","","90","","90","","90","","213.114","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Ba2 Nb4 (Nb0.9 Zr0.1) O9","","- Ba2 Nb4.9 O9 Zr0.1 -","- Ba2 Nb4.9 O9 Zr0.1 -","- Ba2 Nb4.9 O9 Zr0.1 -","1","0.0625","","Iwasaki, K.; Takizawa, H.; Uheda, K.; Endo, T.; Shimada, M.","Synthesis and electrical properties of Ba2 Nb5-x Zrx O9","Journal of Alloys Compd.","2000","308","","109","114","","","","","","","","","","","","","","","","","","","","","","has coordinates","140894","2020-10-21","18:00:00",""
"1521214","9.3848","","9.3848","","26.5461","","90","","90","","120","","2024.8","","","","","","","","","","","","","3","R 3 :H","R 3","146","","Zr Cr2 D3.804","","- Cr2 D3.804 Zr -","- Cr2 D3.8035 Zr -","- Cr72 D136.926 Zr36 -","36","4","","Irodova, A.V.; Suard, E.","Order-disorder phase transition in the deuterated hexagonal (C14-type) Laves phase Zr Cr2 D3.8","Journal of Alloys Compd.","2000","299","","32","38","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521215","5.4756","","5.4248","","9.474","","90","","125.31","","90","","229.646","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Zr V2 D2.8","","- D2.8 V2 Zr -","- D2.8 V2 Zr -","- D11.2 V8 Zr4 -","4","1","","Irodova, A.V.; Andre, G.; Bouree, F.","Phase transition between hydrogen superstructures with k=(001) and k=0 via incommensurate phase in Zr V2 Dx (2.8 <x <3.9)","Journal of Alloys Compd.","2000","302","","159","168","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521216","5.4854","","5.4854","","7.9231","","90","","90","","90","","238.403","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","Zr V2 D3.9","","- D3.9 V2 Zr -","- D3.9 V2 Zr -","- D15.6 V8 Zr4 -","4","0.25","","Irodova, A.V.; Andre, G.; Bouree, F.","Phase transition between hydrogen superstructures with k=(001) and k=0 via incommensurate phase in Zr V2 Dx (2.8 <x <3.9)","Journal of Alloys Compd.","2000","302","","159","168","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521221","10.1752","","10.1752","","10.1752","","90","","90","","90","","1053.49","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","Y2 ((Mn Sb) O6) O","","- Mn O7 Sb Y2 -","- Mn O7 Sb Y2 -","- Mn8 O56 Sb8 Y16 -","8","0.0416667","","Ismunandar; Kennedy, B.J.; Hunter, B.A.","Structural and magnetic studies of manganese-containing pyrochlore oxides","Journal of Alloys Compd.","2000","302","","94","100","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521223","10.3478","","10.3478","","10.3478","","90","","90","","90","","1108.01","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","Sm2 ((Mn Sb) O6) O","","- Mn O7 Sb Sm2 -","- Mn O7 Sb Sm2 -","- Mn8 O56 Sb8 Sm16 -","8","0.0416667","","Ismunandar; Kennedy, B.J.; Hunter, B.A.","Structural and magnetic studies of manganese-containing pyrochlore oxides","Journal of Alloys Compd.","2000","302","","94","100","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521225","10.316","","10.316","","10.316","","90","","90","","90","","1097.83","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","Eu2 ((Mn Sb) O6) O","","- Eu2 Mn O7 Sb -","- Eu2 Mn O7 Sb -","- Eu16 Mn8 O56 Sb8 -","8","0.0416667","","Ismunandar; Kennedy, B.J.; Hunter, B.A.","Structural and magnetic studies of manganese-containing pyrochlore oxides","Journal of Alloys Compd.","2000","302","","94","100","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521227","10.2832","","10.2832","","10.2832","","90","","90","","90","","1087.39","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","Gd2 ((Mn Sb) O6) O","","- Gd2 Mn O7 Sb -","- Gd2 Mn O7 Sb -","- Gd16 Mn8 O56 Sb8 -","8","0.0416667","","Ismunandar; Kennedy, B.J.; Hunter, B.A.","Structural and magnetic studies of manganese-containing pyrochlore oxides","Journal of Alloys Compd.","2000","302","","94","100","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521229","10.2428","","10.2428","","10.2428","","90","","90","","90","","1074.62","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","Tb2 ((Mn Sb) O6) O","","- Mn O7 Sb Tb2 -","- Mn O7 Sb Tb2 -","- Mn8 O56 Sb8 Tb16 -","8","0.0416667","","Ismunandar; Kennedy, B.J.; Hunter, B.A.","Structural and magnetic studies of manganese-containing pyrochlore oxides","Journal of Alloys Compd.","2000","302","","94","100","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521231","10.2151","","10.2151","","10.2151","","90","","90","","90","","1065.93","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","Dy2 ((Mn Sb) O6) O","","- Dy2 Mn O7 Sb -","- Dy2 Mn O7 Sb -","- Dy16 Mn8 O56 Sb8 -","8","0.0416667","","Ismunandar; Kennedy, B.J.; Hunter, B.A.","Structural and magnetic studies of manganese-containing pyrochlore oxides","Journal of Alloys Compd.","2000","302","","94","100","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521233","10.4997","","10.4997","","10.4997","","90","","90","","90","","1157.53","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","Bi1.81 ((Mn Nb) O6) O0.72","","- Bi1.81 Mn Nb O6.72 -","- Bi1.81 Mn Nb O6.72 -","- Bi14.48 Mn8 Nb8 O53.76 -","8","0.0416667","","Ismunandar; Kennedy, B.J.; Hunter, B.A.","Structural and magnetic studies of manganese-containing pyrochlore oxides","Journal of Alloys Compd.","2000","302","","94","100","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521234","10.4402","","10.4402","","10.4402","","90","","90","","90","","1137.96","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","Bi1.75 ((Mn Ta) O6) O0.62","","- Bi1.75 Mn O6.62 Ta -","- Bi1.75 Mn O6.62 Ta -","- Bi14 Mn8 O52.96 Ta8 -","8","0.0416667","","Ismunandar; Kennedy, B.J.; Hunter, B.A.","Structural and magnetic studies of manganese-containing pyrochlore oxides","Journal of Alloys Compd.","2000","302","","94","100","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521236","10.4069","","10.4069","","10.4069","","90","","90","","90","","1127.1","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","Bi1.81 ((Mn Sb) O6) O0.72","","- Bi1.81 Mn O6.72 Sb -","- Bi1.81 Mn O6.72 Sb -","- Bi14.48 Mn8 O53.76 Sb8 -","8","0.0416667","","Ismunandar; Kennedy, B.J.; Hunter, B.A.","Structural and magnetic studies of manganese-containing pyrochlore oxides","Journal of Alloys Compd.","2000","302","","94","100","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521239","7.305","","7.305","","6.394","","90","","90","","90","","341.203","","","","","","","","","","","","","3","I 41/a m d :2","-I 4bd 2","141","","Nd Cr O4","","- Cr Nd O4 -","- Cr Nd O4 -","- Cr4 Nd4 O16 -","4","0.125","","Jimenez, E.; Isasi, J.; Saez-Puche, R.","Synthesis, structural characterization and magnetic properties of R Cr O4 oxides, R = Nd, Sm, Eu and Lu","Journal of Alloys Compd.","2000","312","","53","59","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521241","7.244","","7.244","","6.347","","90","","90","","90","","333.062","","","","","","","","","","","","","3","I 41/a m d :2","-I 4bd 2","141","","Sm (Cr O4)","","- Cr O4 Sm -","- Cr O4 Sm -","- Cr4 O16 Sm4 -","4","0.125","","Jimenez, E.; Isasi, J.; Saez-Puche, R.","Synthesis, structural characterization and magnetic properties of R Cr O4 oxides, R = Nd, Sm, Eu and Lu","Journal of Alloys Compd.","2000","312","","53","59","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521246","3.96291","","3.96291","","3.96291","","90","","90","","90","","62.236","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","(Na0.6 Sr0.4) (Ta O3)","","- Na0.6 O3 Sr0.4 Ta -","- Na0.6 O3 Sr0.4 Ta -","- Na0.6 O3 Sr0.4 Ta -","1","0.0208333","","Istomin, S.Ya.; Svensson, G.; Hannerz, H.; Koehler, J.","An X-ray powder and electron diffraction study of reduced tantalates with the perovskite structure, Na1-x Srx Ta O3, 0<x<4","Journal of Solid State Chemistry","2000","154","","427","434","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521248","3.94756","","3.94756","","3.93993","","90","","90","","90","","61.397","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","(Na0.7 Sr0.3) (Ta O3)","","- Na0.7 O3 Sr0.3 Ta -","- Na0.7 O3 Sr0.3 Ta -","- Na0.7 O3 Sr0.3 Ta -","1","0.0625","","Istomin, S.Ya.; Hannerz, H.; Svensson, G.; Koehler, J.","An X-ray powder and electron diffraction study of reduced tantalates with the perovskite structure, Na1-x Srx Ta O3, 0<x<4","Journal of Solid State Chemistry","2000","154","","427","434","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521251","6.007","","3.602","","6.897","","90","","90","","90","","149.232","","","","","","","","","","","","","8","P n m a","-P 2ac 2n","62","","Fe (Ti0.87 Ni0.13 Cr0.03 V0.02 Co0.01) (P0.97 Si0.03)","","- Co0.01 Cr0.03 Fe Ni0.13 P0.97 Si0.03 Ti0.87 V0.02 -","- Co0.01 Cr0.03 Fe Ni0.13 P0.97 Si0.03 Ti0.87 V0.02 -","- Co0.04 Cr0.12 Fe4 Ni0.52 P3.88 Si0.12 Ti3.48 V0.08 -","4","0.5","","Ivanov, A.V.; Mikouchi, T.; Zolensky, M.E.; Saito, A.; Yang, S.V.; Ohsumi, K.; Kononkova, N.N.","Florenskyite, Fe Ti P, a new phosphide from the Kaidun meteorite","American Mineralogist","2000","85","","1082","1086","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521252","4.0123","","4.0123","","4.0123","","89.98","","89.98","","89.98","","64.592","","","","","","","","","","","","","4","R 3 m :R","P 3* -2","160","","Pb ((Fe Nb) O6)0.5","","- Fe0.5 Nb0.5 O3 Pb -","- Fe0.5 Nb0.5 O3 Pb -","- Fe0.5 Nb0.5 O3 Pb -","1","0.166667","","Ivanov, S.A.; Tellgren, R.; Thomas, N.W.; Rundlof, H.; Ananta, S.","Investigation of the structure of the relaxor ferroelectric Pb (Fe1/2 Nb1/2) O3 by neutron diffraction","Journal of Physics: Condensed Matter","2000","12","","2393","2400","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521254","7.9655","","7.9483","","7.9735","","90","","90.534","","90","","504.798","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","La0.96 (Mg0.655 Nb0.333) O3","","- La0.96 Mg0.655 Nb0.333 O3 -","- La0.96 Mg0.655 Nb0.3325 O3 -","- La7.68 Mg5.24 Nb2.66 O24 -","8","2","","Ivanov, S.A.; Thomas, N.W.; Ananta, S.; Rundlof, H.; Tellgren, R.","The perovskite system La (Mg2/3 Nb1/3) O3. II. A neutron powder diffraction study","Journal of the European Ceramic Society","2000","20","","2325","2329","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521255","3.9039","","3.9039","","4.1348","","90","","90","","90","","63.016","","","","","","","","","","","","","3","P 4 m m","P 4 -2","99","","Pb (Ti O3)","","- O3 Pb Ti -","- O3 Pb Ti -","- O3 Pb Ti -","1","0.125","","Joseph, J.; Vimala, T.M.; Sivasubramanian, V.; Murthy, V.R.K.","Structural investigations on Pb (Zrx Ti1-x) O3 solid solutions using the X-ray Rietveld method","Journal of Materials Science","2000","35","","1571","1575","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521257","3.9539","","3.9539","","4.1319","","90","","90","","90","","64.595","","","","","","","","","","","","","4","P 4 m m","P 4 -2","99","","Pb (Zr0.2 Ti0.8) O3","","- O3 Pb Ti0.8 Zr0.2 -","- O3 Pb Ti0.8 Zr0.2 -","- O3 Pb Ti0.8 Zr0.2 -","1","0.125","","Joseph, J.; Vimala, T.M.; Murthy, V.R.K.; Sivasubramanian, V.","Structural investigations on Pb (Zrx Ti1-x) O3 solid solutions using the X-ray Rietveld method","Journal of Materials Science","2000","35","","1571","1575","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521259","3.9862","","3.9862","","4.1331","","90","","90","","90","","65.674","","","","","","","","","","","","","4","P 4 m m","P 4 -2","99","","Pb (Zr0.3 Ti0.7) O3","","- O3 Pb Ti0.7 Zr0.3 -","- O3 Pb Ti0.7 Zr0.3 -","- O3 Pb Ti0.7 Zr0.3 -","1","0.125","","Joseph, J.; Vimala, T.M.; Sivasubramanian, V.; Murthy, V.R.K.","Structural investigations on Pb (Zrx Ti1-x) O3 solid solutions using the X-ray Rietveld method","Journal of Materials Science","2000","35","","1571","1575","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521261","4.0081","","4.0081","","4.1341","","90","","90","","90","","66.414","","","","","","","","","","","","","4","P 4 m m","P 4 -2","99","","Pb (Zr0.4 Ti0.6) O3","","- O3 Pb Ti0.6 Zr0.4 -","- O3 Pb Ti0.6 Zr0.4 -","- O3 Pb Ti0.6 Zr0.4 -","1","0.125","","Joseph, J.; Vimala, T.M.; Sivasubramanian, V.; Murthy, V.R.K.","Structural investigations on Pb (Zrx Ti1-x) O3 solid solutions using the X-ray Rietveld method","Journal of Materials Science","2000","35","","1571","1575","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521263","5.739","","5.739","","14.1339","","90","","90","","120","","403.149","","","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","","Pb (Zr0.4 Ti0.6) O3","","- O3 Pb Ti0.6 Zr0.4 -","- O3 Pb Ti0.6 Zr0.4 -","- O9 Pb3 Ti1.8 Zr1.2 -","3","0.166667","","Joseph, J.; Sivasubramanian, V.; Vimala, T.M.; Murthy, V.R.K.","Structural investigations on Pb (Zrx Ti1-x) O3 solid solutions using the X-ray Rietveld method","Journal of Materials Science","2000","35","","1571","1575","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521264","4.171","","4.171","","12.226","","90","","90","","90","","212.699","","","","","","","","","","","","","3","P 4/m m m","-P 4 2","123","","","","- Ba2 Nb5 O9 -","- Ba2 Nb5 O9 -","- Ba2 Nb5 O9 -","1","0.0625","","Iwasaki, K.; Takizawa, H.; Uheda, K.; Shimada, M.; Endo, T.","Synthesis and electrical properties of Ba2 Nb5-x Zrx O9","Journal of Alloys Compd.","2000","308","","109","114","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521265","4.0353","","4.0353","","4.1312","","90","","90","","90","","67.271","","","","","","","","","","","","","4","P 4 m m","P 4 -2","99","","Pb (Zr0.53 Ti0.47) O3","","- O3 Pb Ti0.47 Zr0.53 -","- O3 Pb Ti0.47 Zr0.53 -","- O3 Pb Ti0.47 Zr0.53 -","1","0.125","","Joseph, J.; Murthy, V.R.K.; Sivasubramanian, V.; Vimala, T.M.","Structural investigations on Pb (Zrx Ti1-x) O3 solid solutions using the X-ray Rietveld method","Journal of Materials Science","2000","35","","1571","1575","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521266","5.7651","","5.7651","","14.184","","90","","90","","120","","408.266","","","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","","Pb (Zr0.53 Ti0.47) O3","","- O3 Pb Ti0.47 Zr0.53 -","- O3 Pb Ti0.47 Zr0.53 -","- O18 Pb6 Ti2.82 Zr3.18 -","6","0.333333","","Joseph, J.; Vimala, T.M.; Sivasubramanian, V.; Murthy, V.R.K.","Structural investigations on Pb (Zrx Ti1-x) O3 solid solutions using the X-ray Rietveld method","Journal of Materials Science","2000","35","","1571","1575","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521299","7.3547","","9.222","","15.186","","90","","95.18","","90","","1025.79","","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Na4 Co3 (H P O4)2 (P O4)2 (H2 O)8","","- Co3 H18 Na4 O24 P4 -","- Co3 H18 Na4 O24 P4 -","- Co6 H36 Na8 O48 P8 -","2","0.5","","Mao, S.-Y.; Huang, Y.-X.; Huang, Z.-L.; Wei, Z.-B.; Mi Jinxiao; Zhao, J.-T.","Hydrothermal synthesis, crystal structure, and characterization of tetrasodium tricobalt(II)-bis-phosphate-bis-hydrogenophosphate octahydrate, Na4 Co3 H2 (P O4)4 . 8(H2 O), with a new structure type","Journal of Solid State Chemistry","2000","149","","292","297","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521302","3.8313","","3.8373","","11.5275","","90","","90","","90","","169.476","","","","","","","","","","","","","6","P m m m","-P 2 2","47","","Er Ba Sr Cu2.9 (P O4)0.1 O6.61","","- Ba Cu2.9 Er O7.01 P0.1 Sr -","- Ba Cu2.9 Er O7.01 P0.1 Sr -","- Ba Cu2.9 Er O7.01 P0.1 Sr -","1","0.125","","Marimuthu, K.N.; Malik, S.K.; Varadaraju, U.V.; Raveau, B.; Yelon, W.B.; Hervieu, M.","Electron microscopy and neutron diffraction studies on Er Ba Sr Cu3-x (P O4)x Oy (x = 0.0, 0.10, 0.20)","Journal of Solid State Chemistry","2000","150","","188","195","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521304","3.3318","","3.3318","","57.95","","90","","90","","120","","557.111","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","(Zn0.9 Mg0.1 O)5 In2 O3","","- In2 Mg0.5 O8 Zn4.5 -","- In2 Mg0.5 O8 Zn4.5 -","- In6 Mg1.5 O24 Zn13.5 -","3","0.0833333","","Masuda, Y.; Pitschke, W.; Ohta, M.; Seo, W.-S.; Koumoto, K.","Structure and thermoelectric transport properties of isoelectronically substituted (Zn O)5 In2 O3","Journal of Solid State Chemistry","2000","150","","221","227","","","","","","","","","","","","","","","","","","","","","","has coordinates","141044","2020-10-21","18:00:00",""
"1521305","3.3284","","3.3284","","58.066","","90","","90","","120","","557.088","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","(Zn0.95 Co0.05 O)5 In2 O3","","- Co0.25 In2 O8 Zn4.75 -","- Co0.27 In1.99 O8 Zn4.75 -","- Co0.81 In5.97 O24 Zn14.25 -","3","0.0833333","","Masuda, Y.; Ohta, M.; Seo, W.-S.; Koumoto, K.; Pitschke, W.","Structure and thermoelectric transport properties of isoelectronically substituted (Zn O)5 In2 O3","Journal of Solid State Chemistry","2000","150","","221","227","","","","","","","","","","","","","","","","","","","","","","has coordinates","141045","2020-10-21","18:00:00",""
"1521311","3.83205","","3.83205","","11.554","","90","","90","","90","","169.666","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","Ru Sr2 Gd Cu2 O8","","- Cu2 Gd O8 Ru Sr2 -","- Cu2 Gd O8 Ru Sr2 -","- Cu2 Gd O8 Ru Sr2 -","1","0.0625","","McLaughlin, A.C.; Attfield, J.P.; Tallon, J.L.","A variable temperature structural study of the ferromagnetic superconductor Ru Sr2 Gd Cu2 O8","International Journal of Inorganic Materials","2000","2","","95","99","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521314","24.73","","24.73","","10.58","","90","","90","","120","","5603.57","","","","","","","","","","","","","2","P 6/m m m","-P 6 2","191","","Si48 O96","","- O96 Si48 -","- O96 Si48 -","- O96 Si48 -","1","0.0416667","","Mellot-Draznieks, C.; Freeman, C.M.; Gorman, A.M.; Newsam, J.M.; Ferey, G.","De novo prediction of inorganic structures developed through automated assembly of secondary building units (AASBU method)","Angew. Chem. Int. ed.","2000","39","","2270","2275","","","","","","","","","","","","","","","","","","","","","","has coordinates","141055","2020-10-21","18:00:00",""
"1521315","13.601","","18.232","","17.81","","90","","90","","90","","4416.41","","","","","","","","","","","","","7","F m m m","-F 2 2","69","","Na0.41 Ca0.63 (N D4)12.8 (Al13.68 Si58.32 O144) (D2 O)36.16","","- Al13.68 Ca0.63 D123.52 N12.8 Na0.41 O180.16 Si58.32 -","- Al13.68 Ca0.632 N12.8 Na0.408 O180.16 Si58.32 -","- Al13.68 Ca0.632 N12.8 Na0.408 O180.16 Si58.32 -","1","0.03125","","Meneghinello, E.; Alberti, A.; Cruciani, G.; Rapacciuolo, M.T.; Sacerdoti, M.; Ciambelli, P.; McIntyre, G.J.","Single crystal neutron diffraction study of the natural zeolite barrerite in its (N D4) - exchanged form","European Journal of Mineralogy (1,1989-)","2000","12","","1123","1129","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521330","5.5108","","5.5084","","7.7964","","90","","90","","90","","236.665","","","","","","","","","","","","","5","P b n m","-P 2c 2ab","62","","(Na0.682 Ce0.318) ((Ti0.834 Nb0.166) O3)","","- Ce0.318 Na0.682 Nb0.166 O3 Ti0.834 -","- Ce0.318 Na0.682 Nb0.166 O3 Ti0.834 -","- Ce1.272 Na2.728 Nb0.664 O12 Ti3.336 -","4","0.5","","Mitchell, R.H.; Burns, P.C.; Chakhmouradian, A.R.","The crystal structures of loparite-(Ce)","Canadian Mineralogist","2000","38","","145","152","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521331","5.5022","","5.5022","","7.7967","","90","","90","","90","","236.039","","","","","","","","","","","","","5","I 4/m c m","-I 4 2c","140","","(Na0.632 Ce0.368) ((Ti0.912 Nb0.088) O3)","","- Ce0.368 Na0.632 Nb0.088 O3 Ti0.912 -","- Ce0.368 Na0.632 Nb0.088 O3 Ti0.912 -","- Ce1.472 Na2.528 Nb0.352 O12 Ti3.648 -","4","0.125","","Mitchell, R.H.; Burns, P.C.; Chakhmouradian, A.R.","The crystal structures of loparite-(Ce)","Canadian Mineralogist","2000","38","","145","152","","","","","","","","","","","","","","","","","","","","","","has coordinates","141077","2020-10-21","18:00:00",""
"1521332","5.5076","","5.5076","","7.7767","","90","","90","","90","","235.896","","","","","","","","","","","","","6","P b n m","-P 2c 2ab","62","","(Na0.536 Ce0.209 Sr0.255) ((Ti0.944 Nb0.056) O3)","","- Ce0.209 Na0.536 Nb0.056 O3 Sr0.255 Ti0.944 -","- Ce0.209 Na0.536 Nb0.056 O3 Sr0.255 Ti0.944 -","- Ce0.836 Na2.144 Nb0.224 O12 Sr1.02 Ti3.776 -","4","0.5","","Mitchell, R.H.; Burns, P.C.; Chakhmouradian, A.R.","The crystal structures of loparite-(Ce)","Canadian Mineralogist","2000","38","","145","152","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521333","10.219","","10.219","","2.963","","90","","90","","90","","309.42","","","","","","","","","","","","","4","I 4/m","-I 4","87","","Ba1.08 (Fe Ti7 O16)","","- Ba1.08 Fe O16 Ti7 -","- Ba1.08 Fe O16 Ti7 -","- Ba1.08 Fe O16 Ti7 -","1","0.0625","","Mitchell, R.H.; Yakovenchuk, V.N.; Chakhmouradian, A.R.; Burns, P.C.; Pakhomovskii, Ya.A.","Henrymeyerite, a new hollandite-type Ba-Fe titanate from the Kovdorcomplex, Russia","Canadian Mineralogist","2000","38","","617","626","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521335","5.5033","","5.5033","","5.5033","","60.461","","60.461","","60.461","","119.085","","","","","","","","","","","","","4","R -3 c :R","-P 3* 2n","167","","(La0.8 Sr0.2) Mn O2.9","","- La0.8 Mn O2.9 Sr0.2 -","- La0.8 Mn O2.901 Sr0.2 -","- La1.6 Mn2 O5.802 Sr0.4 -","2","0.166667","","Mori, T.; Inoue, K.; Kamegashira, N.","Phase behaviour in the system Lax Sr1-x Mn O(5+x)/2 (x=0.8-1.0) with trivalent state of manganese ion","Journal of Alloys Compd.","2000","308","","87","93","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521336","5.5146","","7.792","","5.5437","","90","","90","","90","","238.211","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","(La0.9 Sr0.1) Mn O2.95","","- La0.9 Mn O2.95 Sr0.1 -","- La0.9 Mn O2.9499 Sr0.1 -","- La3.6 Mn4 O11.7996 Sr0.4 -","4","0.5","","Mori, T.; Inoue, K.; Kamegashira, N.","Phase behaviour in the system Lax Sr1-x Mn O(5+x)/2 (x=0.8-1.0) with trivalent state of manganese ion","Journal of Alloys Compd.","2000","308","","87","93","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521337","5.7478","","7.6921","","5.5352","","90","","90","","90","","244.726","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","La (Mn O3)","","- La Mn O3 -","- La Mn O3 -","- La4 Mn4 O12 -","4","0.5","","Mori, T.; Inoue, K.; Kamegashira, N.","Phase behaviour in the system Lax Sr1-x Mn O(5+x)/2 (x=0.8-1.0) with trivalent state of manganese ion","Journal of Alloys Compd.","2000","308","","87","93","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521346","3.9615","","3.9615","","9.149","","90","","90","","90","","143.58","","","","","","","","","","","","","3","P 4/n m m :2","-P 4a 2a","129","","U Co As2","","- As2 Co U -","- As2 Co U -","- As4 Co2 U2 -","2","0.125","","Kaczorowski, D.; Noel, H.; Potel, M.","Crystal structure and magnetic behaviour of U Co As2","Journal of Alloys Compd.","2000","302","","1","4","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521355","16.0195","","16.0195","","16.0195","","90","","90","","90","","4110.99","","","","","","","","","","","","","4","P a -3","-P 2ac 2ab 3","205","","Sr3 ((Al0.36 Ga0.64)2 O6)","","- Al0.72 Ga1.28 O6 Sr3 -","- Al0.72 Ga1.28 O6 Sr3 -","- Al17.28 Ga30.72 O144 Sr72 -","24","1","","Kahlenberg, V.","Sr3 (Al0.36 Ga0.64)2 O6 - a new strontium aluminium gallate","Crystal Research and Technology","2000","35","","1279","1287","","","","","","","","","","","","","","","","","","","","","","has coordinates","141564","2020-10-21","18:00:00",""
"1521357","8.377","","8.994","","10.68","","90","","93.932","","90","","802.766","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Sr (Ga2 O4)","","- Ga2 O4 Sr -","- Ga2 O4 Sr -","- Ga16 O32 Sr8 -","8","2","","Kahlenberg, V.; Fischer, R.X.; Shaw, C.S.J.","Polymorphism of strontium monogallate: the framework structures of beta-(Sr Ga2 O4) and ABW-type gamma-(Sr Ga2 O4)","Journal of Solid State Chemistry","2000","153","","294","300","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521358","8.11","","10.761","","9.057","","90","","91.569","","90","","790.124","","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Sr (Ga2 O4)","","- Ga2 O4 Sr -","- Ga2 O4 Sr -","- Ga16 O32 Sr8 -","8","2","","Kahlenberg, V.; Shaw, C.S.J.; Fischer, R.X.","Polymorphism of strontium monogallate: the framework structures of beta-(Sr Ga2 O4) and ABW-type gamma-(Sr Ga2 O4)","Journal of Solid State Chemistry","2000","153","","294","300","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521361","5.6913","","7.8355","","5.55","","90","","90","","90","","247.498","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","La2 Mn Ru O5.985","","- La2 Mn O5.985 Ru -","- La2 Mn O5.985 Ru -","- La4 Mn2 O11.97 Ru2 -","2","0.25","","Kamegashira, N.; Mori, T.; Imamura, A.; Hinatsu, Y.","Crystal structure and magnetic property of La2 Mn Ru O6 phase","Journal of Alloys Compd.","2000","302","","6","11","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521362","5.5593","","7.8309","","5.5484","","90","","90","","90","","241.546","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","(La2 Mn Ru O6.125)0.9796","","- La1.9592 Mn0.9796 O6.00005 Ru0.9796 -","- La1.9592 Mn0.9796 O6 Ru0.9796 -","- La3.9184 Mn1.9592 O12 Ru1.9592 -","2","0.25","","Kamegashira, N.; Mori, T.; Imamura, A.; Hinatsu, Y.","Crystal structure and magnetic property of La2 Mn Ru O6 phase","Journal of Alloys Compd.","2000","302","","6","11","","","","","","","","","","","","","","","","","","","","","","has coordinates","141571","2020-10-21","18:00:00",""
"1521363","5.4463","","5.7104","","7.8048","","90","","90.22","","90","","242.732","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Sm2 (Mn Ti O6)","","- Mn O6 Sm2 Ti -","- Mn O6 Sm2 Ti -","- Mn2 O12 Sm4 Ti2 -","2","0.5","","Kamegashira, N.; Nakajima, N.; Watanabe, K.; Kobayashi, M.","Synthesis and crystal structure of Sm2 Mn Ti O6","Journal of Alloys Compd.","2000","311","","74","78","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521365","3.7802","","3.7802","","13.212","","90","","90","","90","","188.798","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","(La1.58 Pb0.27 Sr0.15) Cu O4","","- Cu La1.58 O4 Pb0.27 Sr0.15 -","- Cu La1.58 O4 Pb0.27 Sr0.15 -","- Cu2 La3.16 O8 Pb0.54 Sr0.3 -","2","0.0625","","Kandyel, E.; Adachi, S.; Tajima, S.","Synthesis, structure and superconductivity of (La1.5 Pb0.5-x Srx) Cu Oz","Journal of Superconductivity","2000","13","","121","128","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521369","16.83229","","16.83229","","16.83229","","90","","90","","90","","4769.02","","","","","","","","","","","","","4","I m -3","-I 2 2 3","204","","Ba6 (V10 O30 (H2 O)) (H2 O)2.5","","- Ba6 H7 O33.5 V10 -","- Ba6.00013 O33.5 V10 -","- Ba36.0008 O201 V60 -","6","0.125","","Kanke, Y.; Oka, Y.; Yao, T.","Hydrothermal synthesis and crystal structure of Ba6 (V10 O30 (H2 O)) . 2.5(H2 O) with an unusual arrangement of V(IV)-O polyhedra","Journal of Solid State Chemistry","2000","151","","130","138","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521371","5.7955","","5.7955","","11.6464","","90","","90","","90","","391.177","","","","","","","","","","","","","3","I -4 2 d","I -4 2bw","122","","","","- Cu0.978 In Se1.988 -","- Cu0.9776 In Se1.988 -","- Cu3.9104 In4 Se7.952 -","4","0.25","","Kaplan, L.; Leitus, G.; Lyakhovitskaya, V.; Frolow, F.; Hallak, H.; Kvick, A.; Cahen, D.","Synchrotron X-ray diffraction evidence for native defects in the photovoltaic semiconductor Cu In Se2","Advanced Materials","2000","12","5","366","370","10.1002/(SICI)1521-4095(200003)12:5<366::AID-ADMA366>3.0.CO;2-9","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521373","5.7877","","5.7877","","11.6274","","90","","90","","90","","389.488","","","","","","","","","","","","","3","I -4 2 d","I -4 2bw","122","","","","- Cu0.974 In Se1.989 -","- Cu0.974 In Se1.9892 -","- Cu3.896 In4 Se7.9568 -","4","0.25","","Kaplan, L.; Leitus, G.; Lyakhovitskaya, V.; Frolow, F.; Hallak, H.; Kvick, A.; Cahen, D.","Synchrotron X-ray diffraction evidence for native defects in the photovoltaic semiconductor Cu In Se2","Advanced Materials","2000","12","5","366","370","10.1002/(SICI)1521-4095(200003)12:5<366::AID-ADMA366>3.0.CO;2-9","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521374","4.686","","4.686","","13.291","","90","","90","","120","","252.751","","","","","","","","","","","","","3","R -3 :H","-R 3","148","","Mg (Si O3)","","- Mg O3 Si -","- Mg O3 Si -","- Mg6 O18 Si6 -","6","0.333333","","Karki, B.B.; Duan, W.; da Silva, C.R.S.; Wentzcovitch, R.M.","Ab initio structure of Mg Si O3 ilmenite at high pressure","American Mineralogist","2000","85","","317","320","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521400","22.41229","","12.2777","","7.7526","","90","","90","","90","","2133.29","","","","","","","","","","","","","4","P n a m","-P 2c 2n","62","","Ba0.998 La2.235 Ti4.5 O13.5","","- Ba0.998 La2.235 O13.5 Ti4.5 -","- Ba0.998 La2.235 O13.5 Ti4.5 -","- Ba7.984 La17.88 O108 Ti36 -","8","1","","Kim, J.S.; Cheon, C.I.; Park, T.-R.; Shim, H.-S.","Dielectric properties and crystal structure of Ba6-3x (Nd, M)8+2x Ti18 O54 (M = La, Bi, y) microwave ceramics","Journal of Materials Science","2000","35","","1487","1494","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521401","14.5483","","14.5483","","14.5483","","90","","90","","90","","3079.19","","","","","","","","","","","","","2","P 41 3 2","P 4bd 2ab 3","213","","","","- Ba6 Ge24 -","- Ba6 Ge23.994 -","- Ba24 Ge95.976 -","4","0.166667","","Kim, S.-J.; Hu, S.-Q.; Huang, B.-Q.; Uher, C.; Corbett, J.D.; Hogan, T.; Kanatzidis, M.G.","Structure and thermoelectric properties of Ba6 Ge25-x, Ba6 Ge23 Sn2, and Ba6 Ge22 In3: Zintl phases with a chiral clathrate structure","Journal of Solid State Chemistry","2000","153","","321","329","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521402","14.7073","","14.7073","","14.7073","","90","","90","","90","","3181.26","","","","","","","","","","","","","3","P 43 3 2","P 4acd 2ab 3","212","","","","- Ba6 Ge23.32 Sn1.68 -","- Ba6 Ge23.32 Sn1.68 -","- Ba24 Ge93.28 Sn6.72 -","4","0.166667","","Kim, S.-J.; Hu, S.-Q.; Corbett, J.D.; Hogan, T.; Uher, C.; Huang, B.-Q.; Kanatzidis, M.G.","Structure and thermoelectric properties of Ba6 Ge25-x, Ba6 Ge23 Sn2, and Ba6 Ge22 In3: Zintl phases with a chiral clathrate structure","Journal of Solid State Chemistry","2000","153","","321","329","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521403","14.7409","","14.7409","","14.7409","","90","","90","","90","","3203.11","","","","","","","","","","","","","3","P 43 3 2","P 4acd 2ab 3","212","","","","- Ba6 Ge21.94 In3.06 -","- Ba6 Ge21.942 In3.058 -","- Ba24 Ge87.768 In12.232 -","4","0.166667","","Kim, S.-J.; Hu, S.-Q.; Uher, C.; Hogan, T.; Huang, B.-Q.; Corbett, J.D.; Kanatzidis, M.G.","Structure and thermoelectric properties of Ba6 Ge25-x, Ba6 Ge23 Sn2, and Ba6 Ge22 In3: Zintl phases with a chiral clathrate structure","Journal of Solid State Chemistry","2000","153","","321","329","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521407","24.94429","","24.94429","","24.94429","","90","","90","","90","","15520.8","","","","","","","","","","","","","5","F d -3 :2","-F 2uv 2vw 3","203","","Na87.30 (Al88 Si104 O384) (H2 O)32.64","","- Al88 H65.28 Na87.3 O416.64 Si104 -","- Al88.0032 Na87.296 O416.64 Si103.997 -","- Al88.0032 Na87.296 O416.64 Si103.997 -","1","0.0104167","","Kirschhock, C.E.A.; Hunger, B.; Martens, J.; Jacobs, P.A.","Localisation of residual water in alkali-metal cation-exchanged X and Y type zeolites","J. Phys. Chem. B","2000","104","","439","448","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521408","25.10419","","25.10419","","25.10419","","90","","90","","90","","15821.2","","","","","","","","","","","","","6","F d -3 :2","-F 2uv 2vw 3","203","","K66.56 Na21.66 (Al88 Si104 O384) (H2 O)7.137","","- Al88 H14.274 K66.56 Na21.66 O391.137 Si104 -","- Al88.0032 K66.56 Na21.664 O391.136 Si103.997 -","- Al88.0032 K66.56 Na21.664 O391.136 Si103.997 -","1","0.0104167","","Kirschhock, C.E.A.; Jacobs, P.A.; Hunger, B.; Martens, J.","Localisation of residual water in alkali-metal cation-exchanged X and Y type zeolites","J. Phys. Chem. B","2000","104","","439","448","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521409","25.064","","25.064","","25.064","","90","","90","","90","","15745.3","","","","","","","","","","","","","6","F d -3 :2","-F 2uv 2vw 3","203","","Cs4.51 Na83.75 (Al88 Si104 O384) (H2 O)34.84","","- Al88 Cs4.51 H69.68 Na83.75 O418.84 Si104 -","- Al88.0032 Cs4.512 Na83.744 O418.848 Si103.997 -","- Al88.0032 Cs4.512 Na83.744 O418.848 Si103.997 -","1","0.0104167","","Kirschhock, C.E.A.; Hunger, B.; Martens, J.; Jacobs, P.A.","Localisation of residual water in alkali-metal cation-exchanged X and Y type zeolites","J. Phys. Chem. B","2000","104","","439","448","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521410","25.073","","25.073","","25.073","","90","","90","","90","","15762.3","","","","","","","","","","","","","6","F d -3 :2","-F 2uv 2vw 3","203","","Cs27.49 Na60.88 (Al88 Si104 O384) (H2 O)18.72","","- Al88 Cs27.49 H37.44 Na60.88 O402.72 Si104 -","- Al88.0032 Cs27.488 Na60.88 O402.72 Si103.997 -","- Al88.0032 Cs27.488 Na60.88 O402.72 Si103.997 -","1","0.0104167","","Kirschhock, C.E.A.; Hunger, B.; Martens, J.; Jacobs, P.A.","Localisation of residual water in alkali-metal cation-exchanged X and Y type zeolites","J. Phys. Chem. B","2000","104","","439","448","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521411","24.6429","","24.6429","","24.6429","","90","","90","","90","","14965","","","","","","","","","","","","","5","F d -3 m :2","-F 4vw 2vw 3","227","","Na54.91 (Al56 Si136 O384) (H2 O)18.62","","- Al56 H37.24 Na54.91 O402.62 Si136 -","- Al56.0064 Na54.912 O402.624 Si135.994 -","- Al56.0064 Na54.912 O402.624 Si135.994 -","1","0.00520833","","Kirschhock, C.E.A.; Hunger, B.; Martens, J.; Jacobs, P.A.","Localisation of residual water in alkali-metal cation-exchanged X and Y type zeolites","J. Phys. Chem. B","2000","104","","439","448","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521412","24.6736","","24.6736","","24.6736","","90","","90","","90","","15021","","","","","","","","","","","","","6","F d -3 m :2","-F 4vw 2vw 3","227","","K35.54 Na19.39 (Al56 Si136 O384) (H2 O)14.98","","- Al56 H29.96 K35.54 Na19.39 O398.98 Si136 -","- Al56.0064 K35.536 Na19.392 O398.976 Si135.994 -","- Al56.0064 K35.536 Na19.392 O398.976 Si135.994 -","1","0.00520833","","Kirschhock, C.E.A.; Hunger, B.; Martens, J.; Jacobs, P.A.","Localisation of residual water in alkali-metal cation-exchanged X and Y type zeolites","J. Phys. Chem. B","2000","104","","439","448","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521413","24.78609","","24.78609","","24.78609","","90","","90","","90","","15227.3","","","","","","","","","","","","","6","F d -3 m :2","-F 4vw 2vw 3","227","","Rb27.74 Na27.6 (Al56 Si136 O384) (H2 O)4.32","","- Al56 H8.64 Na27.6 O388.32 Rb27.74 Si136 -","- Al56.0064 Na27.6 O388.32 Rb27.744 Si135.994 -","- Al56.0064 Na27.6 O388.32 Rb27.744 Si135.994 -","1","0.00520833","","Kirschhock, C.E.A.; Jacobs, P.A.; Martens, J.; Hunger, B.","Localisation of residual water in alkali-metal cation-exchanged X and Y type zeolites","J. Phys. Chem. B","2000","104","","439","448","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521414","24.70599","","24.70599","","24.70599","","90","","90","","90","","15080.2","","","","","","","","","","","","","6","F d -3 m :2","-F 4vw 2vw 3","227","","Cs24.16 Na31.73 (Al56 Si136 O384) (H2 O)6.94","","- Al56 Cs24.16 H13.88 Na31.73 O390.94 Si136 -","- Al56.0064 Cs24.16 Na31.728 O390.944 Si135.994 -","- Al56.0064 Cs24.16 Na31.728 O390.944 Si135.994 -","1","0.00520833","","Kirschhock, C.E.A.; Jacobs, P.A.; Hunger, B.; Martens, J.","Localisation of residual water in alkali-metal cation-exchanged X and Y type zeolites","J. Phys. Chem. B","2000","104","","439","448","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521415","10.527","","10.527","","10.527","","90","","90","","90","","1166.58","","","","","","","","","","","","","3","P 21 3","P 2ac 2ab 3","198","","Ce (Zr O4)","","- Ce O4 Zr -","- Ce O4 Zr -","- Ce16 O64 Zr16 -","16","1.33333","","Kishimoto, H.; Omata, T.; Otsuka-Yao-Matsuo, S.; Ueda, K.; Hosono, H.; Kawazoe, H.","Crystal structure of metastable kappa-(Ce Zr O4) phase possessing an order arrangement of Ce and Zr ions","Journal of Alloys Compd.","2000","312","","94","103","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521416","7.614","","7.614","","7.614","","90","","90","","90","","441.406","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","Na (P F6)","","- F6 Na P -","- F6 Na P -","- F24 Na4 P4 -","4","0.0208333","","Kitashita, K.; Tamada, O.; Hagiwara, R.; Ito, Y.","Crystal structures of some cubic hexafluorophosphates at ambient temperatures","Journal of Fluorine Chemistry","2000","101","","173","179","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521417","7.7891","","7.7891","","7.7891","","90","","90","","90","","472.565","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","K (P F6)","","- F6 K P -","- F6 K P -","- F24 K4 P4 -","4","0.0208333","","Kitashita, K.; Hagiwara, R.; Ito, Y.; Tamada, O.","Crystal structures of some cubic hexafluorophosphates at ambient temperatures","Journal of Fluorine Chemistry","2000","101","","173","179","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521418","8.197","","8.197","","8.197","","90","","90","","90","","550.763","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","Cs (P F6)","","- Cs F6 P -","- Cs F6 P -","- Cs4 F24 P4 -","4","0.0208333","","Kitashita, K.; Hagiwara, R.; Tamada, O.; Ito, Y.","Crystal structures of some cubic hexafluorophosphates at ambient temperatures","Journal of Fluorine Chemistry","2000","101","","173","179","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521419","4.7384","","4.7384","","3.1865","","90","","90","","90","","71.545","","","","","","","","","","","","","2","P 42/m n m","-P 4n 2n","136","","Sn0.912 O2","","- O2 Sn0.912 -","- O2 Sn0.912 -","- O4 Sn1.824 -","2","0.125","","Klementova, M.; Weiss, Z.; Rieder, M.","Rietveld refinement of cassiterite: a caveat for meticulous sample preparation","International Journal of Inorganic Materials","2000","45","","155","157","","","","","","","","","","","","","","","","","","","","","","has coordinates","141629","2020-10-21","18:00:00",""
"1521420","3.8069","","3.8069","","30.055","","90","","90","","90","","435.572","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","Tl (La2 Sr2) Ni2 O9","","- La2 Ni2 O9 Sr2 Tl -","- La2 Ni2 O9 Sr2 Tl -","- La4 Ni4 O18 Sr4 Tl2 -","2","0.0625","","Knee, C.S.; Weller, M.T.","Synthesis and structure of a new family of nickelates: Tl (Ln2 Sr2) Ni2 O9, Ln= La, Pr, Nd, Sm, Eu and Gd","Journal of Solid State Chemistry","2000","150","","1","13","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521421","3.7864","","3.7864","","29.804","","90","","90","","90","","427.295","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","Tl (Pr2 Sr2) Ni2 O9","","- Ni2 O9 Pr2 Sr2 Tl -","- Ni2 O9 Pr2 Sr2 Tl -","- Ni4 O18 Pr4 Sr4 Tl2 -","2","0.0625","","Knee, C.S.; Weller, M.T.","Synthesis and structure of a new family of nickelates: Tl (Ln2 Sr2)Ni2 O9, Ln = La, Pr, Nd, Sm, Eu and Gd","Journal of Solid State Chemistry","2000","150","","1","13","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521422","3.7794","","3.7794","","29.697","","90","","90","","90","","424.188","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","Tl (Nd2 Sr2) Ni2 O9","","- Nd2 Ni2 O9 Sr2 Tl -","- Nd2 Ni2 O9 Sr2 Tl -","- Nd4 Ni4 O18 Sr4 Tl2 -","2","0.0625","","Knee, C.S.; Weller, M.T.","Synthesis and structure of a new family of nickelates: Tl (Ln2 Sr2)Ni2 O9, Ln = La, Pr, Nd, Sm, Eu and Gd","Journal of Solid State Chemistry","2000","150","","1","13","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521423","3.7718","","3.7718","","29.524","","90","","90","","90","","420.022","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","Tl (Sm2 Sr2) Ni2 O9","","- Ni2 O9 Sm2 Sr2 Tl -","- Ni2 O9 Sm2 Sr2 Tl -","- Ni4 O18 Sm4 Sr4 Tl2 -","2","0.0625","","Knee, C.S.; Weller, M.T.","Synthesis and structure of a new family of nickelates: Tl (Ln2 Sr2) Ni2 O9, Ln = La, Pr, Nd, Sm, Eu and Gd","Journal of Solid State Chemistry","2000","150","","1","13","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521424","3.7711","","3.7711","","29.421","","90","","90","","90","","418.402","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","Tl (Eu2 Sr2) Ni2 O9","","- Eu2 Ni2 O9 Sr2 Tl -","- Eu2 Ni2 O9 Sr2 Tl -","- Eu4 Ni4 O18 Sr4 Tl2 -","2","0.0625","","Knee, C.S.; Weller, M.T.","Synthesis and structure of a new family of nickelates: Tl (Ln2 Sr2)Ni2 O9, Ln = La, Pr, Nd, Sm, Eu and Gd","Journal of Solid State Chemistry","2000","150","","1","13","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521425","3.7667","","3.7667","","29.39","","90","","90","","90","","416.986","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","Tl (Gd2 Sr2) Ni2 O9","","- Gd2 Ni2 O9 Sr2 Tl -","- Gd2 Ni2 O9 Sr2 Tl -","- Gd4 Ni4 O18 Sr4 Tl2 -","2","0.0625","","Knee, C.S.; Weller, M.T.","Synthesis and structure of a new family of nickelates: Tl (Ln2 Sr2)Ni2 O9, Ln = La, Pr, Nd, Sm, Eu and Gd","Journal of Solid State Chemistry","2000","150","","1","13","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521434","6.239","","3.796","","7.196","","90","","90","","90","","170.425","","","","","","","","","","","","","2","P n m a","-P 2ac 2n","62","","Eu D2","","- D2 Eu -","- D2 Eu -","- D8 Eu4 -","4","0.5","","Kohlmann, H.; Yvon, K.","The crystal structures of Eu H2 and Eu Li H3 by neutron powder diffraction","Journal of Alloys Compd.","2000","299","","16","20","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521435","3.7875","","3.7875","","3.7875","","90","","90","","90","","54.332","","","","","","","","","","","","","3","P m -3 m","-P 4 2 3","221","","Eu Li D3","","- D3 Eu Li -","- D3 Eu Li -","- D3 Eu Li -","1","0.0208333","","Kohlmann, H.; Yvon, K.","The crystal structures of Eu H2 and Eu Li H3 by neutron powder diffraction","Journal of Alloys Compd.","2000","299","","16","20","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521436","9.3864","","9.3864","","26.55","","90","","90","","120","","2025.79","","","","","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","Zr Cr2 D3.765","","- Cr2 D3.765 Zr -","- Cr2 D3.765 Zr -","- Cr72 D135.54 Zr36 -","36","1","","Kohlmann, H.; Yvon, K.","Revision of the low-temperature structures of rhombohedral Zr Cr2 Dx (x = 3.8), and monoclinic Zr V2 Dx (1.1 < x < 2.3) and Hf V2 Dx (x = 1.9)","Journal of Alloys Compd.","2000","309","","123","126","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521437","9.3576","","5.426","","9.3729","","90","","109.198","","90","","449.437","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Zr V2 D2.26","","- D2.26 V2 Zr -","- D2.26 V2 Zr -","- D18.08 V16 Zr8 -","8","1","","Kohlmann, H.; Yvon, K.","Revision of the low-temperature structures of rhombohedral Zr Cr2 Dx (x = 3.8), and monoclinic Zr V2 Dx (1.1 < x < 2.3) and Hf V2 Dx (x = 1.9)","Journal of Alloys Compd.","2000","309","","123","126","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521438","9.2322","","5.3622","","9.2454","","90","","109.034","","90","","432.668","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Hf V2 D1.78","","- D1.78 Hf V2 -","- D1.78 Hf V2 -","- D14.24 Hf8 V16 -","8","1","","Kohlmann, H.; Yvon, K.","Revision of the low-temperature structures of rhombohedral Zr Cr2 Dx (x = 3.8), and monoclinic Zr V2 Dx (1.1 < x < 2.3) and Hf V2 Dx (x = 1.9)","Journal of Alloys Compd.","2000","309","","123","126","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521439","9.3309","","5.4164","","9.3475","","90","","109.095","","90","","446.428","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Zr V2 D1.75","","- D1.75 V2 Zr -","- D1.75 V2 Zr -","- D14 V16 Zr8 -","8","1","","Kohlmann, H.; Yvon, K.","Revision of the low-temperature structures of rhombohedral Zr Cr2 Dx (x = 3.8), and monoclinic Zr V2 Dx (1.1 < x < 2.3) and Hf V2 Dx (x = 1.9)","Journal of Alloys Compd.","2000","309","","123","126","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521440","9.2696","","5.3857","","9.2882","","90","","109.04","","90","","438.329","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Zr V2 D1.54","","- D1.54 V2 Zr -","- D1.54 V2 Zr -","- D12.32 V16 Zr8 -","8","1","","Kohlmann, H.; Yvon, K.","Revision of the low-temperature structures of rhombohedral Zr Cr2 Dx (x = 3.8), and monoclinic Zr V2 Dx (1.1 < x < 2.3) and Hf V2 Dx (x = 1.9)","Journal of Alloys Compd.","2000","309","","123","126","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521441","9.243","","5.368","","9.261","","90","","109.1","","90","","434.202","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Zr V2 D1.14","","- D1.14 V2 Zr -","- D1.14 V2 Zr -","- D9.12 V16 Zr8 -","8","1","","Kohlmann, H.; Yvon, K.","Revision of the low-temperature structures of rhombohedral Zr Cr2 Dx (x = 3.8), and monoclinic Zr V2 Dx (1.1 < x < 2.3) and Hf V2 Dx (x = 1.9)","Journal of Alloys Compd.","2000","309","","123","126","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521444","4.122","","4.122","","9.6753","","90","","90","","90","","164.392","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","Tb Os2 Si2","","- Os2 Si2 Tb -","- Os2 Si2 Tb -","- Os4 Si4 Tb2 -","2","0.0625","","Kolenda, M.; Leciejewicz, J.; Hofmann, M.; Szytula, A.; Penc, B.","Neutron diffraction study of incommensurate magnetic order in Tb Os2 Si2 and Ho Os2 Si2","Journal of Alloys Compd.","2000","305","","153","156","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521452","5.873","","5.873","","23.064","","90","","90","","120","","688.946","","","","","","","","","","","","","5","P 63/m m c","-P 6c 2c","194","","Ba Fe10.87 Ir0.62 Co0.51 O19","","- Ba Co0.51 Fe10.87 Ir0.62 O19 -","- Ba Co0.51 Fe10.87 Ir0.62 O19 -","- Ba2 Co1.02 Fe21.74 Ir1.24 O38 -","2","0.0833333","","Kreisel, J.; Vincent, H.; Tasset, F.; Wolfers, P.","The magnetic anisotropy change of Ba Fe12-2x Irx Cox O19: a single-crystal neutron diffraction study of the accompanying atomic and magnetic structures","Journal of Magnetism and Magnetic Materials","2000","213","","262","270","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521453","5.881","","5.881","","23.071","","90","","90","","120","","691.034","","","","","","","","","","","","","5","P 63/m m c","-P 6c 2c","194","","Ba Fe10.67 Ir0.71 Co0.62 O19","","- Ba Co0.62 Fe10.67 Ir0.71 O19 -","- Ba Co0.62 Fe10.67 Ir0.71 O19 -","- Ba2 Co1.24 Fe21.34 Ir1.42 O38 -","2","0.0833333","","Kreisel, J.; Tasset, F.; Vincent, H.; Wolfers, P.","The magnetic anisotropy change of Ba Fe12-2x Irx Cox O19: a single-crystal neutron diffraction study of the accompanying atomic and magnetic structures","Journal of Magnetism and Magnetic Materials","2000","213","","262","270","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521454","12.2567","","36.633","","3.9496","","90","","90","","90","","1773.37","","","","","","","","","","","","","3","P 21 21 2","P 2 2ab","18","","Nb6.7 W10.3 O47","","- Nb6.7 O47 W10.3 -","- Nb6.703 O47 W10.299 -","- Nb13.406 O94 W20.598 -","2","0.5","","Krumeich, F.; Woerle, M.; Hussain, A.","Superstructure and twinning in the tetragonal tungsten bronze-type phase Nb7 W10 O47","Journal of Solid State Chemistry","2000","149","","428","433","","","","","","","","","","","","","","","","","","","","","","has coordinates","141665","2020-10-21","18:00:00",""
"1521471","7.0523","","7.0523","","3.5879","","90","","90","","90","","178.444","","","","","","","","","","","","","3","P 42/m n m","-P 4n 2n","136","","Yb Ni4 P2","","- Ni4 P2 Yb -","- Ni4 P2 Yb -","- Ni8 P4 Yb2 -","2","0.125","","Kuz'ma, Yu.B.; Chikhrii, S.I.; Budnyk, S.L.","Yb - Ni - P system","Journal of Alloys Compd.","2000","298","","190","194","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521472","9.051","","9.051","","3.6577","","90","","90","","120","","259.497","","","","","","","","","","","","","3","P -6","P -6","174","","Yb2 Ni12 P7","","- Ni12 P7 Yb2 -","- Ni12 P7 Yb2 -","- Ni12 P7 Yb2 -","1","0.166667","","Kuz'ma, Yu.B.; Chikhrii, S.I.; Budnyk, S.L.","Yb - Ni - P system","Journal of Alloys Compd.","2000","298","","190","194","","","","","","","","","","","","","","","","","","","","","","has coordinates","141683","2020-10-21","18:00:00",""
"1521474","3.6162","","3.6162","","5.1576","","90","","90","","90","","67.445","","","","","","","","","","","","","3","P 42/n m c :1","P 4n 2n -1n","137","","((Zr O2)0.95 (Y2 O3)0.05)0.952","","- O1.9516 Y0.0952 Zr0.9044 -","- O1.952 Y0.096 Zr0.904 -","- O3.904 Y0.192 Zr1.808 -","2","0.125","","Lamas, D.G.; Walsoe de Reca, N.E.","X-ray diffraction study of compositionally homogeneous, nanocrystalline yttria-doped zirconia powders","Journal of Materials Science","2000","35","","5563","5567","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521475","3.6251","","3.6251","","5.1401","","90","","90","","90","","67.548","","","","","","","","","","","","","3","P 42/n m c :1","P 4n 2n -1n","137","","((Zr O2)0.93 (Y2 O3)0.07)0.935","","- O1.93545 Y0.1309 Zr0.86955 -","- O1.934 Y0.13 Zr0.87 -","- O3.868 Y0.26 Zr1.74 -","2","0.125","","Lamas, D.G.; Walsoe de Reca, N.E.","X-ray diffraction study of compositionally homogeneous, nanocrystalline yttria-doped zirconia powders","Journal of Materials Science","2000","35","","5563","5567","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521476","3.6297","","3.6297","","5.1394","","90","","90","","90","","67.71","","","","","","","","","","","","","3","P 42/n m c :1","P 4n 2n -1n","137","","((Zr O2)0.89 (Y2 O3)0.11)0.901","","- O1.90111 Y0.19822 Zr0.80189 -","- O1.9 Y0.198 Zr0.802 -","- O3.8 Y0.396 Zr1.604 -","2","0.125","","Lamas, D.G.; Walsoe de Reca, N.E.","X-ray diffraction study of compositionally homogeneous, nanocrystalline yttria-doped zirconia powders","Journal of Materials Science","2000","35","","5563","5567","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521477","3.6325","","3.6325","","5.1426","","90","","90","","90","","67.857","","","","","","","","","","","","","3","P 42/n m c :1","P 4n 2n -1n","137","","((Zr O2)0.88 (Y2 O3)0.12)0.893","","- O1.89316 Y0.21432 Zr0.78584 -","- O1.892 Y0.214 Zr0.786 -","- O3.784 Y0.428 Zr1.572 -","2","0.125","","Lamas, D.G.; Walsoe de Reca, N.E.","X-ray diffraction study of compositionally homogeneous, nanocrystalline yttria-doped zirconia powders","Journal of Materials Science","2000","35","","5563","5567","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521478","5.1378","","5.1378","","5.1378","","90","","90","","90","","135.622","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","((Zr O2)0.88 (Y2 O3)0.12)0.893","","- O1.89316 Y0.21432 Zr0.78584 -","- O1.892 Y0.214 Zr0.786 -","- O7.568 Y0.856 Zr3.144 -","4","0.0208333","","Lamas, D.G.; Walsoe de Reca, N.E.","X-ray diffraction study of compositionally homogeneous, nanocrystalline yttria-doped zirconia powders","Journal of Materials Science","2000","35","","5563","5567","","","","","","","","","","","","","","","","","","","","","","has coordinates","141689","2020-10-21","18:00:00",""
"1521481","4.0097","","4.0097","","4.0097","","90","","90","","90","","64.467","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","Pb ((Fe Ta) O6)0.5","","- Fe0.5 O3 Pb Ta0.5 -","- Fe0.5 O3 Pb0.9996 Ta0.5 -","- Fe0.5 O3 Pb0.9996 Ta0.5 -","1","0.0208333","","Lampis, N.; Geddo Lehmann, A.; Sciau, P.","Rietveld refinement of the paraelectric and ferroelectric structures of Pb Fe0.5 Ta0.5 O3","Journal of Physics: Condensed Matter","2000","12","","2367","2378","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521482","5.6687","","5.661","","4.0083","","90","","89.853","","90","","128.628","","","","","","","","","","","","","4","C 1 m 1","C -2y","8","","Pb (Fe0.5 Ta0.5) O3","","- Fe0.5 O3 Pb Ta0.5 -","- Fe0.5 O3 Pb Ta0.5 -","- Fe O6 Pb2 Ta -","2","0.5","","Lampis, N.; Sciau, P.; Geddo Lehmann, A.","Rietveld refinement of the paraelectric and ferroelectric structures of Pb Fe0.5 Ta0.5 O3","Journal of Physics: Condensed Matter","2000","12","","2367","2378","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521483","6.7037","","3.9062","","3.9542","","90","","125.258","","90","","84.551","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","(Bi0.667 Nd1.333) O3","","- Bi0.667 Nd1.333 O3 -","- Bi0.666 Nd1.334 O3 -","- Bi0.666 Nd1.334 O3 -","1","0.125","","Lan, Y.C.; Chen, X.L.; Li, J.-Q.","Structure of Bi2 Nd4 O9 monoclinic phase","Journal of Solid State Chemistry","2000","153","","30","33","","","","","","","","","","","","","","","","","","","","","","has coordinates","141694","2020-10-21","18:00:00",""
"1521486","7.855","","7.855","","7.855","","90","","90","","90","","484.662","","","","","","","","","","","","","3","P -4 3 m","P -4 2 3","215","","Y Mn2 D1.26","","- D1.26 Mn2 Y -","- D1.26 Mn2 Y -","- D10.08 Mn16 Y8 -","8","0.333333","","Latroche, M.; Paul-Boncour, V.; Percheron-Guegan, A.; Bouree-Vigneron, F.; Andre, G.","Structural and magnetic properties of low D content Y Mn2 deuteride","Journal of Solid State Chemistry","2000","154","","398","404","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521489","10.9008","","10.9008","","10.9008","","90","","90","","90","","1295.31","","","","","","","","","","","","","4","P m -3 n","-P 4n 2 3","223","","Ba8 Ga17.134 Sb2.78 Ge25.595","","- Ba8 Ga17.134 Ge25.595 Sb2.78 -","- Ba8 Ga17.134 Ge25.5956 Sb2.7776 -","- Ba8 Ga17.134 Ge25.5956 Sb2.7776 -","1","0.0208333","","Latturner, S.; Bu Xianhui; Blake, N.; Metiu, H.; Stucky, G.","Gallium antimonide-doped germanium clathrate - a p-type thermoelectric cage structure","Journal of Solid State Chemistry","2000","151","","61","64","","","","","","","","","","","","","","","","","","","","","","has coordinates","141700","2020-10-21","18:00:00",""
"1521490","9.6194","","9.6194","","11.1061","","90","","90","","120","","889.996","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","Sr3 Zn (Rh O6)","","- O6 Rh Sr3 Zn -","- O6 Rh Sr3 Zn -","- O36 Rh6 Sr18 Zn6 -","6","0.166667","","Layland, R.C.; zur Loye, H.C.","Synthesis, characterization, and magnetic properties of a commensurate and incommensurate phase of Sr3 Zn Rh O6: zinc in trigonal prismatic coordination","Journal of Alloys Compd.","2000","299","","118","125","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521491","24.71","","24.71","","24.71","","90","","90","","90","","15087.5","","","","","","","","","","","","","4","F d -3 :2","-F 2uv 2vw 3","203","","Zn46 Si100 Al92 O384 (Zn O)8","","- Al92 O392 Si100 Zn54 -","- Al91.9968 O392 Si100.003 Zn54 -","- Al91.9968 O392 Si100.003 Zn54 -","1","0.0104167","","Lee, S.H.; Kim, Y.","Two crystal structures of dehydrated Zn(2+)-exchanged zeolite X: Zn46 Si100 Al92 O384 . 8(Zn O) and Zn13 Tl66 Si100 Al92 O384 . 2(Zn O)","Bulletin of the Korean Chemical Society","2000","21","","180","186","","","","","","","","","","","","","","","","","","","","","","has coordinates","141702","2020-10-21","18:00:00",""
"1521492","24.984","","24.984","","24.984","","90","","90","","90","","15595","","","","","","","","","","","","","5","F d -3 :2","-F 2uv 2vw 3","203","","Zn13 Tl66 Si100 Al92 O384 (Zn O)2","","- Al92 O386 Si100 Tl66 Zn15 -","- Al91.9968 O384 Si100.003 Tl66 Zn14.9984 -","- Al91.9968 O384 Si100.003 Tl66 Zn14.9984 -","1","0.0104167","","Lee, S.H.; Kim, Y.","Two crystal structures of dehydrated Zn(2+)-exchanged zeolite X: Zn46 Si100 Al92 O384 . 8(Zn O) and Zn13 Tl66 Si100 Al92 O384 . 2(ZnO)","Bulletin of the Korean Chemical Society","2000","21","","180","186","","","","","","","","","","","","","","","","","","","","","","has coordinates","141703","2020-10-21","18:00:00",""
"1521493","5.5467","","5.5616","","7.8426","","90","","89.959","","90","","241.933","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","La (Mg0.5 Ti0.5) O3","","- La Mg0.5 O3 Ti0.5 -","- La Mg0.5 O3 Ti0.5 -","- La4 Mg2 O12 Ti2 -","4","1","","Lee, D.Y.; Paik, J.H.; Yoon, S.-J.; Whang, K.-C.; Nahm, S.; Yeo, J.H.; Ahn, B.G.","Crystal structure and microwave dielectric properties of La (Mg1/2 Ti1/2) O3 ceramics","Journal of Materials Science. Letters","2000","19","","131","134","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521494","25.2","","25.2","","25.2","","90","","90","","90","","16003","","","","","","","","","","","","","4","F d -3 :2","-F 2uv 2vw 3","203","","Rb140 (Al92 Si100 O384)","","- Al92 O384 Rb140 Si100 -","- Al91.9968 O384 Rb140 Si100.003 -","- Al91.9968 O384 Rb140 Si100.003 -","1","0.0104167","","Lee, S.H.; Seff, K.; Kim, Y.","A cationic rubidium continuum in zeolite X","J. Phys. Chem. B","2000","104","","11162","11167","","","","","","","","","","","","","","","","","","","","","","has coordinates","141705","2020-10-21","18:00:00",""
"1521495","24.982","","24.982","","24.982","","90","","90","","90","","15591.3","","","","","","","","","","","","","6","F d -3 :2","-F 2uv 2vw 3","203","","Pd14 (O H Pd O Pd O H)8 Na32 (Al92 Si100 O384)","","- Al92 H16 Na32 O408 Pd30 Si100 -","- Al91.9968 Na32 O408 Pd30.0032 Si100.003 -","- Al91.9968 Na32 O408 Pd30.0032 Si100.003 -","1","0.0104167","","Lee, S.H.; Kim, Y.; Seff, K.","Crystal structure of partially Pd(2+)-exchanged zeolite X dehydrated in oxygen at 400 C. Formation of linear Pd2 O3 clusters proposed to be (H O) - Pd(IV) - O - Pd(IV) - (O H) in (Pd(2+))14 (HO Pd O Pd O H)(4+)8 (Na(+))32 - Si100 Al92 O384","J. Phys. Chem. B","2000","104","","2490","2494","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521496","8.019","","8.013","","3.661","","90","","90","","90","","235.242","","","","","","","","","","","","","4","C m m m","-C 2 2","65","","(Ni (N H3)2) Cl2","","- Cl2 H6 N2 Ni -","- Cl2 H6 N2 Ni -","- Cl4 H12 N4 Ni2 -","2","0.125","","Leineweber, A.; Jacobs, H.","Preparation and crystal structures of Ni (N H3)2 Cl2 and of two modifications of Ni (N H3)2 Br2 and Ni (N H3)2 I2","Journal of Solid State Chemistry","2000","152","","381","387","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521497","8.273","","8.297","","3.851","","90","","90","","90","","264.337","","","","","","","","","","","","","4","C m m m","-C 2 2","65","","(Ni (N H3)2) Br2","","- Br2 H6 N2 Ni -","- Br2 H6 N2 Ni -","- Br4 H12 N4 Ni2 -","2","0.125","","Leineweber, A.; Jacobs, H.","Preparation and crystal structures of Ni (N H3)2 Cl2 and of two modifications of Ni (N H3)2 Br2 and Ni (N H3)2 I2","Journal of Solid State Chemistry","2000","152","","381","387","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521498","5.865","","11.723","","3.856","","90","","90","","90","","265.121","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","(Ni (N H3)2) Br2","","- Br2 H6 N2 Ni -","- Br2 H6 N2 Ni -","- Br4 H12 N4 Ni2 -","2","0.25","","Leineweber, A.; Jacobs, H.","Preparation and crystal structures of Ni (N H3)2 Cl2 and of two modifications of Ni (N H3)2 Br2 and Ni (N H3)2 I2","Journal of Solid State Chemistry","2000","152","","381","387","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521499","14.5501","","14.5501","","8.9543","","90","","90","","120","","1641.7","","","","","","","","","","","","","3","P 6/m m m","-P 6 2","191","","Sc B16.432 C0.235","","- C0.235 B16.432 Sc -","- C0.235 B16.4317 Sc -","- C2.82 B197.18 Sc12 -","12","0.5","","Leithe-Jasper, A.; Tanaka, T.; Bourgeois, L.; Michiue, Y.; Shi, Y.","A single-crystal XRD and TEM study of ""Sc B17 C0.25""","Journal of Solid State Chemistry","2000","154","","130","136","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521500","5.56133","","5.76733","","9.74629","","90","","124.81","","90","","256.662","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Ca2 (Ca0.667 Nb0.333) Nb O6","","- Ca2.667 Nb1.333 O6 -","- Ca2.667 Nb1.333 O6 -","- Ca5.334 Nb2.666 O12 -","2","0.5","","Levin, I.; Bendersky, L.A.; Cline, J.P.; Roth, R.S.; Vanderah, T.A.","Octahedral tilting and cation ordering in perovskite-like Ca4 Nb2 O9 = 3 . Ca (Ca1/3 Nb2/3) O3 polymorphs","Journal of Solid State Chemistry","2000","150","","43","61","","","","","","","","","","","","","","","","","","","","","","has coordinates","141712","2020-10-21","18:00:00",""
"1521501","29.12399","","29.12399","","17.26019","","90","","90","","120","","12678.8","","","","","","","","","","","","","2","R -3 c :H","-R 3 2""c","167","","Si38 O76","","- O76 Si38 -","- O76 Si38 -","- O456 Si228 -","6","0.166667","","Li, Y.-P.; Krivovichev, S.V.; Burns, P.C.","The crystal structure of thornasite, Na12 Th3 (Si8 O19)4 (H2 O)18: a novel interrupted silicate framework","American Mineralogist","2000","85","","1521","1525","","","","","","","","","","","","","","","","","","","","","","has coordinates","141713","2020-10-21","18:00:00",""
"1521503","12.554","","13.019","","8.391","","90","","90","","90","","1371.43","","","","","","","","","","","","","4","P n a m","-P 2c 2n","62","","Pb3.116 (H2 O)2 ((U O2)4 O4.116 (O H)2.884)2","","- H9.768 O32 Pb3.116 U8 -","- O32 Pb3.116 U8 -","- O64 Pb6.232 U16 -","2","0.25","","Li, Y.-P.; Burns, P.C.","Investigations of crystal-chemical variability in lead uranyl oxide hydrates. I. Curite","Canadian Mineralogist","2000","38","","727","735","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521504","12.579","","13.022","","8.392","","90","","90","","90","","1374.64","","","","","","","","","","","","","4","P n a m","-P 2c 2n","62","","Pb3.164 (H2 O)2 ((U O2)4 O4.164 (O H)2.836)2","","- H9.672 O32 Pb3.164 U8 -","- O32 Pb3.164 U8 -","- O64 Pb6.328 U16 -","2","0.25","","Li, Y.-P.; Burns, P.C.","Investigations of crystal-chemical variability in lead uranyl oxide hydrates. I. Curite","Canadian Mineralogist","2000","38","","727","735","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521505","12.584","","13.033","","8.402","","90","","90","","90","","1377.99","","","","","","","","","","","","","4","P n a m","-P 2c 2n","62","","Pb2.892 (H2 O)2 ((U O2)4 O3.892 (O H)3.108)2","","- H10.216 O32 Pb2.892 U8 -","- O32 Pb2.892 U8 -","- O64 Pb5.784 U16 -","2","0.25","","Li, Y.-P.; Burns, P.C.","Investigations of crystal-chemical variability in lead uranyl oxide hydrates. I. Curite","Canadian Mineralogist","2000","38","","727","735","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521506","12.537","","13.001","","8.384","","90","","90","","90","","1366.54","","","","","","","","","","","","","4","P n a m","-P 2c 2n","62","","Pb3.044 (H2 O)2 ((U O2)4 O4.044 (O H)2.956)2","","- H9.912 O32 Pb3.044 U8 -","- O32 Pb3.044 U8 -","- O64 Pb6.088 U16 -","2","0.25","","Li, Y.-P.; Burns, P.C.","Investigations of crystal-chemical variability in lead uranyl oxide hydrates. I. Curite","Canadian Mineralogist","2000","38","","727","735","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521507","14.022","","16.45","","14.355","","90","","90","","90","","3311.15","","","","","","","","","","","","","4","B b 21 m","B -2 -2b","36","","Pb0.919 ((U O2)4 O2.838 (O H)4.162) (H2 O)4","","- H12.162 O19 Pb0.919 U4 -","- O19 Pb0.919 U4 -","- O152 Pb7.352 U32 -","8","1","","Li, Y.-P.; Burns, P.C.","Investigations of crystal-chemical variability in lead uranyl oxide hydrates. II. Fourmarierite","Canadian Mineralogist","2000","38","","737","749","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521508","14.01","","16.468","","14.369","","90","","90","","90","","3315.17","","","","","","","","","","","","","4","B b 21 m","B -2 -2b","36","","Pb0.855 ((U O2)4 O2.710 (O H)4.290) (H2 O)4","","- H12.29 O19 Pb0.855 U4 -","- O19 Pb0.855 U4 -","- O152 Pb6.84 U32 -","8","1","","Li, Y.-P.; Burns, P.C.","Investigations of crystal-chemical variability in lead uranyl oxide hydrates. II. Fourmarierite","Canadian Mineralogist","2000","38","","737","749","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521509","13.938","","16.638","","14.672","","90","","90","","90","","3402.44","","","","","","","","","","","","","4","B b 21 m","B -2 -2b","36","","Pb0.497 ((U O2)4 O1.994 (O H)5.006) (H2 O)4","","- H13.006 O19 Pb0.497 U4 -","- O19 Pb0.497 U4 -","- O152 Pb3.976 U32 -","8","1","","Li, Y.-P.; Burns, P.C.","Investigations of crystal-chemical variability in lead uranyl oxide hydrates. II. Fourmarierite","Canadian Mineralogist","2000","38","","737","749","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521511","3.82698","","3.82698","","13.06858","","90","","90","","90","","191.399","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","(La1.2 Sr0.8) (Mn O3.94)","","- La1.2 Mn O3.94 Sr0.8 -","- La1.2 Mn O3.938 Sr0.8 -","- La2.4 Mn2 O7.876 Sr1.6 -","2","0.0625","","Li, R.-K.; Greaves, C.","Synthesis and characterization of the electron-doped single-layer manganite La1.2 Sr0.8 Mn O4-d and its oxidized phase La1.2 Sr0.8 Mn O4+d","Journal of Solid State Chemistry","2000","153","","34","40","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521512","3.93477","","3.93477","","12.5237","","90","","90","","90","","193.897","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","(La1.2 Sr0.8) (Mn O4.27)","","- La1.2 Mn O4.27 Sr0.8 -","- La1.2 Mn O4.27 Sr0.8 -","- La2.4 Mn2 O8.54 Sr1.6 -","2","0.0625","","Li, R.-K.; Greaves, C.","Synthesis and characterization of the electron-doped single-layer manganite La1.2 Sr0.8 Mn O4-d and its oxidized phase La1.2 Sr0.8 MnO4+d","Journal of Solid State Chemistry","2000","153","","34","40","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521513","30.557","","5.809","","7.183","","90","","90","","90","","1275.02","","","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","(Pb6 O4) (O H) (N O3) (C O3)","","- C H N O11 Pb6 -","- C N O11 Pb6 -","- C4 N4 O44 Pb24 -","4","0.5","","Li, Y.-P.; Krivovichev, S.V.; Burns, P.C.","Crystal chemistry of lead oxide hydroxide nitrates. I. The crystal structure of (Pb6 O4) (O H) (N O3) (C O3)","Journal of Solid State Chemistry","2000","153","","365","370","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521516","12.249","","12.249","","12.249","","90","","90","","90","","1837.81","","","","","","","","","","","","","5","P m -3 m","-P 4 2 3","221","","(Na12 (Al12 Si12 O48)) Xe7","","- Al12 Na12 O48 Si12 Xe7 -","- Al12 Na11.9996 O48 Si12 Xe7 -","- Al12 Na11.9996 O48 Si12 Xe7 -","1","0.0208333","","Lim, W.T.; Heo, N.-H.; Park, M.","Crystal structure of xenon encapsulate within Na-A zeolite","Bulletin of the Korean Chemical Society","2000","21","","75","80","","","","","","","","","","","","","","","","","","","","","","has coordinates","141728","2020-10-21","18:00:00",""
"1521517","5.4587","","5.4587","","12.038","","90","","90","","90","","358.701","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","(Pb0.99 La0.01) (W O4)","","- La0.01 O4 Pb0.99 W -","- La0.01 O4 Pb0.99 W -","- La0.04 O16 Pb3.96 W4 -","4","0.25","","Lin, Q.-S.; Feng, X.-Q.; Chen, J.-T.","The structure of a PWO:La(3+) crystal","Journal of Alloys Compd.","2000","307","","245","248","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521521","5.39283","","5.44856","","20.51849","","90","","90","","90","","602.898","","","","","","","","","","","","","3","A m a m","-A 2 2a","63","","","","- La3 Ni2 O7 -","- La3 Ni2 O7 -","- La12 Ni8 O28 -","4","0.25","","Ling, C.D.; Argyriou, D.N.; Wu, G.-Q.; Neumeier, J.J.","Neutron diffraction study of La3 Ni2 O7 : structural relationships among n = 1, 2, and 3 phases Lan+1 Nin O3n+1","Journal of Solid State Chemistry","2000","152","","517","525","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521522","5.41327","","5.46233","","27.96049","","90","","90","","90","","826.766","","","","","","","","","","","","","3","B m a b","-B 2ab 2","64","","","","- La4 Ni3 O10 -","- La4 Ni3 O10 -","- La16 Ni12 O40 -","4","","","Ling, C.D.; Argyriou, D.N.; Wu, G.-Q.; Neumeier, J.J.","Neutron diffraction study of La3 Ni2 O7 : structural relationships among n = 1, 2, and 3 phases Lan+1 Nin O3n+1","Journal of Solid State Chemistry","2000","152","","517","525","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521523","7.9502","","7.9502","","7.9502","","90","","90","","90","","502.498","","","","","","","","","","","","","3","P a -3","-P 2ac 2ab 3","205","","W (P2 O7)","","- O7 P2 W -","- O7 P2 W -","- O28 P8 W4 -","4","0.166667","","Lisnyak, V.V.; Stus', N.V.; Belyavina, N.M.; Slobodyanik, N.S.; Markiv, V.Ya.","Crystal structure of a novel cubic pyrophosphate W P2 O7","Journal of Alloys Compd.","2000","309","","83","87","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521529","5.414","","5.414","","5.414","","90","","90","","90","","158.692","","","","","","","","","","","","","4","P -4","P -4","81","","Cu2 Fe (Sn S4)","","- Cu2 Fe S4 Sn -","- Cu2 Fe S4 Sn -","- Cu2 Fe S4 Sn -","1","0.25","","Llanos, J.; Tapia, M.; Mujica, C.; Oro-Sole, J.; Gomez-Romero, P.","A new structural modification of stannite","Boletin de la Sociedad Chilena de Quimica","2000","45","","605","609","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521535","6.657","","6.714","","6.518","","112.31","","92.14","","83.89","","267.983","","","","","","","","","","","","","4","P -1","-P 1","2","","Na2 Mn (P2 O7)","","- Mn Na O7 P2 -","- Mn Na O7 P2 -","- Mn2 Na2 O14 P4 -","2","1","","Lokanath, N.K.; Sridhar, M.A.; Shashidara Prasad, J.; Gopalakrishnan, G.S.; Ashamanjari, K.G.","Synthesis and structural characterization of Na2 Mn P2 O7 crystal","Bulletin of Materials Science (Bangalore)","2000","23","","175","178","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521536","4.893","","4.893","","47.78","","90","","90","","120","","990.666","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","Sr Al2 (B2 O7)","","- Al2 B2 O7 Sr -","- Al2 B2 O7 Sr -","- Al12 B12 O42 Sr6 -","6","0.166667","","Lucas, F.; Jaulmes, S.; Quarton, M.; le Mercier, T.; Fouassier, C.; Guillen, F.","Crystal structure of Sr Al2 B2 O7 and Eu(2+) luminescence","Journal of Solid State Chemistry","2000","150","","404","409","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521537","13.807","","3.483","","18.564","","90","","108.95","","90","","844.354","","","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","Ni (Ta1.98 Nb0.02) Se7","","- Nb0.02 Ni Se7 Ta1.98 -","- Nb0.02 Ni Se7 Ta1.98 -","- Nb0.08 Ni4 Se28 Ta7.92 -","4","0.5","","Luedecke, J.; Schneider, M.; van Smaalen, S.","Independent q and 2q distortions in the incommensurately modulated low-temperature structure of Ni Ta2 Se7","Journal of Solid State Chemistry","2000","153","","152","157","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521560","4.032","","4.032","","15.467","","90","","90","","90","","251.447","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Gd (Ti0.85 Mo0.15) Ge","","- Gd Ge Mo0.15 Ti0.85 -","- Gd Ge Mo0.15 Ti0.85 -","- Gd4 Ge4 Mo0.6 Ti3.4 -","4","0.125","","Morozkin, A.V.; Sviridov, I.A.","New ternary (Ce Sc Si)-type R Ti0.85 Mo0.15 Ge compounds (R = Gd-Tm, Lu)","Journal of Alloys Compd.","2000","296","","6","7","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521561","4.014","","4.014","","15.315","","90","","90","","90","","246.758","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Tb (Ti0.85 Mo0.15) Ge","","- Ge Mo0.15 Tb Ti0.85 -","- Ge Mo0.15 Tb Ti0.85 -","- Ge4 Mo0.6 Tb4 Ti3.4 -","4","0.125","","Morozkin, A.V.; Sviridov, I.A.","New ternary (Ce Sc Si)-type R Ti0.85 Mo0.15 Ge compounds (R = Gd-Tm, Lu)","Journal of Alloys Compd.","2000","296","","6","7","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521562","4.01","","4.01","","15.264","","90","","90","","90","","245.447","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Dy (Ti0.85 Mo0.15) Ge","","- Dy Ge Mo0.15 Ti0.85 -","- Dy Ge Mo0.15 Ti0.85 -","- Dy4 Ge4 Mo0.6 Ti3.4 -","4","0.125","","Morozkin, A.V.; Sviridov, I.A.","New ternary (Ce Sc Si)-type R Ti0.85 Mo0.15 Ge compounds (R = Gd-Tm, Lu)","Journal of Alloys Compd.","2000","296","","6","7","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521563","3.99","","3.99","","15.144","","90","","90","","90","","241.094","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Ho Ti0.85 Mo0.15 Ge","","- Ge Ho Mo0.15 Ti0.85 -","- Ge Ho Mo0.15 Ti0.85 -","- Ge4 Ho4 Mo0.6 Ti3.4 -","4","0.125","","Morozkin, A.V.; Sviridov, I.A.","New ternary (Ce Sc Si)-type R Ti0.85 Mo0.15 Ge compounds (R = Gd-Tm, Lu)","Journal of Alloys Compd.","2000","296","","6","7","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521564","3.993","","3.993","","15.107","","90","","90","","90","","240.867","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Er (Ti0.85 Mo0.15) Ge","","- Er Ge Mo0.15 Ti0.85 -","- Er Ge Mo0.15 Ti0.85 -","- Er4 Ge4 Mo0.6 Ti3.4 -","4","0.125","","Morozkin, A.V.; Sviridov, I.A.","New ternary (Ce Sc Si)-type R Ti0.85 Mo0.15 Ge compounds (R = Gd-Tm, Lu)","Journal of Alloys Compd.","2000","296","","6","7","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521565","3.97","","3.97","","15.004","","90","","90","","90","","236.477","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Tm (Ti0.85 Mo0.15) Ge","","- Ge Mo0.15 Ti0.85 Tm -","- Ge Mo0.15 Ti0.85 Tm -","- Ge4 Mo0.6 Ti3.4 Tm4 -","4","0.125","","Morozkin, A.V.; Sviridov, I.A.","New ternary (Ce Sc Si)-type R Ti0.85 Mo0.15 Ge compounds (R = Gd-Tm, Lu)","Journal of Alloys Compd.","2000","296","","6","7","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521566","3.955","","3.955","","14.875","","90","","90","","90","","232.675","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Lu (Ti0.85 Mo0.15) Ge","","- Ge Lu Mo0.15 Ti0.85 -","- Ge Lu Mo0.15 Ti0.85 -","- Ge4 Lu4 Mo0.6 Ti3.4 -","4","0.125","","Morozkin, A.V.; Sviridov, I.A.","New ternary (Ce Sc Si)-type R Ti0.85 Mo0.15 Ge compounds (R = Gd-Tm, Lu)","Journal of Alloys Compd.","2000","296","","6","7","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521567","6.691","","4.146","","7.365","","90","","90","","90","","204.312","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Lu Rh Si -","- Lu Rh Si -","- Lu4 Rh4 Si4 -","4","0.5","","Morozkin, A.V.; Sviridov, I.A.","New ternary compounds in the Lu - (Ru, Rh) - (Si, Ge) systems","Journal of Alloys Compd.","2000","296","","4","5","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521568","6.871","","4.259","","7.305","","90","","90","","90","","213.771","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Lu Ru Ge","","- Ge Lu Ru -","- Ge Lu Ru -","- Ge4 Lu4 Ru4 -","4","0.5","","Morozkin, A.V.; Sviridov, I.A.","New ternary compounds in the Lu - (Ru, Rh) - (Si, Ge) systems","Journal of Alloys Compd.","2000","296","","4","5","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521569","6.736","","4.216","","7.493","","90","","90","","90","","212.794","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Lu Rh Ge","","- Ge Lu Rh -","- Ge Lu Rh -","- Ge4 Lu4 Rh4 -","4","0.5","","Morozkin, A.V.; Sviridov, I.A.","New ternary compounds in the Lu - (Ru, Rh) - (Si, Ge) systems","Journal of Alloys Compd.","2000","296","","4","5","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521570","10.611","","10.611","","5.573","","90","","90","","90","","627.483","","","","","","","","","","","","","3","P 4/m n c","-P 4 2n","128","","","","- Lu2 Ru3 Si5 -","- Lu2 Ru3 Si5 -","- Lu8 Ru12 Si20 -","4","0.25","","Morozkin, A.V.; Sviridov, I.A.","New ternary compounds in the Lu - (Ru, Rh) - (Si, Ge) systems","Journal of Alloys Compd.","2000","296","","4","5","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521571","4.131","","4.131","","9.411","","90","","90","","90","","160.6","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","","","- Lu Ru2 Si2 -","- Lu Ru2 Si2 -","- Lu2 Ru4 Si4 -","2","0.0625","","Morozkin, A.V.; Sviridov, I.A.","New ternary compounds in the Lu - (Ru, Rh) - (Si, Ge) systems","Journal of Alloys Compd.","2000","296","","4","5","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521572","4.005","","4.005","","9.83","","90","","90","","90","","157.673","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","","","- Lu Rh2 Si2 -","- Lu Rh2 Si2 -","- Lu2 Rh4 Si4 -","2","0.0625","","Morozkin, A.V.; Sviridov, I.A.","New ternary compounds in the Lu - (Ru, Rh) - (Si, Ge) systems","Journal of Alloys Compd.","2000","296","","4","5","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521573","8.239","","8.239","","8.239","","90","","90","","90","","559.273","","","","","","","","","","","","","3","I m -3 m","-I 4 2 3","229","","Lu4 Ru7 Ge6","","- Ge6 Lu4 Ru7 -","- Ge6 Lu4 Ru7 -","- Ge12 Lu8 Ru14 -","2","0.0208333","","Morozkin, A.V.; Sviridov, I.A.","New ternary compounds in the Lu - (Ru, Rh) - (Si, Ge) systems","Journal of Alloys Compd.","2000","296","","4","5","","","","","","","","","","","","","","","","","","","","","","has coordinates","141785","2020-10-21","18:00:00",""
"1521574","8.244","","8.244","","8.244","","90","","90","","90","","560.291","","","","","","","","","","","","","3","I m -3 m","-I 4 2 3","229","","Lu4 Rh7 Ge6","","- Ge6 Lu4 Rh7 -","- Ge6 Lu4 Rh7 -","- Ge12 Lu8 Rh14 -","2","0.0208333","","Morozkin, A.V.; Sviridov, I.A.","New ternary compounds in the Lu - (Ru, Rh) - (Si, Ge) systems","Journal of Alloys Compd.","2000","296","","4","5","","","","","","","","","","","","","","","","","","","","","","has coordinates","141786","2020-10-21","18:00:00",""
"1521575","8.882","","8.882","","8.882","","90","","90","","90","","700.7","","","","","","","","","","","","","3","P m -3 n","-P 4n 2 3","223","","Lu3 Rh4 Ge13","","- Ge13 Lu3 Rh4 -","- Ge13 Lu3 Rh4 -","- Ge26 Lu6 Rh8 -","2","0.0416667","","Morozkin, A.V.; Sviridov, I.A.","New ternary compounds in the Lu - (Ru, Rh) - (Si, Ge) systems","Journal of Alloys Compd.","2000","296","","4","5","","","","","","","","","","","","","","","","","","","","","","has coordinates","141787","2020-10-21","18:00:00",""
"1521576","4.07","","4.07","","7.723","","90","","90","","90","","127.931","","","","","","","","","","","","","3","P 4/n m m :2","-P 4a 2a","129","","Gd Ti Ge0.9","","- Gd Ge0.9 Ti -","- Gd Ge0.9 Ti -","- Gd2 Ge1.8 Ti2 -","2","0.125","","Morozkin, A.V.; Viting, L.M.; Sviridov, I.A.; Tskhadadze, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521577","4.071","","4.071","","15.422","","90","","90","","90","","255.589","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","Gd Ti0.9 Ge","","- Gd Ge Ti0.9 -","- Gd Ge Ti0.9 -","- Gd4 Ge4 Ti3.6 -","4","0.125","","Morozkin, A.V.; Viting, L.M.; Sviridov, I.A.; Tskhadadze, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521578","4.06","","4.06","","15.415","","90","","90","","90","","254.095","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","Gd0.9 Ti Ge","","- Gd0.9 Ge Ti -","- Gd0.9 Ge Ti -","- Gd3.6 Ge4 Ti4 -","4","0.125","","Morozkin, A.V.; Viting, L.M.; Sviridov, I.A.; Tskhadadze, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521579","4.058","","4.058","","7.708","","90","","90","","90","","126.93","","","","","","","","","","","","","3","P 4/n m m :2","-P 4a 2a","129","","Gd0.9 Ti Ge","","- Gd0.9 Ge Ti -","- Gd0.9 Ge Ti -","- Gd1.8 Ge2 Ti2 -","2","0.125","","Morozkin, A.V.; Viting, L.M.; Tskhadadze, I.A.; Sviridov, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521580","4.06","","4.06","","15.412","","90","","90","","90","","254.045","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","Gd Ti Ge","","- Gd Ge Ti -","- Gd Ge Ti -","- Gd4 Ge4 Ti4 -","4","0.125","","Morozkin, A.V.; Viting, L.M.; Sviridov, I.A.; Tskhadadze, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521581","4.059","","4.059","","15.394","","90","","90","","90","","253.624","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","(Sm0.05 Gd0.95) Ti Ge","","- Gd0.95 Ge Sm0.05 Ti -","- Gd0.95 Ge Sm0.05 Ti -","- Gd3.8 Ge4 Sm0.2 Ti4 -","4","0.125","","Morozkin, A.V.; Viting, L.M.; Sviridov, I.A.; Tskhadadze, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521582","4.059","","4.059","","7.697","","90","","90","","90","","126.812","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","(Sm0.05 Gd0.95) Ti Ge","","- Gd0.95 Ge Sm0.05 Ti -","- Gd0.95 Ge Sm0.05 Ti -","- Gd1.9 Ge2 Sm0.1 Ti2 -","2","0.125","","Morozkin, A.V.; Tskhadadze, I.A.; Viting, L.M.; Sviridov, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521583","4.053","","4.053","","15.378","","90","","90","","90","","252.611","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","(Sm0.1 Gd0.9) Ti Ge","","- Gd0.9 Ge Sm0.1 Ti -","- Gd0.9 Ge Sm0.1 Ti -","- Gd3.6 Ge4 Sm0.4 Ti4 -","4","0.125","","Morozkin, A.V.; Viting, L.M.; Sviridov, I.A.; Tskhadadze, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521584","4.052","","4.052","","7.687","","90","","90","","90","","126.211","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","(Sm0.1 Gd0.9) Ti Ge","","- Gd0.9 Ge Sm0.1 Ti -","- Gd0.9 Ge Sm0.1 Ti -","- Gd1.8 Ge2 Sm0.2 Ti2 -","2","0.125","","Morozkin, A.V.; Viting, L.M.; Tskhadadze, I.A.; Sviridov, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521585","4.054","","4.054","","15.391","","90","","90","","90","","252.95","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","(Sm0.3 Gd0.7) Ti Ge","","- Gd0.7 Ge Sm0.3 Ti -","- Gd0.7 Ge Sm0.3 Ti -","- Gd2.8 Ge4 Sm1.2 Ti4 -","4","0.125","","Morozkin, A.V.; Viting, L.M.; Sviridov, I.A.; Tskhadadze, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521586","4.052","","4.052","","15.383","","90","","90","","90","","252.569","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","(Sm0.4 Gd0.6) Ti Ge","","- Gd0.6 Ge Sm0.4 Ti -","- Gd0.6 Ge Sm0.4 Ti -","- Gd2.4 Ge4 Sm1.6 Ti4 -","4","0.125","","Morozkin, A.V.; Viting, L.M.; Sviridov, I.A.; Tskhadadze, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521587","4.072","","4.072","","15.464","","90","","90","","90","","256.411","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","(Sm0.5 Gd0.5) Ti Ge","","- Gd0.5 Ge Sm0.5 Ti -","- Gd0.5 Ge Sm0.5 Ti -","- Gd2 Ge4 Sm2 Ti4 -","4","0.125","","Morozkin, A.V.; Sviridov, I.A.; Viting, L.M.; Tskhadadze, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521588","4.067","","4.067","","15.45","","90","","90","","90","","255.551","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","(Sm0.6 Gd0.4) Ti Ge","","- Gd0.4 Ge Sm0.6 Ti -","- Gd0.4 Ge Sm0.6 Ti -","- Gd1.6 Ge4 Sm2.4 Ti4 -","4","0.125","","Morozkin, A.V.; Sviridov, I.A.; Viting, L.M.; Tskhadadze, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521589","4.075","","4.075","","15.489","","90","","90","","90","","257.205","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","(Sm0.8 Gd0.2) Ti Ge","","- Gd0.2 Ge Sm0.8 Ti -","- Gd0.2 Ge Sm0.8 Ti -","- Gd0.8 Ge4 Sm3.2 Ti4 -","4","0.125","","Morozkin, A.V.; Sviridov, I.A.; Viting, L.M.; Tskhadadze, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521590","4.079","","4.079","","15.502","","90","","90","","90","","257.926","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","Sm Ti Ge","","- Ge Sm Ti -","- Ge Sm Ti -","- Ge4 Sm4 Ti4 -","4","0.125","","Morozkin, A.V.; Viting, L.M.; Sviridov, I.A.; Tskhadadze, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521591","4.075","","4.075","","7.749","","90","","90","","90","","128.677","","","","","","","","","","","","","3","P 4/n m m :2","-P 4a 2a","129","","Sm Ti Ge","","- Ge Sm Ti -","- Ge Sm Ti -","- Ge2 Sm2 Ti2 -","2","0.125","","Morozkin, A.V.; Sviridov, I.A.; Viting, L.M.; Tskhadadze, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521592","4.062","","4.062","","7.685","","90","","90","","90","","126.801","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","(Gd0.8 Y0.2) Ti Ge","","- Gd0.8 Ge Ti Y0.2 -","- Gd0.8 Ge Ti Y0.2 -","- Gd1.6 Ge2 Ti2 Y0.4 -","2","0.125","","Morozkin, A.V.; Viting, L.M.; Sviridov, I.A.; Tskhadadze, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521593","4.064","","4.064","","15.369","","90","","90","","90","","253.836","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","(Gd0.8 Y0.2) Ti Ge","","- Gd0.8 Ge Ti Y0.2 -","- Gd0.8 Ge Ti Y0.2 -","- Gd3.2 Ge4 Ti4 Y0.8 -","4","0.125","","Morozkin, A.V.; Viting, L.M.; Sviridov, I.A.; Tskhadadze, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521594","4.063","","4.063","","7.674","","90","","90","","90","","126.682","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","(Gd0.6 Y0.4) Ti Ge","","- Gd0.6 Ge Ti Y0.4 -","- Gd0.6 Ge Ti Y0.4 -","- Gd1.2 Ge2 Ti2 Y0.8 -","2","0.125","","Morozkin, A.V.; Viting, L.M.; Tskhadadze, I.A.; Sviridov, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521595","4.064","","4.064","","15.348","","90","","90","","90","","253.489","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","(Gd0.6 Y0.4) Ti Ge","","- Gd0.6 Ge Ti Y0.4 -","- Gd0.6 Ge Ti Y0.4 -","- Gd2.4 Ge4 Ti4 Y1.6 -","4","0.125","","Morozkin, A.V.; Viting, L.M.; Sviridov, I.A.; Tskhadadze, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521596","4.059","","4.059","","7.658","","90","","90","","90","","126.169","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","(Gd0.5 Y0.5) Ti Ge","","- Gd0.5 Ge Ti Y0.5 -","- Gd0.5 Ge Ti Y0.5 -","- Gd Ge2 Ti2 Y -","2","0.125","","Morozkin, A.V.; Viting, L.M.; Sviridov, I.A.; Tskhadadze, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521597","4.059","","4.059","","7.649","","90","","90","","90","","126.021","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","(Gd0.4 Y0.6) Ti Ge","","- Gd0.4 Ge Ti Y0.6 -","- Gd0.4 Ge Ti Y0.6 -","- Gd0.8 Ge2 Ti2 Y1.2 -","2","0.125","","Morozkin, A.V.; Viting, L.M.; Sviridov, I.A.; Tskhadadze, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521598","4.059","","4.059","","15.292","","90","","90","","90","","251.943","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","(Gd0.4 Y0.6) Ti Ge","","- Gd0.4 Ge Ti Y0.6 -","- Gd0.4 Ge Ti Y0.6 -","- Gd1.6 Ge4 Ti4 Y2.4 -","4","0.125","","Morozkin, A.V.; Tskhadadze, I.A.; Viting, L.M.; Sviridov, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521599","4.051","","4.051","","7.629","","90","","90","","90","","125.196","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","(Gd0.2 Y0.8) Ti Ge","","- Gd0.2 Ge Ti Y0.8 -","- Gd0.2 Ge Ti Y0.8 -","- Gd0.4 Ge2 Ti2 Y1.6 -","2","0.125","","Morozkin, A.V.; Viting, L.M.; Sviridov, I.A.; Tskhadadze, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521600","4.053","","4.053","","15.257","","90","","90","","90","","250.624","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","(Gd0.2 Y0.8) Ti Ge","","- Gd0.2 Ge Ti Y0.8 -","- Gd0.2 Ge Ti Y0.8 -","- Gd0.8 Ge4 Ti4 Y3.2 -","4","0.125","","Morozkin, A.V.; Viting, L.M.; Tskhadadze, I.A.; Sviridov, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521601","4.049","","4.049","","7.63","","90","","90","","90","","125.089","","","","","","","","","","","","","3","P 4/n m m :2","-P 4a 2a","129","","Y Ti Ge","","- Ge Ti Y -","- Ge Ti Y -","- Ge2 Ti2 Y2 -","2","0.125","","Morozkin, A.V.; Viting, L.M.; Sviridov, I.A.; Tskhadadze, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521602","4.049","","4.049","","15.258","","90","","90","","90","","250.146","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","Y Ti Ge","","- Ge Ti Y -","- Ge Ti Y -","- Ge4 Ti4 Y4 -","4","0.125","","Morozkin, A.V.; Tskhadadze, I.A.; Viting, L.M.; Sviridov, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521603","4.069","","4.069","","15.416","","90","","90","","90","","255.239","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Gd (Sc0.05 Ti0.95) Ge","","- Gd Ge Sc0.05 Ti0.95 -","- Gd Ge Sc0.05 Ti0.95 -","- Gd4 Ge4 Sc0.2 Ti3.8 -","4","0.125","","Morozkin, A.V.; Tskhadadze, I.A.; Viting, L.M.; Sviridov, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521604","4.068","","4.068","","7.708","","90","","90","","90","","127.557","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","Gd (Sc0.05 Ti0.95) Ge","","- Gd Ge Sc0.05 Ti0.95 -","- Gd Ge Sc0.05 Ti0.95 -","- Gd2 Ge2 Sc0.1 Ti1.9 -","2","0.125","","Morozkin, A.V.; Viting, L.M.; Sviridov, I.A.; Tskhadadze, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521605","4.077","","4.077","","15.415","","90","","90","","90","","256.227","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Gd (Sc0.1 Ti0.9) Ge","","- Gd Ge Sc0.1 Ti0.9 -","- Gd Ge Sc0.1 Ti0.9 -","- Gd4 Ge4 Sc0.4 Ti3.6 -","4","0.125","","Morozkin, A.V.; Viting, L.M.; Sviridov, I.A.; Tskhadadze, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521606","4.074","","4.074","","7.707","","90","","90","","90","","127.917","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","Gd (Sc0.1 Ti0.9) Ge","","- Gd Ge Sc0.1 Ti0.9 -","- Gd Ge Sc0.1 Ti0.9 -","- Gd2 Ge2 Sc0.2 Ti1.8 -","2","0.125","","Morozkin, A.V.; Viting, L.M.; Sviridov, I.A.; Tskhadadze, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521607","4.078","","4.078","","15.395","","90","","90","","90","","256.02","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Gd (Sc0.15 Ti0.85) Ge","","- Gd Ge Sc0.15 Ti0.85 -","- Gd Ge Sc0.15 Ti0.85 -","- Gd4 Ge4 Sc0.6 Ti3.4 -","4","0.125","","Morozkin, A.V.; Tskhadadze, I.A.; Viting, L.M.; Sviridov, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521608","4.093","","4.093","","15.421","","90","","90","","90","","258.343","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Gd (Sc0.2 Ti0.8) Ge","","- Gd Ge Sc0.2 Ti0.8 -","- Gd Ge Sc0.2 Ti0.8 -","- Gd4 Ge4 Sc0.8 Ti3.2 -","4","0.125","","Morozkin, A.V.; Viting, L.M.; Sviridov, I.A.; Tskhadadze, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521609","4.1","","4.1","","15.397","","90","","90","","90","","258.824","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Gd (Sc0.3 Ti0.7) Ge","","- Gd Ge Sc0.3 Ti0.7 -","- Gd Ge Sc0.3 Ti0.7 -","- Gd4 Ge4 Sc1.2 Ti2.8 -","4","0.125","","Morozkin, A.V.; Viting, L.M.; Sviridov, I.A.; Tskhadadze, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521610","4.129","","4.129","","15.401","","90","","90","","90","","262.566","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Gd (Sc0.4 Ti0.6) Ge","","- Gd Ge Sc0.4 Ti0.6 -","- Gd Ge Sc0.4 Ti0.6 -","- Gd4 Ge4 Sc1.6 Ti2.4 -","4","0.125","","Morozkin, A.V.; Sviridov, I.A.; Viting, L.M.; Tskhadadze, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521611","4.141","","4.141","","15.376","","90","","90","","90","","263.666","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Gd (Sc0.5 Ti0.5) Ge","","- Gd Ge Sc0.5 Ti0.5 -","- Gd Ge Sc0.5 Ti0.5 -","- Gd4 Ge4 Sc2 Ti2 -","4","0.125","","Morozkin, A.V.; Viting, L.M.; Sviridov, I.A.; Tskhadadze, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521612","4.066","","4.066","","15.405","","90","","90","","90","","254.681","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Gd (Zr0.15 Ti0.85) Ge","","- Gd Ge Ti0.85 Zr0.15 -","- Gd Ge Ti0.85 Zr0.15 -","- Gd4 Ge4 Ti3.4 Zr0.6 -","4","0.125","","Morozkin, A.V.; Sviridov, I.A.; Viting, L.M.; Tskhadadze, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521613","4.064","","4.064","","7.704","","90","","90","","90","","127.24","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","Gd (Zr0.15 Ti0.85) Ge","","- Gd Ge Ti0.85 Zr0.15 -","- Gd Ge Ti0.85 Zr0.15 -","- Gd2 Ge2 Ti1.7 Zr0.3 -","2","0.125","","Morozkin, A.V.; Tskhadadze, I.A.; Sviridov, I.A.; Viting, L.M.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521614","4.072","","4.072","","15.44","","90","","90","","90","","256.013","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Gd (Zr0.3 Ti0.7) Ge","","- Gd Ge Ti0.7 Zr0.3 -","- Gd Ge Ti0.7 Zr0.3 -","- Gd4 Ge4 Ti2.8 Zr1.2 -","4","0.125","","Morozkin, A.V.; Viting, L.M.; Sviridov, I.A.; Tskhadadze, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521615","4.063","","4.063","","15.41","","90","","90","","90","","254.388","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Gd (Hf0.15 Ti0.85) Ge","","- Gd Ge Hf0.15 Ti0.85 -","- Gd Ge Hf0.15 Ti0.85 -","- Gd4 Ge4 Hf0.6 Ti3.4 -","4","0.125","","Morozkin, A.V.; Viting, L.M.; Tskhadadze, I.A.; Sviridov, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521616","4.063","","4.063","","7.707","","90","","90","","90","","127.227","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","Gd (Hf0.15 Ti0.85) Ge","","- Gd Ge Hf0.15 Ti0.85 -","- Gd Ge Hf0.15 Ti0.85 -","- Gd2 Ge2 Hf0.3 Ti1.7 -","2","0.125","","Morozkin, A.V.; Viting, L.M.; Sviridov, I.A.; Tskhadadze, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521617","4.076","","4.076","","15.471","","90","","90","","90","","257.032","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Gd (Hf0.3 Ti0.7) Ge","","- Gd Ge Hf0.3 Ti0.7 -","- Gd Ge Hf0.3 Ti0.7 -","- Gd4 Ge4 Hf1.2 Ti2.8 -","4","0.125","","Morozkin, A.V.; Tskhadadze, I.A.; Viting, L.M.; Sviridov, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521618","4.041","","4.041","","15.411","","90","","90","","90","","251.657","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Gd (V0.15 Ti0.85) Ge","","- Gd Ge Ti0.85 V0.15 -","- Gd Ge Ti0.85 V0.15 -","- Gd4 Ge4 Ti3.4 V0.6 -","4","0.125","","Morozkin, A.V.; Viting, L.M.; Tskhadadze, I.A.; Sviridov, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521619","4.038","","4.038","","7.705","","90","","90","","90","","125.633","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","Gd (V0.15 Ti0.85) Ge","","- Gd Ge Ti0.85 V0.15 -","- Gd Ge Ti0.85 V0.15 -","- Gd2 Ge2 Ti1.7 V0.3 -","2","0.125","","Morozkin, A.V.; Sviridov, I.A.; Viting, L.M.; Tskhadadze, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521620","4.04","","4.04","","15.424","","90","","90","","90","","251.744","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Gd (V0.3 Ti0.7) Ge","","- Gd Ge Ti0.7 V0.3 -","- Gd Ge Ti0.7 V0.3 -","- Gd4 Ge4 Ti2.8 V1.2 -","4","0.125","","Morozkin, A.V.; Tskhadadze, I.A.; Sviridov, I.A.; Viting, L.M.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521621","4.029","","4.029","","7.71","","90","","90","","90","","125.155","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","Gd (V0.3 Ti0.7) Ge","","- Gd Ge Ti0.7 V0.3 -","- Gd Ge Ti0.7 V0.3 -","- Gd2 Ge2 Ti1.4 V0.6 -","2","0.125","","Morozkin, A.V.; Viting, L.M.; Tskhadadze, I.A.; Sviridov, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521622","4.043","","4.043","","15.495","","90","","90","","90","","253.279","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Gd (Nb0.15 Ti0.85) Ge","","- Gd Ge Nb0.15 Ti0.85 -","- Gd Ge Nb0.15 Ti0.85 -","- Gd4 Ge4 Nb0.6 Ti3.4 -","4","0.125","","Morozkin, A.V.; Viting, L.M.; Tskhadadze, I.A.; Sviridov, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521623","4.044","","4.044","","7.747","","90","","90","","90","","126.694","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","Gd (Nb0.15 Ti0.85) Ge","","- Gd Ge Nb0.15 Ti0.85 -","- Gd Ge Nb0.15 Ti0.85 -","- Gd2 Ge2 Nb0.3 Ti1.7 -","2","0.125","","Morozkin, A.V.; Sviridov, I.A.; Viting, L.M.; Tskhadadze, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521624","4.058","","4.058","","15.523","","90","","90","","90","","255.623","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Gd (Nb0.3 Ti0.7) Ge","","- Gd Ge Nb0.3 Ti0.7 -","- Gd Ge Nb0.3 Ti0.7 -","- Gd4 Ge4 Nb1.2 Ti2.8 -","4","0.125","","Morozkin, A.V.; Sviridov, I.A.; Viting, L.M.; Tskhadadze, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521625","4.058","","4.058","","15.384","","90","","90","","90","","253.334","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Gd (Mn0.3 Ti0.7) Ge","","- Gd Ge Mn0.3 Ti0.7 -","- Gd Ge Mn0.3 Ti0.7 -","- Gd4 Ge4 Mn1.2 Ti2.8 -","4","0.125","","Morozkin, A.V.; Viting, L.M.; Tskhadadze, I.A.; Sviridov, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521626","4.06","","4.06","","7.693","","90","","90","","90","","126.808","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","Gd (Mn0.3 Ti0.7) Ge","","- Gd Ge Mn0.3 Ti0.7 -","- Gd Ge Mn0.3 Ti0.7 -","- Gd2 Ge2 Mn0.6 Ti1.4 -","2","0.125","","Morozkin, A.V.; Viting, L.M.; Sviridov, I.A.; Tskhadadze, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521627","4.074","","4.074","","15.392","","90","","90","","90","","255.468","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Gd Ti (Ge0.9 C0.1)","","- C0.1 Gd Ge0.9 Ti -","- C0.1 Gd Ge0.9 Ti -","- C0.4 Gd4 Ge3.6 Ti4 -","4","0.125","","Morozkin, A.V.; Viting, L.M.; Sviridov, I.A.; Tskhadadze, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521628","4.053","","4.053","","15.374","","90","","90","","90","","252.546","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Gd Ti (Ge0.9 Si0.1)","","- Gd Ge0.9 Si0.1 Ti -","- Gd Ge0.9 Si0.1 Ti -","- Gd4 Ge3.6 Si0.4 Ti4 -","4","0.125","","Morozkin, A.V.; Viting, L.M.; Tskhadadze, I.A.; Sviridov, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521629","4.05","","4.05","","7.687","","90","","90","","90","","126.086","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","Gd Ti (Ge0.9 Si0.1)","","- Gd Ge0.9 Si0.1 Ti -","- Gd Ge0.9 Si0.1 Ti -","- Gd2 Ge1.8 Si0.2 Ti2 -","2","0.125","","Morozkin, A.V.; Viting, L.M.; Sviridov, I.A.; Tskhadadze, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521630","4.067","","4.067","","15.397","","90","","90","","90","","254.674","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Gd Ti (Ge0.9 Pb0.1)","","- Gd Ge0.9 Pb0.1 Ti -","- Gd Ge0.9 Pb0.1 Ti -","- Gd4 Ge3.6 Pb0.4 Ti4 -","4","0.125","","Morozkin, A.V.; Viting, L.M.; Sviridov, I.A.; Tskhadadze, I.A.","Ce Sc Si - and Ce Fe Si-type structures in compounds derived from Gd Ti Ge","Journal of Alloys Compd.","2000","297","","168","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521631","8.8352","","8.8352","","22.254","","90","","90","","120","","1504.43","","","","","","","","","","","","","5","R -3 :H","-R 3","148","","Cu0.5 Mn0.25 Zr2 (P O4)3","","- Cu0.5 Mn0.25 O12 P3 Zr2 -","- Cu0.501 Mn0.25 O12 P3 Zr2 -","- Cu3.006 Mn1.5 O72 P18 Zr12 -","6","0.333333","","Mouline, A.; Alami, M.; Parent, C.; Brochu, R.; Olazcuaga, R.; le Flem, G.","Structural and luminescent properties of a Nasicon-type phosphate Cu(I)0.5 Mn(II)0.25 Zr2 (P O4)3","Journal of Solid State Chemistry","2000","152","","453","459","","","","","","","","","","","","","","","","","","","","","","has coordinates","141844","2020-10-21","18:00:00",""
"1521632","3.89306","","3.89306","","10.6054","","90","","90","","90","","160.735","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","Ho Cr2 Si2","","- Cr2 Ho Si2 -","- Cr2 Ho Si2 -","- Cr4 Ho2 Si4 -","2","0.0625","","Moze, O.; Hofmann, M.; Buschow, K.H.J.","Chromium sublattice magnetic ordering in a compound of the Th Cr2 Si2 type structure: Ho Cr2 Si2","Journal of Alloys Compd.","2000","308","","60","63","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521633","3.976","","3.976","","40.554","","90","","90","","120","","555.21","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Ho2 Cu5.58 P4.5","","- Cu5.58 Ho2 P4.5 -","- Cu5.58 Ho2 P4.5 -","- Cu16.74 Ho6 P13.5 -","3","0.0833333","","Mozharivsky, Yu.; Kuz'ma, Yu.B.","Ternary phosphide Ho2 Cu6-x P5-y, its crystal structure, and REm+n (Cu2 P3)m (Cu4 P2)n relationship with other rhombohedral rare-earthcopper phosphides","Journal of Solid State Chemistry","2000","151","","150","156","","","","","","","","","","","","","","","","","","","","","","has coordinates","141846","2020-10-21","18:00:00",""
"1521634","7.5793","","7.5793","","13.2864","","90","","90","","90","","763.248","","","","","","","","","","","","","3","I 4/m c m","-I 4 2c","140","","","","- Ho5 Ni2 Sb -","- Ho5 Ni2 Sb -","- Ho20 Ni8 Sb4 -","4","0.125","","Mozharivsky, Yu.; Franzen, H.F.","Crystal structure and bonding in the rare-earth rich ternary pnictides RE5 M2 X (RE = Y, Gd, Tb, Dy, Ho, Er, Tm, Lu; M = Ni, Pd;X = Sb, Bi)","Journal of Solid State Chemistry","2000","152","","478","485","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521639","14.709","","8.436","","11.461","","90","","90","","90","","1422.14","","","","","","","","","","","","","4","P n a 21","P 2c -2n","33","","Gd (Re O4)3 (H2 O)3","","- Gd H6 O15 Re3 -","- Gd O15 Re3 -","- Gd4 O60 Re12 -","4","1","","Mujica, C.; Llanos, J.; Peters, E.M.; Peters, K.; von Schnering, H.G.","Synthesis, crystal structure, magnetic properties and thermal stability of Gd (Re O4)3 (H2 O)3","Boletin de la Sociedad Chilena de Quimica","2000","45","","329","332","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521640","8.653","","8.653","","5.739","","90","","90","","90","","429.704","","","","","","","","","","","","","3","P 4/n :2","-P 4a","85","","Eu2 Re O5","","- Eu2 O5 Re -","- Eu2 O5 Re -","- Eu8 O20 Re4 -","4","0.5","","Mujica, C.; Gutierrez, D.; Llanos, J.; Cardoso, R.","Synthesis and crystal structure of Eu2 Re O5, a complex oxide with Re - Re pairs in a tetragonal antiprismatic coordination","Journal of Alloys Compd.","2000","307","","127","130","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521654","13.6883","","4.5148","","16.3427","","90","","90","","90","","1009.98","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Ba Sm2 Te4 -","- Ba Sm2 Te4 -","- Ba4 Sm8 Te16 -","4","0.5","","Narducci, A.A.; Yang, Y.-T.; Digman, M.A.; Ibers, J.A.; Sipes, A.B.","An investigation of the rare-earth telluride system Ba Ln2 Te4 (Ln = Sm - Tm, Y): syntheses, crystal structures and magnetic properties","Journal of Alloys Compd.","2000","303","","432","439","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521655","13.6924","","4.4822","","16.25969","","90","","90","","90","","997.891","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Ba Gd2 Te4 -","- Ba Gd2 Te4 -","- Ba4 Gd8 Te16 -","4","0.5","","Narducci, A.A.; Yang, Y.-T.; Digman, M.A.; Sipes, A.B.; Ibers, J.A.","An investigation of the rare-earth telluride system Ba Ln2 Te4 (Ln = Sm - Tm, Y): syntheses, crystal structures and magnetic properties","Journal of Alloys Compd.","2000","303","","432","439","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521656","13.6611","","4.4611","","16.1817","","90","","90","","90","","986.17","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Ba Tb2 Te4 -","- Ba Tb2 Te4 -","- Ba4 Tb8 Te16 -","4","0.5","","Narducci, A.A.; Yang, Y.-T.; Sipes, A.B.; Digman, M.A.; Ibers, J.A.","An investigation of the rare-earth telluride system Ba Ln2 Te4 (Ln = Sm - Tm, Y): syntheses, crystal structures and magnetic properties","Journal of Alloys Compd.","2000","303","","432","439","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521657","13.6567","","4.4517","","16.1465","","90","","90","","90","","981.635","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Ba Dy2 Te4 -","- Ba Dy2 Te4 -","- Ba4 Dy8 Te16 -","4","0.5","","Narducci, A.A.; Yang, Y.-T.; Sipes, A.B.; Digman, M.A.; Ibers, J.A.","An investigation of the rare-earth telluride system Ba Ln2 Te4 (Ln = Sm - Tm, Y): syntheses, crystal structures and magnetic properties","Journal of Alloys Compd.","2000","303","","432","439","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521658","13.646","","4.443","","16.141","","90","","90","","90","","978.616","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Ba Y2 Te4","","- Ba Te4 Y2 -","- Ba Te4 Y2 -","- Ba4 Te16 Y8 -","4","0.5","","Narducci, A.A.; Yang, Y.-T.; Digman, M.A.; Sipes, A.B.; Ibers, J.A.","An investigation of the rare-earth telluride system Ba Ln2 Te4 (Ln = Sm - Tm, Y): syntheses, crystal structures and magnetic properties","Journal of Alloys Compd.","2000","303","","432","439","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521659","13.6211","","4.4322","","16.0959","","90","","90","","90","","971.733","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Ba Ho2 Te4 -","- Ba Ho2 Te4 -","- Ba4 Ho8 Te16 -","4","0.5","","Narducci, A.A.; Yang, Y.-T.; Digman, M.A.; Ibers, J.A.; Sipes, A.B.","An investigation of the rare-earth telluride system Ba Ln2 Te4 (Ln = Sm - Tm, Y): syntheses, crystal structures and magnetic properties","Journal of Alloys Compd.","2000","303","","432","439","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521660","13.5992","","4.4177","","16.0487","","90","","90","","90","","964.161","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Ba Er2 Te4 -","- Ba Er2 Te4 -","- Ba4 Er8 Te16 -","4","0.5","","Narducci, A.A.; Yang, Y.-T.; Ibers, J.A.; Sipes, A.B.; Digman, M.A.","An investigation of the rare-earth telluride system Ba Ln2 Te4 (Ln = Sm - Tm, Y): syntheses, crystal structures and magnetic properties","Journal of Alloys Compd.","2000","303","","432","439","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521661","13.5677","","4.4058","","15.9989","","90","","90","","90","","956.359","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Ba Tm2 Te4","","- Ba Te4 Tm2 -","- Ba Te4 Tm2 -","- Ba4 Te16 Tm8 -","4","0.5","","Narducci, A.A.; Yang, Y.-T.; Digman, M.A.; Sipes, A.B.; Ibers, J.A.","An investigation of the rare-earth telluride system Ba Ln2 Te4 (Ln = Sm - Tm, Y): syntheses, crystal structures and magnetic properties","Journal of Alloys Compd.","2000","303","","432","439","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521662","6.667","","13.01","","15.39","","90","","90","","90","","1334.89","","","","","","","","","","","","","3","I b a m","-I 2 2c","72","","Cs2 Cd3 Te4","","- Cd3 Cs2 Te4 -","- Cd3 Cs2 Te4 -","- Cd12 Cs8 Te16 -","4","0.25","","Narducci, A.A.; Ibers, J.A.","Syntheses, crystal structures, and band gaps of Cs2 Cd3 Te4 and Rb2 Cd3 Te4","Journal of Alloys Compd.","2000","306","","170","174","","","","","","","","","","","","","","","","","","","","","","has coordinates","141875","2020-10-21","18:00:00",""
"1521663","14.424","","15.35","","12.864","","90","","116.249","","90","","2554.49","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Rb2 Cd3 Te4","","- Cd3 Rb2 Te4 -","- Cd3 Rb2 Te4 -","- Cd24 Rb16 Te32 -","8","1","","Narducci, A.A.; Ibers, J.A.","Syntheses, crystal structures, and band gaps of Cs2 Cd3 Te4 and Rb2Cd3 Te4","Journal of Alloys Compd.","2000","306","","170","174","","","","","","","","","","","","","","","","","","","","","","has coordinates","141876","2020-10-21","18:00:00",""
"1521664","11.88","","17.75","","18.14","","87.87","","86.4","","85.78","","3805.25","","","","","","","","","","","","","6","P -1","-P 1","2","","K8.5 H3.5 (Ce (B W11 O39) (W5 O18)) (H2 O)25","","- B Ce H53.5 K8.5 O82 W16 -","- B Ce K8.5 O82 W16 -","- B2 Ce2 K17 O164 W32 -","2","1","","Naruke, Haruo; Yamase, Toshihiro","A novel-type mixed-ligand polyoxotungstolanthanoate, [Ln(BW~11~O~39~)(W~5~O~18~)]^12-^ (Ln = Ce^3+^ and Eu^3+^)","Bulletin of the Chemical Society of Japan","2000","73","2","375","382","10.1246/bcsj.73.375","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521665","11.7035","","17.927","","18.028","","87.401","","86.723","","85.867","","3763.2","","","","","","","","","","","","","6","P -1","-P 1","2","","K9.5 H2.5 (Eu (B W11 O39) (W5 O18)) (H2 O)25","","- B Eu H52.5 K9.5 O82 W16 -","- B Eu K9.5 O82 W16 -","- B2 Eu2 K19 O164 W32 -","2","1","","Naruke, Haruo; Yamase, Toshihiro","A novel-type mixed-ligand polyoxotungstolanthanoate, [Ln(BW~11~O~39~)(W~5~O~18~)]^12-^ (Ln = Ce^3+^ and Eu^3+^)","Bulletin of the Chemical Society of Japan","2000","73","2","375","382","10.1246/bcsj.73.375","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521666","13.255","","13.255","","14.432","","90","","90","","90","","2535.63","","","","","","","","","","","","","7","I 4/m","-I 4","87","","((C3 H7)4 N)2 (Mn (H2 O)4) (Re6 S8 (C N)6)","","- C30 H64 Mn N8 O4 Re6 S8 -","- C30 Mn N8 O4 Re6 S8 -","- C60 Mn2 N16 O8 Re12 S16 -","2","0.125","","Naumov, N.G.; Artemkina, S.B.; Virovets, A.V.; Fedorov, V.E.","Facile transformation of isolated fragments to infinite chains in rhenium chalcocyanide clusters: synthesis and structure of (Pr4 N)2 M (H2 O)5 (Re6 X8 (C N)6) . (H2 O) and (Pr4 N)2 M (H2 O)4 (Re6 S8 (C N)6) (X = S, Se; M = Mn, Ni)","Journal of Solid State Chemistry","2000","153","","195","204","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521667","18.286","","18.345","","16.568","","90","","90","","90","","5557.85","","","","","","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","((C3 H7)4 N)2 (Mn (H2 O)5) (Re6 Se8 (C N)6) (H2 O)","","- C30 H68 Mn N8 O6 Re6 Se8 -","- C30 Mn N8 O6 Re6 Se8 -","- C120 Mn4 N32 O24 Re24 Se32 -","4","1","","Naumov, N.G.; Artemkina, S.B.; Virovets, A.V.; Fedorov, V.E.","Facile transformation of isolated fragments to infinite chains in rhenium chalcocyanide clusters: synthesis and structure of (Pr4 N)2 M (H2 O)5 (Re6 X8 (C N)6) . (H2 O) and (Pr4 N)2 M (H2 O)4 (Re6 S8 (C N)6) (X = S, Se; M = Mn, Ni)","Journal of Solid State Chemistry","2000","153","","195","204","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521668","13.247","","13.247","","14.246","","90","","90","","90","","2499.93","","","","","","","","","","","","","7","I 4/m","-I 4","87","","((C3 H7)4 N)2 (Ni (H2 O)4) (Re6 S8 (C N)6)","","- C30 H64 N8 Ni O4 Re6 S8 -","- C30 N8 Ni O4 Re6 S8 -","- C60 N16 Ni2 O8 Re12 S16 -","2","0.125","","Naumov, N.G.; Artemkina, S.B.; Virovets, A.V.; Fedorov, V.E.","Facile transformation of isolated fragments to infinite chains in rhenium chalcocyanide clusters: synthesis and structure of (Pr4 N)2 M (H2 O)5 (Re6 X8 (C N)6) . (H2 O) and (Pr4 N)2 M (H2 O)4 (Re6 S8 (C N)6) (X = S, Se; M = Mn, Ni)","Journal of Solid State Chemistry","2000","153","","195","204","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521670","3.299","","3.299","","26.101","","90","","90","","120","","246.01","","","","","","","","","","","","","4","R -3 :H","-R 3","148","","In Ga Zn O4","","- Ga In O4 Zn -","- Ga In O4 Zn -","- Ga3 In3 O12 Zn3 -","3","0.166667","","Nespolo, M.; Sato, A.; Osawa, T.; Ohashi, H.","Synthesis, crystal structure and charge distribution of In Ga Zn O4. X-ray diffraction of 20 kb single crystal and 50 kb twin by reticular merohedry","Crystal Research and Technology","2000","35","","151","165","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521671","3.4185","","3.4185","","25.463","","90","","90","","120","","257.698","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","Lu Fe Zn O4","","- Fe Lu O4 Zn -","- Fe Lu O4 Zn -","- Fe3 Lu3 O12 Zn3 -","3","0.0833333","","Nespolo, M.; Nakamura, M.; Ohashi, H.","Reinvestigation of the Lu Fe O3 (Zn O)m homologous series: insightsfrom charge distribution analysis on the effect of the coordinationpolyhedra shape on the cation distribution","Journal of Solid State Chemistry","2000","150","","96","103","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521674","12.0786","","12.102","","21.416","","94.87","","94.755","","113.81","","2830.04","","","","","","","","","","","","","6","P -1","-P 1","2","","(H3 (P Mo12 O40)) ((C H3 C H2)2 N H)5 (H2 O)","","- C20 H60 Mo12 N5 O41 P -","- C20 Mo12 N5 O41 P -","- C40 Mo24 N10 O82 P2 -","2","1","","Niu, J.-Y.; Wang, J.-P.; Yan, B.; Dang, D.-B.; Zhou, Z.-Y.","Preparation, characterization and crystal structure of an intermolecular compound based on H~3~PMo~12~O~40~ . n(H~2~O) and diethylamine","Journal of Chemical Crystallography","2000","30","1","43","48","10.1023/A:1009546132511","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521675","8.3048","","8.3048","","8.3048","","90","","90","","90","","572.78","","","","","","","","","","","","","3","I m -3 m","-I 4 2 3","229","","U4 Ru7 As6","","- As6 Ru7 U4 -","- As6 Ru7 U4 -","- As12 Ru14 U8 -","2","0.0208333","","Noel, H.; Potel, M.; Kaczorowski, D.","A new ternary uranium arsenide, U4 Ru7 As6","Journal of Alloys Compd.","2000","302","","1","2","","","","","","","","","","","","","","","","","","","","","","has coordinates","141888","2020-10-21","18:00:00",""
"1521676","19.118","","19.118","","12.383","","90","","90","","120","","3919.6","","","","","","","","","","","","","4","P 62 2 2","P 62 2 (0 0 4)","180","","K6 (Co W12 O40) (H2 O)16","","- Co K5 O46 W12 -","- Co K5 O46 W12 -","- Co3 K15 O138 W36 -","3","0.25","","Nolan, A.L.; Allen, C.C.; Burns, R.C.; Craig, D.C.; Lawrance, G.A.","X-ray structural studies of K6 (Co(II) W12 O40) . ca 16(H2 O) and K5 (Co(III) W12 O40). ca 16(H2 O) and structural trends along the (X W12 O40)(n-) series, where X = P(V), Si(IV), Co(III) and Co(II)","Australian Journal of Chemistry","2000","53","","59","66","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521677","19.111","","19.111","","12.509","","90","","90","","120","","3956.58","","","","","","","","","","","","","5","P 62 2 2","P 62 2 (0 0 4)","180","","K5 (Co W12 O40) (H2 O)3","","- Co H6 K5 O43 W12 -","- Co K5 O43 W12 -","- Co3 K15 O129 W36 -","3","0.25","","Nolan, A.L.; Allen, C.C.; Burns, R.C.; Lawrance, G.A.; Craig, D.C.","X-ray structural studies of K6 (Co(II) W12 O40) . ca 16(H2 O) and K5 (Co(III) W12 O40). ca 16(H2 O) and structural trends along the (X W12 O40)(n-) series, where X = P(V), Si(IV), Co(III) and Co(II)","Australian Journal of Chemistry","2000","53","","59","66","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521679","12.142","","12.142","","15.919","","90","","90","","90","","2346.91","","","","","","","","","","","","","3","I 4/m c m","-I 4 2c","140","","Ce3 In0.89 Ge1.11","","- Ce3 Ge1.11 In0.89 -","- Ce3 Ge1.11 In0.89 -","- Ce48 Ge17.76 In14.24 -","16","0.5","","Nychyporuk, G.; Zaremba, V.; Pietraszko, A.; Stepien-Damm, J.; Kal'ichak, Ya.M.","Crystal structure of Ce3 Ge1.11 In0.89 and related compounds","Journal of Alloys Compd.","2000","312","","154","157","","","","","","","","","","","","","","","","","","","","","","has coordinates","141892","2020-10-21","18:00:00",""
"1521680","9.536","","17.797","","5.278","","90","","102.54","","90","","874.373","","","","","","","","","","","","","11","C 1 2/m 1","-C 2y","12","","Na0.73 (Li1.35 Na0.6 Ca0.05) (Li0.84 Mg1.77 Fe2.07 Al0.21 Ti0.11) Si8 O22 ((O H)1.16 F0.84)","","- Al0.21 Ca0.05 F0.84 Fe2.07 H1.16 Li2.19 Mg1.77 Na1.33 O23.16 Si8 Ti0.11 -","- Al0.21 Ca0.05 F0.84 Fe2.07 H1.16 Li2.19 Mg1.77 Na1.331 O23.16 Si8 Ti0.11 -","- Al0.42 Ca0.1 F1.68 Fe4.14 H2.32 Li4.38 Mg3.54 Na2.662 O46.32 Si16 Ti0.22 -","2","0.25","","Oberti, R.; Caballero, J.M.; Ottolini, L.; Lopez-Andres, S.; Herreros, V.","Sodic - ferripedrizite, a new monoclinic amphibole bridging the magnesium - iron - manganese - lithium and the sodium calcium groups","American Mineralogist","2000","85","","578","585","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521682","8.379","","8.379","","5.259","","90","","90","","90","","369.222","","","","","","","","","","","","","3","P 4/n :2","-P 4a","85","","Sr (V4 O9)","","- O9 Sr V4 -","- O9 Sr V4 -","- O18 Sr2 V8 -","2","0.25","","Oka, Y.; Yao, T.; Maegawa, S.; Yamamoto, N.; Ueda, M.","Synthesis and crystal structure of Sr V4 O9 in a metastable state","Journal of Solid State Chemistry","2000","149","","414","418","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521683","15.144","","3.596","","14.972","","90","","90.08","","90","","815.342","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","Ba1.128 V8 O21","","- Ba1.128 O21 V8 -","- Ba1.128 O21 V8 -","- Ba2.256 O42 V16 -","2","0.25","","Oka, Y.; Yao, T.; Yamamoto, N.","Hydrothermal synthesis and crystal structure of a new barium vanadium bronze Ba1+x V8 O21 with a tunnel structure","Journal of Solid State Chemistry","2000","150","","330","335","","","","","","","","","","","","","","","","","","","","","","has coordinates","141896","2020-10-21","18:00:00",""
"1521685","10.311","","10.311","","10.311","","90","","90","","90","","1096.23","","","","","","","","","","","","","9","F d -3 m :2","-F 4vw 2vw 3","227","","(Ca0.91 Sb0.27 Fe0.19 Al0.10 Na0.10 Mn0.06) (Sb1.28 Ti0.72) O6 (O H)","","- Al0.1 Ca0.91 Fe0.19 H Mn0.06 Na0.1 O7 Sb1.55 Ti0.72 -","- Al0.1 Ca0.91 Fe0.19 Mn0.06 Na0.1 O7 Sb1.55 Ti0.72 -","- Al0.8 Ca7.28 Fe1.52 Mn0.48 Na0.8 O56 Sb12.4 Ti5.76 -","8","0.0416667","","Zubkova, N.V.; Pushcharovskii, D.Yu.; Atencio, D.; Arakcheeva, A.V.; Matioli, P.A.","The crystal structure of lewisite, (Ca, Sb(3+), Fe(3+), Al, Na, Mn, (vac))2 (Sb(5+), Ti)2 O6 (O H)","Journal of Alloys Compd.","2000","296","","75","79","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521688","5.3624","","5.4451","","27.238","","90","","90.288","","90","","795.307","","","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","Nd4 Co3 O10","","- Co3 Nd4 O10 -","- Co3 Nd4 O10 -","- Co12 Nd16 O40 -","4","1","","Olafsen, A.; Hauback, B.C.; Fjellvag, H.","Crystal structure and properties of Nd4 Co3 O10+d and Nd4 Ni3 O10-d","Journal of Solid State Chemistry","2000","151","","46","55","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521689","5.3675","","5.4548","","27.433","","90","","90.312","","90","","803.189","","","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- Nd4 Ni3 O10 -","- Nd4 Ni3 O10 -","- Nd16 Ni12 O40 -","4","1","","Olafsen, A.; Fjellvag, H.; Hauback, B.C.","Crystal structure and properties of Nd4 Co3 O10+d and Nd4 Ni3 O10-d","Journal of Solid State Chemistry","2000","151","","46","55","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521690","20.00449","","19.9229","","13.3929","","90","","90","","90","","5337.71","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Cs5.32 (Al5.8 Si90.2 O192)","","- Al5.8 Cs5.32 O192 Si90.2 -","- Al5.8008 Cs5.316 O192 Si90.1992 -","- Al5.8008 Cs5.316 O192 Si90.1992 -","1","0.125","","Olson, D.H.; Khosrovani, N.; Toby, B.H.; Peters, A.W.","Crystal structure of dehydrated Cs ZSM-5 (5.8 Al): evidence for nonrandom aluminium distribution","J. Phys. Chem. B","2000","104","","4844","4848","","","","","","","","","","","","","","","","","","","","","","has coordinates","141903","2020-10-21","18:00:00",""
"1521693","10.08029","","5.87311","","14.86206","","90","","103.617","","90","","855.141","","","","","","","","","","","","","4","A 1 2/a 1","-A 2ya","15","","K3 D (Se O4)2","","- D K3 O8 Se2 -","- D K3 O8 Se2 -","- D4 K12 O32 Se8 -","4","0.5","","Onoda-Yamamuro, N.; Yamamuro, O.; Matsuo, T.; Ichikawa, M.; Ibberson, R.M.; David, W.I.F.","Neutron diffraction study on hydrogen bond structure in K3 H (Se O4)2 and K3 D (Se O4)2 crystals","Journal of Physics: Condensed Matter","2000","12","","8559","8565","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521699","3.851","","3.851","","6.664","","90","","90","","120","","85.588","","","","","","","","","","","","","3","P -3 m 1","-P 3 2""","164","","","","- Gd2 O2 S -","- Gd2 O2 S -","- Gd2 O2 S -","1","0.0833333","","Onoda, M.; Chen, X.-A.; Sato, A.; Wada, H.","Crystal structure of Cu2 Gd2/3 S2: interlayer short-range order of Gd vacancies","Journal of Solid State Chemistry","2000","152","","332","339","10.1006/jssc.2000.8652","","","","","","","","","","","","","","","","","","","","warnings","has coordinates","249449","2020-10-21","18:00:00",""
"1521700","5.554","","5.551","","25.144","","90","","90","","90","","775.196","","","","","","","","","","","","","4","A 21 a m","A -2 2a","36","","Sr0.85 Bi2.1 Ta2 O9","","- Bi2.1 O9 Sr0.85 Ta2 -","- Bi2.1 O9 Sr0.85 Ta2 -","- Bi8.4 O36 Sr3.4 Ta8 -","4","0.5","","Onodera, A.; Kubo, T.; Yoshio, K.; Kojima, S.; Yamashita, H.; Takama, T.","Crystal structure of high-temperature paraelectric phase in bi-layered perovskite Sr0.85 Bi2.1 Ta2 O9","Japanese Journal of Applied Physics, Part 1","2000","39","","5711","5715","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521701","3.927","","3.927","","25.142","","90","","90","","90","","387.723","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Sr0.85 Bi2.1 Ta2 O9","","- Bi2.1 O9 Sr0.85 Ta2 -","- Bi2.1 O9 Sr0.85 Ta2 -","- Bi4.2 O18 Sr1.7 Ta4 -","2","0.0625","","Onodera, A.; Kubo, T.; Yoshio, K.; Kojima, S.; Yamashita, H.; Takama, T.","Crystal structure of high-temperature paraelectric phase in bi-layered perovskite Sr0.85 Bi2.1 Ta2 O9","Japanese Journal of Applied Physics, Part 1","2000","39","","5711","5715","","","","","","","","","","","","","","","","","","","","","","has coordinates","141915","2020-10-21","18:00:00",""
"1521710","4.15303","","4.15303","","16.55969","","90","","90","","90","","285.616","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Na2 Ti2 Sb2 O","","- Na2 O Sb2 Ti2 -","- Na2 O Sb2 Ti2 -","- Na4 O2 Sb4 Ti4 -","2","0.0625","","Ozawa, T.C.; Kauzlarich, S.M.; Pantoja, R.; Richardson, J.W.jr.; Axtell, E.A.; Bieringer, M.; Greedan, J.E.","Powder neutron diffraction studies of Na2 Ti2 Sb2 O and its structure-property relationships","Journal of Solid State Chemistry","2000","153","","275","281","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521712","4.2174","","4.2174","","4.2174","","90","","90","","90","","75.013","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","Ba (Ce0.1 Zr0.9) O3","","- Ba Ce0.1 O3 Zr0.9 -","- Ba Ce0.1 O3 Zr0.9 -","- Ba Ce0.1 O3 Zr0.9 -","1","0.0208333","","Pagnier, T.; Lucazeau, G.; Ritter, C.; Charrier-Cougoulic, I.","A neutron diffraction study of Ba Cex Zr1-x O3","The European Physical Journal Apllied Physics","2000","9","","1","9","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521713","6.0605","","6.0605","","14.798","","90","","90","","120","","470.707","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","Ba ((Ce0.4 Zr0.6) O3)","","- Ba Ce0.4 O3 Zr0.6 -","- Ba Ce0.4 O3 Zr0.6 -","- Ba6 Ce2.4 O18 Zr3.6 -","6","0.166667","","Pagnier, T.; Charrier-Cougoulic, I.; Ritter, C.; Lucazeau, G.","A neutron diffraction study of Ba Cex Zr1-x O3","The European Physical Journal Apllied Physics","2000","9","","1","9","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521714","6.1536","","8.6855","","6.1831","","90","","90","","90","","330.469","","","","","","","","","","","","","4","I m m a","-I 2b 2","74","","Ba ((Ce0.8 Zr0.2) O3)","","- Ba Ce0.8 O3 Zr0.2 -","- Ba Ce0.8 O3 Zr0.2 -","- Ba4 Ce3.2 O12 Zr0.8 -","4","0.25","","Pagnier, T.; Charrier-Cougoulic, I.; Ritter, C.; Lucazeau, G.","A neutron diffraction study of Ba Cex Zr1-x O3","The European Physical Journal Apllied Physics","2000","9","","1","9","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521715","4.3033","","4.3033","","4.3033","","90","","90","","90","","79.69","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","Ba ((Ce0.4 Zr0.6) O3)","","- Ba Ce0.4 O3 Zr0.6 -","- Ba Ce0.4 O3 Zr0.6 -","- Ba Ce0.4 O3 Zr0.6 -","1","0.0208333","","Pagnier, T.; Charrier-Cougoulic, I.; Ritter, C.; Lucazeau, G.","A neutron diffraction study of Ba Cex Zr1-x O3","The European Physical Journal Apllied Physics","2000","9","","1","9","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521716","6.18","","6.18","","15.0567","","90","","90","","120","","498.009","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","Ba ((Ce0.8 Zr0.2) O3)","","- Ba Ce0.8 O3 Zr0.2 -","- Ba Ce0.8 O3 Zr0.2 -","- Ba6 Ce4.8 O18 Zr1.2 -","6","0.166667","","Pagnier, T.; Charrier-Cougoulic, I.; Ritter, C.; Lucazeau, G.","A neutron diffraction study of Ba Cex Zr1-x O3","The European Physical Journal Apllied Physics","2000","9","","1","9","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521717","4.3957","","4.3957","","4.3957","","90","","90","","90","","84.934","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","Ba ((Ce0.8 Zr0.2) O3)","","- Ba Ce0.8 O3 Zr0.2 -","- Ba Ce0.8 O3 Zr0.2 -","- Ba Ce0.8 O3 Zr0.2 -","1","0.0208333","","Pagnier, T.; Charrier-Cougoulic, I.; Ritter, C.; Lucazeau, G.","A neutron diffraction study of Ba Cex Zr1-x O3","The European Physical Journal Apllied Physics","2000","9","","1","9","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521721","8.4836","","8.4836","","8.4836","","90","","90","","90","","610.577","","","","","","","","","","","","","4","F m -3 m","-F 4 2 3","225","","Ba2 Bi0.667 Te O6","","- Ba2 Bi0.667 O6 Te -","- Ba2 Bi0.667 O6 Te -","- Ba8 Bi2.668 O24 Te4 -","4","0.0208333","","Park, J.-H.; Woodward, P.M.","Synthesis, structure and optical properties of two new perovskites: Ba2 Bi2/3 Te O6 and Ba3 Bi2 Te O9","International Journal of Inorganic Materials","2000","2","","153","166","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521722","6.18313","","6.18313","","14.8645","","90","","90","","120","","492.15","","","","","","","","","","","","","4","P -3 c 1","-P 3 2""c","165","","Ba3 (Bi2 Te O9)","","- Ba3 Bi2 O9 Te -","- Ba3 Bi2 O9 Te -","- Ba6 Bi4 O18 Te2 -","2","0.166667","","Park, J.-H.; Woodward, P.M.","Synthesis, structure and optical properties of two new perovskites:Ba2 Bi2/3 Te O6 and Ba3 Bi2 Te O9","International Journal of Inorganic Materials","2000","2","","153","166","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521723","24.999","","24.999","","24.999","","90","","90","","90","","15623.1","","","","","","","","","","","","","5","F d -3 m :2","-F 4vw 2vw 3","227","","La38 Al92 Si100 O384 (O H)22 (H2 O)61.9","","- Al92 H145.8 La38 O467.9 Si100 -","- Al92.0064 La38 O467.904 Si99.9936 -","- Al92.0064 La38 O467.904 Si99.9936 -","1","0.00520833","","Park, H.S.; Seff, K.","Crystal structures of fully La(3+)-exchanged zeolite X: an intrazeolitic La2 O3 continuum, hexagonal planar and trigonally monocapped trigonal prismatic coordination","J. Phys. Chem. B","2000","104","","2224","2236","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521724","25.059","","25.059","","25.059","","90","","90","","90","","15735.9","","","","","","","","","","","","","5","F d -3 m :2","-F 4vw 2vw 3","227","","La37.63 (H3 O)37.7 Al92 Si100 O384 (O H)58.59 (H2 O)41.31","","- Al92 H254.31 La37.63 O521.6 Si100 -","- Al92.0064 La37.64 O521.674 Si99.9936 -","- Al92.0064 La37.64 O521.674 Si99.9936 -","1","0.00520833","","Park, H.S.; Seff, K.","Crystal structures of fully La(3+)-exchanged zeolite X: an intrazeolitic La2 O3 continuum, hexagonal planar and trigonally monocapped trigonal prismatic coordination","J. Phys. Chem. B","2000","104","","2224","2236","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521726","25.154","","25.154","","25.154","","90","","90","","90","","15915.5","","","","","","","","","","","","","5","F d -3 :2","-F 2uv 2vw 3","203","","La33.1 (H3 O)16 Al92 Si100 O384 (O H)23.3 (H2 O)143.9","","- Al92 H359.1 La33.1 O567.2 Si100 -","- Al91.9968 La33.1008 O567.136 Si100.003 -","- Al91.9968 La33.1008 O567.136 Si100.003 -","1","0.0104167","","Park, H.S.; Seff, K.","Crystal structures of fully La(3+)-exchanged zeolite X: an intrazeolitic La2 O3 continuum, hexagonal planar and trigonally monocapped trigonal prismatic coordination","J. Phys. Chem. B","2000","104","","2224","2236","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521731","5.3756","","5.3756","","35.578","","90","","90","","90","","1028.1","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Bi0.415 Sr2.585 Mn O4.825","","- Bi0.415 Mn O4.825 Sr2.585 -","- Bi0.415 Mn O4.825 Sr2.585 -","- Bi3.32 Mn8 O38.6 Sr20.68 -","8","0.25","","Pelloquin, D.; Michel, C.; Maignan, A.; Hervieu, M.; Raveau, B.","Two new Sr-rich layered manganites with a 1:1 Bi-Sr ordering: 1201 Bi0.4 Sr2.6 Mn O5-d and 2201 Bi0.9 Sr3.1 Mn O6-d","Journal of Solid State Chemistry","2000","151","","210","219","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521732","5.2829","","5.2998","","23.99059","","90","","90.27","","90","","671.689","","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","Bi0.9 Sr3.1 Mn O6","","- Bi0.9 Mn O6 Sr3.1 -","- Bi0.9 Mn O6 Sr3.1 -","- Bi3.6 Mn4 O24 Sr12.4 -","4","2","","Pelloquin, D.; Maignan, A.; Hervieu, M.; Michel, C.; Raveau, B.","Two new Sr-rich layered manganites with a 1:1 Bi-Sr ordering: 1201 Bi0.4 Sr2.6 Mn O5-d and 2201 Bi0.9 Sr3.1 Mn O6-d","Journal of Solid State Chemistry","2000","151","","210","219","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521733","10.7959","","5.4012","","30.07549","","90","","90","","90","","1753.73","","","","","","","","","","","","","3","A 21 a m","A -2 2a","36","","Sr4.5 Cr2.5 O9","","- Cr2.5 O9 Sr4.5 -","- Cr2.5 O9 Sr4.5 -","- Cr20 O72 Sr36 -","8","1","","Pelloquin, D.; Wahl, A.; Michel, C.; Masset, A.C.; Raveau, B.; Maignan, A.","A novel mixed valent chromium-layered oxide with peculiar magnetic properties: Sr4.5 Cr2.5 O9","Journal of Solid State Chemistry","2000","154","","375","383","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521734","7.013","","4.271","","7.402","","90","","90","","90","","221.709","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Tb Pt Si","","- Pt Si Tb -","- Pt Si Tb -","- Pt4 Si4 Tb4 -","4","0.5","","Penc, B.; Slaski, M.; Baran, S.; Leciejewicz, J.; Hofmann, M.; Szytula, A.","Magnetic ordering in R Pt X (R = Gd, Tb, Dy; X = Si, Ge) compounds","Journal of Alloys Compd.","2000","299","","79","87","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521735","6.948","","4.251","","7.419","","90","","90","","90","","219.127","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Dy Pt Si -","- Dy Pt Si -","- Dy4 Pt4 Si4 -","4","0.5","","Penc, B.; Szytula, A.; Baran, S.; Hofmann, M.; Slaski, M.; Leciejewicz, J.","Magnetic ordering in R Pt X (R = Gd, Tb, Dy; X = Si, Ge) compounds","Journal of Alloys Compd.","2000","299","","79","87","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521736","6.978","","4.325","","7.546","","90","","90","","90","","227.737","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Tb Pt Ge","","- Ge Pt Tb -","- Ge Pt Tb -","- Ge4 Pt4 Tb4 -","4","0.5","","Penc, B.; Baran, S.; Hofmann, M.; Leciejewicz, J.; Slaski, M.; Szytula, A.","Magnetic ordering in R Pt X (R = Gd, Tb, Dy; X = Si, Ge) compounds","Journal of Alloys Compd.","2000","299","","79","87","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521737","6.998","","4.359","","7.557","","90","","90","","90","","230.521","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Dy Pt Ge","","- Dy Ge Pt -","- Dy Ge Pt -","- Dy4 Ge4 Pt4 -","4","0.5","","Penc, B.; Szytula, A.; Baran, S.; Hofmann, M.; Slaski, M.; Leciejewicz, J.","Magnetic ordering in R Pt X (R = Gd, Tb, Dy; X = Si, Ge) compounds","Journal of Alloys Compd.","2000","299","","79","87","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521739","5.3219","","5.4283","","7.5564","","90","","90","","90","","218.296","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","Sm (Ni0.97 Co0.03) O3","","- Co0.03 Ni0.97 O3 Sm -","- Co0.03 Ni0.97 O3 Sm -","- Co0.12 Ni3.88 O12 Sm4 -","4","0.5","","Perez-Cacho, J.; Blasco, J.; Sanchez, R.; Garcia, J.","Relationships between structure and physical properties in Sm Ni1-xCox O3","Journal of Solid State Chemistry","2000","150","","145","153","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521740","5.3182","","5.4195","","7.5462","","90","","90","","90","","217.496","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","Sm (Ni0.7 Co0.3) O3","","- Co0.3 Ni0.7 O3 Sm -","- Co0.3 Ni0.7 O3 Sm -","- Co1.2 Ni2.8 O12 Sm4 -","4","0.5","","Perez-Cacho, J.; Sanchez, R.; Garcia, J.; Blasco, J.","Relationships between structure and physical properties in Sm Ni1-x Cox O3","Journal of Solid State Chemistry","2000","150","","145","153","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521741","5.3099","","5.4078","","7.5335","","90","","90","","90","","216.324","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","Sm (Ni0.5 Co0.5) O3","","- Co0.5 Ni0.5 O3 Sm -","- Co0.5 Ni0.5 O3 Sm -","- Co2 Ni2 O12 Sm4 -","4","0.5","","Perez-Cacho, J.; Blasco, J.; Sanchez, R.; Garcia, J.","Relationships between structure and physical properties in Sm Ni1-xCox O3","Journal of Solid State Chemistry","2000","150","","145","153","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521742","5.3021","","5.3952","","7.5226","","90","","90","","90","","215.191","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","Sm (Ni0.3 Co0.7) O3","","- Co0.7 Ni0.3 O3 Sm -","- Co0.7 Ni0.3 O3 Sm -","- Co2.8 Ni1.2 O12 Sm4 -","4","0.5","","Perez-Cacho, J.; Blasco, J.; Sanchez, R.; Garcia, J.","Relationships between structure and physical properties in Sm Ni1-x Cox O3","Journal of Solid State Chemistry","2000","150","","145","153","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521743","5.2925","","5.3704","","7.509","","90","","90","","90","","213.427","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","Sm (Ni0.1 Co0.9) O3","","- Co0.9 Ni0.1 O3 Sm -","- Co0.9 Ni0.1 O3 Sm -","- Co3.6 Ni0.4 O12 Sm4 -","4","0.5","","Perez-Cacho, J.; Blasco, J.; Garcia, J.; Sanchez, R.","Relationships between structure and physical properties in Sm Ni1-x Cox O3","Journal of Solid State Chemistry","2000","150","","145","153","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521744","5.2831","","5.3502","","7.4962","","90","","90","","90","","211.885","","","","","","","","","","","","","3","P b n m","-P 2c 2ab","62","","Sm (Co O3)","","- Co O3 Sm -","- Co O3 Sm -","- Co4 O12 Sm4 -","4","0.5","","Perez-Cacho, J.; Sanchez, R.; Blasco, J.; Garcia, J.","Relationships between structure and physical properties in Sm Ni1-xCox O3","Journal of Solid State Chemistry","2000","150","","145","153","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521745","5.7644","","5.7644","","7.0859","","90","","90","","120","","203.908","","","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","","Pb (Sc0.48 Nb0.52) O3","","- Nb0.52 O3 Pb Sc0.48 -","- Nb0.52 O3 Pb Sc0.48 -","- Nb1.56 O9 Pb3 Sc1.44 -","3","0.166667","","Perrin, C.; Menguy, N.; Suard, E.; Muller, C.; Caranoni, C.; Stepanov, A.","Neutron diffraction study of the relaxor-ferroelectric phase transition in disordered Pb (Sc1/2 Nb1/2) O3","Journal of Physics: Condensed Matter","2000","12","","7523","7539","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521746","4.0823","","4.0823","","4.0823","","90","","90","","90","","68.032","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","Pb (Sc0.48 Nb0.52) O3","","- Nb0.52 O3 Pb Sc0.48 -","- Nb0.52 O3 Pb Sc0.48 -","- Nb0.52 O3 Pb Sc0.48 -","1","0.0208333","","Perrin, C.; Stepanov, A.; Menguy, N.; Muller, C.; Suard, E.; Caranoni, C.","Neutron diffraction study of the relaxor-ferroelectric phase transition in disordered Pb (Sc1/2 Nb1/2) O3","Journal of Physics: Condensed Matter","2000","12","","7523","7539","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521750","6.716","","7.603","","17.41","","113.96","","82.33","","94.7","","804.735","","","","","","","","","","","","","3","P -1","-P 1","2","","Mn7 Si7 O21","","- Mn7 O21 Si7 -","- Mn7 O21 Si7 -","- Mn14 O42 Si14 -","2","1","","Pertlik, F.","Pyroxymangit aus Duernstein in der Steiermark: eine Strukturverfeinerung mit kristallchemischen Ueberlegungen ueber dieBesetzungen der ""nichttetraedrisch"" koordinierten Kationpositionen","Joannea - Mineral.","2000","1","","31","43","","","","","","","","","","","","","","","","","","","","","","has coordinates","141964","2020-10-21","18:00:00",""
"1521765","5.4303","","11.924","","11.747","","112.927","","94.75","","103.175","","669.497","","","","","","","","","","","","","10","P -1","-P 1","2","","(K1.78 Rb0.13) Na0.9 (Na0.18 Mn5.98 Zn0.84) (Nb1.8 Ti0.2) (Si8 O26) (O H)4 O","","- H4 K1.78 Mn5.98 Na1.08 Nb1.8 O31 Rb0.13 Si8 Ti0.2 Zn0.84 -","- K1.78 Mn5.98 Na1.08 Nb1.8 O31 Rb0.13 Si8 Ti0.2 Zn0.84 -","- K1.78 Mn5.98 Na1.08 Nb1.8 O31 Rb0.13 Si8 Ti0.2 Zn0.84 -","1","0.5","","Piilonen, P.C.; Lalonde, A.E.; McDonald, A.M.; Gault, R.A.","Niobokupletskite, a new astrophyllite-group mineral from Mont Saint-Hilaire, Quebec, Canada : description and crystal structure","Canadian Mineralogist","2000","38","","627","639","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521767","8.48026","","8.48026","","4.76708","","90","","90","","90","","342.824","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Y Fe8.74 V1.41 C0.3","","- C0.3 Fe8.74 V1.41 Y -","- C0.3 Fe8.736 V1.408 Y -","- C0.6 Fe17.472 V2.816 Y2 -","2","0.0625","","Plugaru, N.; Morariu, M.; Galatanu, A.; Lazar, D.P.; Wiesinger, G.; Kottar, A.; Vasile, E.","Structural and magnetic investigation of nonstoichiometric Y Fe10 V2 and its interstitial carbide prepared by arc-melting","Journal of Alloys Compd.","2000","299","","45","54","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521772","5.1378","","5.1378","","13.4987","","90","","90","","120","","308.587","","","","","","","","","","","","","3","R 3 c :H","R 3 -2""c","161","","Li (Nb O3)","","- Li Nb O3 -","- Li Nb O3 -","- Li6 Nb6 O18 -","6","0.333333","","Postnikov, A.V.; Caciuc, V.; Borstel, G.","Structure optimization and frozen phonons in Li Nb O3","Journal of Physics and Chemistry of Solids","2000","61","","295","299","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521776","10.4434","","10.4434","","3.37932","","90","","90","","120","","319.186","","","","","","","","","","","","","4","P -6 2 m","P -6 -2","189","","Sr3.75 K1.75 Bi3 O12","","- Bi3 K1.75 O12 Sr3.75 -","- Bi3 K1.75 O12 Sr3.75 -","- Bi3 K1.75 O12 Sr3.75 -","1","0.0833333","","Pshirkov, J.S.; Kazakov, S.M.; Bougerol-Chaillout, C.; Putilin, S.N.; Abakumov, A.M.; Antipov, E.V.; Lebedev, O.I.; van Tendeloo, G.","Synthesis and characterization of new phases: Sr3.75 K1.75 Bi3 O12 and Sr3.1 Na2.9 Bi3 O12","Journal of Solid State Chemistry","2000","152","","492","502","","","","","","","","","","","","","","","","","","","","","","has coordinates","141990","2020-10-21","18:00:00",""
"1521777","10.1102","","10.1102","","3.3389","","90","","90","","120","","295.565","","","","","","","","","","","","","4","P -6 2 m","P -6 -2","189","","Sr3.1 Na2.9 Bi3 O12","","- Bi3 Na2.9 O12 Sr3.1 -","- Bi3 Na2.9 O12 Sr3.1 -","- Bi3 Na2.9 O12 Sr3.1 -","1","0.0833333","","Pshirkov, J.S.; Lebedev, O.I.; Abakumov, A.M.; Putilin, S.N.; Kazakov, S.M.; Antipov, E.V.; Bougerol-Chaillout, C.; van Tendeloo, G.","Synthesis and characterization of new phases: Sr3.75 K1.75 Bi3 O12 and Sr3.1 Na2.9 Bi3 O12","Journal of Solid State Chemistry","2000","152","","492","502","","","","","","","","","","","","","","","","","","","","","","has coordinates","141991","2020-10-21","18:00:00",""
"1521778","6.785","","6.831","","10.629","","100.07","","91.98","","119.46","","418.134","","","","","","","","","","","","","4","P -1","-P 1","2","","Ba (B5 O8 (O H)) (H2 O)","","- B5 Ba H3 O10 -","- B5 Ba O10 -","- B10 Ba2 O20 -","2","1","","Pushcharovskii, D.Yu.; Ferro, O.; Merlino, S.; Dimitrova, O.V.; Vinogradova, S.A.","The crystal structures of two new Ba borates: pentaborate hydrate, Ba (B5 O8 (O H)) . (H2 O), and decaborate, Li Ba2 (B10 O16 (O H)3)","Journal of Alloys Compd.","2000","306","","163","169","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521779","6.732","","11.369","","11.581","","119.31","","90.11","","73.08","","728.868","","","","","","","","","","","","","5","P -1","-P 1","2","","Li Ba2 (B10 O16 (O H)3)","","- B10 Ba2 H3 Li O19 -","- B10 Ba2 Li O19 -","- B20 Ba4 Li2 O38 -","2","1","","Pushcharovskii, D.Yu.; Vinogradova, S.A.; Merlino, S.; Ferro, O.; Dimitrova, O.V.","The crystal structures of two new Ba borates: pentaborate hydrate, Ba (B5 O8 (O H)) . (H2 O), and decaborate, Li Ba2 (B10 O16 (O H)3)","Journal of Alloys Compd.","2000","306","","163","169","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521789","3.985","","3.985","","8.595","","90","","90","","90","","136.491","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","Pr Fe As O","","- As Fe O Pr -","- As Fe O Pr -","- As2 Fe2 O2 Pr2 -","2","0.125","","Quebe, P.; Terbuechte, L.J.; Jeitschko, W.","Quaternary rare earth transition metal arsenide oxides R T As O (T = Fe, Ru, Co) with Zr Cu Si As type structure","Journal of Alloys Compd.","2000","302","","70","74","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521791","5.531","","5.531","","13.363","","90","","90","","120","","354.032","","","","","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","La (Mn O3)","","- La Mn O3 -","- La Mn O3 -","- La6 Mn6 O18 -","6","0.166667","","Quo, Y.-Q.; Zhang, X.-H.; Waeppling, R.","Crystal structure of La1-x Srx Mn O3-2x+d F2x","Journal of Alloys Compd.","2000","306","","133","140","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521793","5.527","","5.527","","13.355","","90","","90","","120","","353.308","","","","","","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","(La0.717 Sr0.167) (Mn (O2.583 F0.333))","","- F0.333 La0.717 Mn O2.583 Sr0.167 -","- F0.333 La0.72 Mn O2.583 Sr0.17 -","- F1.998 La4.32 Mn6 O15.498 Sr1.02 -","6","0.166667","","Quo, Y.-Q.; Zhang, X.-H.; Waeppling, R.","Crystal structure of La1-x Srx Mn O3-2x+d F2x","Journal of Alloys Compd.","2000","306","","133","140","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521795","5.511","","5.511","","13.356","","90","","90","","120","","351.292","","","","","","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","(La0.667 Sr0.317) (Mn (O2.333 F0.633))","","- F0.633 La0.667 Mn O2.333 Sr0.317 -","- F0.633 La0.667 Mn O2.334 Sr0.32 -","- F3.798 La4.002 Mn6 O14.004 Sr1.92 -","6","0.166667","","Quo, Y.-Q.; Zhang, X.-H.; Waeppling, R.","Crystal structure of La1-x Srx Mn O3-2x+d F2x","Journal of Alloys Compd.","2000","306","","133","140","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521797","5.496","","5.496","","13.359","","90","","90","","120","","349.46","","","","","","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","(La0.633 Sr0.35) (Mn (O1.967 F0.967))","","- F0.967 La0.633 Mn O1.967 Sr0.35 -","- F0.966 La0.633 Mn O1.968 Sr0.35 -","- F5.796 La3.798 Mn6 O11.808 Sr2.1 -","6","0.166667","","Quo, Y.-Q.; Zhang, X.-H.; Waeppling, R.","Crystal structure of La1-x Srx Mn O3-2x+d F2x","Journal of Alloys Compd.","2000","306","","133","140","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521799","5.51","","5.461","","7.74","","90","","90","","90","","232.897","","","","","","","","","","","","","5","P b n m","-P 2c 2ab","62","","(La0.325 Sr0.65) (Mn O (O1.375 F0.575))","","- F0.575 La0.325 Mn O2.375 Sr0.65 -","- F0.574 La0.325 Mn O2.38 Sr0.65 -","- F2.296 La1.3 Mn4 O9.52 Sr2.6 -","4","0.5","","Quo, Y.-Q.; Zhang, X.-H.; Waeppling, R.","Crystal structure of La1-x Srx Mn O3-2x+d F2x","Journal of Alloys Compd.","2000","306","","133","140","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521801","5.514","","5.46","","7.723","","90","","90","","90","","232.512","","","","","","","","","","","","","5","P b n m","-P 2c 2ab","62","","(La0.275 Sr0.65) (Mn O (O1.325 F0.625))","","- F0.625 La0.275 Mn O2.325 Sr0.65 -","- F0.62 La0.28 Mn O2.324 Sr0.65 -","- F2.48 La1.12 Mn4 O9.296 Sr2.6 -","4","0.5","","Quo, Y.-Q.; Zhang, X.-H.; Waeppling, R.","Crystal structure of La1-x Srx Mn O3-2x+d F2x","Journal of Alloys Compd.","2000","306","","133","140","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521803","5.506","","5.457","","7.711","","90","","90","","90","","231.687","","","","","","","","","","","","","5","P b n m","-P 2c 2ab","62","","(La0.275 Sr0.7) (Mn O (O1.175 F0.775))","","- F0.775 La0.275 Mn O2.175 Sr0.7 -","- F0.774 La0.275 Mn O2.18 Sr0.7 -","- F3.096 La1.1 Mn4 O8.72 Sr2.8 -","4","0.5","","Quo, Y.-Q.; Zhang, X.-H.; Waeppling, R.","Crystal structure of La1-x Srx Mn O3-2x+d F2x","Journal of Alloys Compd.","2000","306","","133","140","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521805","5.4411","","7.9142","","12.2313","","90","","90","","90","","526.704","","","","","","","","","","","","","4","P m c n","-P 2n 2a","62","","Bi Mg2 (V O6)","","- Bi Mg2 O6 V -","- Bi Mg2 O6 V -","- Bi4 Mg8 O24 V4 -","4","0.5","","Radosavljevic, I.; Sleight, A.W.","Variable temperature X-ray diffraction study of bismuth magnesium vanadate, Bi Mg2 V O6","Journal of Solid State Chemistry","2000","149","","143","148","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521808","9.659","","9.659","","7.182","","90","","90","","120","","580.284","","","","","","","","","","","","","10","P -3","-P 3","147","","(Sr0.85 Ce0.06 Na0.05 Ba0.02 Nd0.02)6 (Na0.84 Nd0.12)2 (Ce0.38 La0.31 Sr0.22 Ba0.09)2 (P O4)6 F2 Cl0.021","","- Ba0.3 Ce1.12 Cl0.021 F2 La0.62 Na1.98 Nd0.36 O24 P6 Sr5.54 -","- Ba0.3 Ce1.12 Cl0.021 F2 La0.62 Na1.98 Nd0.36 O24 P6 Sr5.54 -","- Ba0.3 Ce1.12 Cl0.021 F2 La0.62 Na1.98 Nd0.36 O24 P6 Sr5.54 -","1","0.166667","","Rakovan, J.F.; Hughes, J.M.","Strontium in the apatite structure: strontian fluorapatite and belovite-(Ce)","Canadian Mineralogist","2000","38","","839","845","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521809","3.872","","3.872","","12.727","","90","","90","","90","","190.808","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Sr2 (Ru0.9 Ir0.1) O4","","- Ir0.1 O4 Ru0.9 Sr2 -","- Ir0.1 O4 Ru0.9 Sr2 -","- Ir0.2 O8 Ru1.8 Sr4 -","2","0.0625","","Rama Rao, M.V.; Panigrahi, B.; Sathe, V.G.; Shripathi, T.; Sornadurai, D.","Metal to insulator transition in Sr2 Ru1-x Irx O4","Journal of Physics and Chemistry of Solids","2000","61","","1989","1999","","","","","","","","","","","","","","","","","","","","","","has coordinates","142025","2020-10-21","18:00:00",""
"1521810","3.878","","3.878","","12.796","","90","","90","","90","","192.438","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Sr2 (Ru0.6 Ir0.4) O4","","- Ir0.4 O4 Ru0.6 Sr2 -","- Ir0.4 O4 Ru0.6 Sr2 -","- Ir0.8 O8 Ru1.2 Sr4 -","2","0.0625","","Rama Rao, M.V.; Shripathi, T.; Sathe, V.G.; Sornadurai, D.; Panigrahi, B.","Metal to insulator transition in Sr2 Ru1-x Irx O4","Journal of Physics and Chemistry of Solids","2000","61","","1989","1999","","","","","","","","","","","","","","","","","","","","","","has coordinates","142026","2020-10-21","18:00:00",""
"1521811","5.489","","5.489","","25.67","","90","","90","","90","","773.415","","","","","","","","","","","","","4","I 41/a c d :2","-I 4bd 2c","142","","Sr2 (Ru0.4 Ir0.6) O4","","- Ir0.6 O4 Ru0.4 Sr2 -","- Ir0.6 O4 Ru0.4 Sr2 -","- Ir4.8 O32 Ru3.2 Sr16 -","8","0.25","","Rama Rao, M.V.; Sathe, V.G.; Shripathi, T.; Sornadurai, D.; Panigrahi, B.","Metal to insulator transition in Sr2 Ru1-x Irx O4","Journal of Physics and Chemistry of Solids","2000","61","","1989","1999","","","","","","","","","","","","","","","","","","","","","","has coordinates","142027","2020-10-21","18:00:00",""
"1521812","5.493","","5.493","","25.77699","","90","","90","","90","","777.77","","","","","","","","","","","","","3","I 41/a c d :2","-I 4bd 2c","142","","Sr2 (Ir O4)","","- Ir O4 Sr2 -","- Ir O4 Sr2 -","- Ir8 O32 Sr16 -","8","0.25","","Rama Rao, M.V.; Sathe, V.G.; Sornadurai, D.; Panigrahi, B.; Shripathi, T.","Metal to insulator transition in Sr2 Ru1-x Irx O4","Journal of Physics and Chemistry of Solids","2000","61","","1989","1999","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521822","14.69","","7.535","","6.372","","90.07","","85.9","","97.1","","698.091","","","","","","","","","","","","","4","P 1","P 1","1","","(U O2) ((Mo O4) (H2 O)) (H2 O)1.45","","- H4.9 Mo O8.45 U -","- Mo O8.45 U -","- Mo4 O33.8 U4 -","4","4","","Rastsvetaeva, R.K.; Barinova, A.V.; Sidorenko, G.A.; Pushcharovskii, D.Yu.","Crystal structure of triclinic umohoite (U Mo O6 (H2 O)) . (H2 O)","Doklady Akad. Nauk","2000","373","","202","205","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521826","5.3607","","9.2874","","10.2664","","90","","100.3","","90","","502.896","","","","","","","","","","","","","6","C 1 2/m 1","-C 2y","12","","K0.928 (Fe2.352 Al0.748) (Al1.68 Si2.32) O10 (O H)2","","- Al2.428 Fe2.352 H2 K0.928 O12 Si2.32 -","- Al2.428 Fe2.352 K0.928 O12 Si2.32 -","- Al4.856 Fe4.704 K1.856 O24 Si4.64 -","2","0.25","","Redhammer, G.J.; Beran, A.; Schneider, J.; Lottermoser, W.; Amthauer, G.","Spectroscopic and structural properties of synthetic micas on the annite-siderophyllite binary: synthesis, crystal structure refinement, Mossbauer, and infrared spectroscopy","American Mineralogist","2000","85","","449","465","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521827","5.377","","9.308","","10.283","","90","","100.22","","90","","506.489","","","","","","","","","","","","","9","C 1 2/m 1","-C 2y","12","","K (Fe2.38 Al0.27 Mg0.11 Mn0.03 Ti0.04) (Si2.55 Al1.45) O10 (O H)1.88","","- Al1.72 Fe2.38 H1.88 K Mg0.11 Mn0.03 O11.88 Si2.55 Ti0.04 -","- Al1.72 Fe2.379 K Mg0.111 Mn0.03 O11.88 Si2.55 Ti0.039 -","- Al3.44 Fe4.758 K2 Mg0.222 Mn0.06 O23.76 Si5.1 Ti0.078 -","2","0.25","","Redhammer, G.J.; Lottermoser, W.; Schneider, J.; Beran, A.; Amthauer, G.","Spectroscopic and structural properties of synthetic micas on the annite-siderophyllite binary: synthesis, crystal structure refinement, Mossbauer, and infrared spectroscopy","American Mineralogist","2000","85","","449","465","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521832","7.21","","7.21","","26.8189","","90","","90","","120","","1207.38","","","","","","","","","","","","","6","R -3 :H","-R 3","148","","Cs (Co (N D3)6) (Cl O4)2 Cl2","","- Cl4 Co Cs D18 N6 O8 -","- Cl4 Co Cs D18 N6 O8 -","- Cl12 Co3 Cs3 D54 N18 O24 -","3","0.166667","","Reynolds, P.A.; Henning, R.W.; Schultz, A.J.","Orientational disordering in Cs Co (N D3)6 (Cl O4)2 Cl2 crystals studied by single crystal neutron diffraction between 20 and 290 K","Journal of Solid State Chemistry","2000","149","","60","67","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521835","3.5959","","10.9734","","9.5961","","90","","90","","90","","378.655","","","","","","","","","","","","","3","C m c m","-C 2c 2","63","","Zr3 Co D6.88","","- Co D6.88 Zr3 -","- Co D6.88 Zr3 -","- Co4 D27.52 Zr12 -","4","0.25","","Riabov, A.B.; Yartys', V.A.; Fjellvag, H.; Sorby, M.H.; Hauback, B.C.","Neutron diffraction studies of Zr-containing intermetallic hydrides with ordered hydrogen sublattice. V. Orthorhombic Zr3 Co D6.9 with filled (Re3 B)-type structure","Journal of Alloys Compd.","2000","296","","312","316","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521836","6.9091","","6.9091","","5.6305","","90","","90","","90","","268.776","","","","","","","","","","","","","3","P 4/n c c :2","-P 4a 2ac","130","","Zr2 Co D5","","- Co D5 Zr2 -","- Co D5 Zr2 -","- Co4 D20 Zr8 -","4","0.25","","Riabov, A.B.; Yartys', V.A.; Sorby, M.H.; Hauback, B.C.; Fjellvag, H.","Neutron diffraction studies of Zr-containing intermetallic hydrides with ordered hydrogen sublattice. V. Orthorhombic Zr3 Co D6.9 with filled (Re3 B)-type structure","Journal of Alloys Compd.","2000","296","","312","316","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521837","3.506","","3.506","","4.455","","90","","90","","90","","54.761","","","","","","","","","","","","","2","I 4/m m m","-I 4 2","139","","Zr D2","","- D2 Zr -","- D2 Zr -","- D4 Zr2 -","2","0.0625","","Riabov, A.B.; Sorby, M.H.; Yartys', V.A.; Fjellvag, H.; Hauback, B.C.","Neutron diffraction studies of Zr-containing intermetallic hydrides with ordered hydrogen sublattice. V. Orthorhombic Zr3 Co D6.9 with filled (Re3 B)-type structure","Journal of Alloys Compd.","2000","296","","312","316","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521843","8.0121","","8.0121","","8.0121","","90","","90","","90","","514.327","","","","","","","","","","","","","4","F m -3 m","-F 4 2 3","225","","","","- Ba2 Fe0.92 Mo0.93 O5.69 -","- Ba2 Fe0.92 Mo0.93 O5.6898 -","- Ba8 Fe3.68 Mo3.72 O22.7592 -","4","0.0208333","","Ritter, C.; Ibarra, M.R.; Morellon, L.; Blasco, J.; Garcia, J.; de Teresa, J.M.","Structural and magnetic properties of double perovskites A A' Fe Mo O6 (AA' = Ba2, BaSr, Sr2, Ca)","Journal of Physics: Condensed Matter","2000","12","","8295","8308","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521844","7.9272","","7.9272","","7.9272","","90","","90","","90","","498.149","","","","","","","","","","","","","5","F m -3 m","-F 4 2 3","225","","Ba Sr Fe0.95 Mo0.97 O5.84","","- Ba Fe0.95 Mo0.97 O5.84 Sr -","- Ba Fe0.95 Mo0.97 O5.838 Sr -","- Ba4 Fe3.8 Mo3.88 O23.352 Sr4 -","4","0.0208333","","Ritter, C.; de Teresa, J.M.; Morellon, L.; Ibarra, M.R.; Blasco, J.; Garcia, J.","Structural and magnetic properties of double perovskites A A' Fe Mo O6 (AA' = Ba2, BaSr, Sr2, Ca)","Journal of Physics: Condensed Matter","2000","12","","8295","8308","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521845","5.4277","","5.5221","","7.7248","","90","","90.015","","90","","231.53","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Ca2 (Fe0.94 Mo0.06) Mo O6.00","","- Ca2 Fe0.94 Mo1.06 O6 -","- Ca2 Fe0.94 Mo1.06 O6 -","- Ca4 Fe1.88 Mo2.12 O12 -","2","0.5","","Ritter, C.; Ibarra, M.R.; Morellon, L.; Blasco, J.; Garcia, J.; de Teresa, J.M.","Structural and magnetic properties of double perovskites A A' Fe Mo O6 (AA' = Ba2, BaSr, Sr2, Ca)","Journal of Physics: Condensed Matter","2000","12","","8295","8308","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521846","5.5741","","5.5741","","7.9243","","90","","90","","90","","246.213","","","","","","","","","","","","","4","P 42/m","-P 4c","84","","Sr2 Fe0.97 Mo0.94 O5.81","","- Fe0.97 Mo0.94 O5.81 Sr2 -","- Fe0.97 Mo0.94 O5.808 Sr2 -","- Fe1.94 Mo1.88 O11.616 Sr4 -","2","0.25","","Ritter, C.; Ibarra, M.R.; Garcia, J.; Morellon, L.; Blasco, J.; de Teresa, J.M.","Structural and magnetic properties of double perovskites A A' Fe Mo O6 (AA' = Ba2, BaSr, Sr2, Ca)","Journal of Physics: Condensed Matter","2000","12","","8295","8308","","","","","","","","","","","","","","","","","","","","","","has coordinates","142062","2020-10-21","18:00:00",""
"1521847","7.91904","","7.91904","","7.91904","","90","","90","","90","","496.612","","","","","","","","","","","","","4","F m -3 m","-F 4 2 3","225","","Sr2 Fe0.97 Mo0.94 O5.81","","- Fe0.97 Mo0.94 O5.81 Sr2 -","- Fe0.97 Mo0.94 O5.808 Sr2 -","- Fe3.88 Mo3.76 O23.232 Sr8 -","4","0.0208333","","Ritter, C.; de Teresa, J.M.; Ibarra, M.R.; Morellon, L.; Garcia, J.; Blasco, J.","Structural and magnetic properties of double perovskites A A' Fe Mo O6 (AA' = Ba2, BaSr, Sr2, Ca)","Journal of Physics: Condensed Matter","2000","12","","8295","8308","","","","","","","","","","","","","","","","","","","","","","has coordinates","142063","2020-10-21","18:00:00",""
"1521853","5.465","","7.694","","5.412","","90","","90","","90","","227.562","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Na Mg D3","","- D3 Mg Na -","- D3 Mg Na -","- D12 Mg4 Na4 -","4","0.5","","Roennebro, E.; Noreus, D.; Kadir, K.; Reiser, A.; Bogdanovic, B.","Investigation of the perovskite related structures of Na Mg H3, Na Mg F3 and Na3 Al H6","Journal of Alloys Compd.","2000","299","","101","106","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521854","5.4897","","7.6682","","5.3617","","90","","90","","90","","225.707","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Na Mg F3","","- F3 Mg Na -","- F3 Mg Na -","- F12 Mg4 Na4 -","4","0.5","","Roennebro, E.; Noreus, D.; Kadir, K.; Reiser, A.; Bogdanovic, B.","Investigation of the perovskite related structures of Na Mg H3, Na Mg F3 and Na3 Al H6","Journal of Alloys Compd.","2000","299","","101","106","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521855","5.39","","5.514","","7.725","","90","","89.86","","90","","229.59","","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Na3 Al D6","","- Al D6 Na3 -","- Al D6 Na3 -","- Al2 D12 Na6 -","2","0.5","","Roennebro, E.; Noreus, D.; Bogdanovic, B.; Reiser, A.; Kadir, K.","Investigation of the perovskite related structures of Na Mg H3, Na Mg F3 and Na3 Al H6","Journal of Alloys Compd.","2000","299","","101","106","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521856","3.405","","13.765","","3.631","","90","","90","","90","","170.184","","","","","","","","","","","","","3","C m m m","-C 2 2","65","","Y2 B3 C2","","- C2 B3 Y2 -","- C2 B3 Y2 -","- C4 B6 Y4 -","2","0.125","","Rogl, P.; Bouree, F.","A novel boroncarbide, Y2 B3 C2. X ray single crystal and neutron powder diffraction analysis","Journal of Alloys Compd.","2000","298","","160","163","","","","","","","","","","","","","","","","","","","","","","has coordinates","142072","2020-10-21","18:00:00",""
"1521860","5.881","","8.127","","6.259","","90","","96.35","","90","","297.313","","","","","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","K2 (Mn F5) (H2 O)","","- F5 H2 K2 Mn O -","- F5 H2 K2 Mn O -","- F10 H4 K4 Mn2 O2 -","2","0.5","","Roisnel, T.; Nunez, P.; Tressaud, A.; Molins, E.; Rodriguez-Carvajal, J.","Investigation of K2 Mn F5 . (H2 O) by neutron diffraction","Journal of Solid State Chemistry","2000","150","","104","111","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521873","7.571","","9.536","","8.362","","90","","90","","90","","603.712","","","","","","","","","","","","","3","P n a b","-P 2bc 2n","60","","(V O)2 (P2 O7)","","- O9 P2 V2 -","- O9 P2 V2 -","- O36 P8 V8 -","4","0.5","","Saito, T.; Terashima, T.; Utsumi, W.; Takano, M.; Azuma, M.; Goto, T.; Ohta, H.; Johnston, D.C.; Bordet, P.","Single crystal growth of the high pressure phase of (V O)2 P2 O7 at 3 GPa","Journal of Solid State Chemistry","2000","153","","124","131","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521874","6.918","","6.918","","10.151","","90","","90","","120","","420.727","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","K2 Zr (Si3 O9)","","- K2 O9 Si3 Zr -","- K2 O9 Si3 Zr -","- K4 O18 Si6 Zr2 -","2","0.166667","","Sakai, K.; Nakagawa, T.; Okuno, M.; Kihara, K.","A mineral wadeite in glass, occurrence and crystal structure","Journal of Mineralogical and Petrological Sciences","2000","95","","24","31","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521875","4.189","","4.189","","9.754","","90","","90","","90","","171.16","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","","","- Nd Ru2 Si2 -","- Nd Ru2 Si2 -","- Nd2 Ru4 Si4 -","2","0.0625","","Salamakha, P.S.; Sologub, O.L.; Righi, L.; Bocelli, G.","Single-crystal investigation of the compounds Nd Ru2 Si2 and Nd Rh2 (Si, Ge)2","Journal of Alloys Compd.","2000","299","","4","5","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521876","4.182","","4.182","","9.829","","90","","90","","90","","171.901","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Nd Rh2 (Si0.83 Ge0.17)2","","- Ge0.34 Nd Rh2 Si1.66 -","- Ge0.34 Nd Rh2 Si1.66 -","- Ge0.68 Nd2 Rh4 Si3.32 -","2","0.0625","","Salamakha, P.S.; Sologub, O.L.; Righi, L.; Bocelli, G.","Single-crystal investigation of the compounds Nd Ru2 Si2 and Nd Rh2 (Si, Ge)2","Journal of Alloys Compd.","2000","299","","4","5","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521877","10.747","","10.747","","5.695","","90","","90","","90","","657.761","","","","","","","","","","","","","3","P 4/m n c","-P 4 2n","128","","Sm2 Ru3 Si5","","- Ru3 Si5 Sm2 -","- Ru3 Si5 Sm2 -","- Ru12 Si20 Sm8 -","4","0.25","","Salamakha, P.S.; Sologub, O.L.; Bocelli, G.; Righi, L.","Single-crystal investigation of the compound Sm2 Ru3 Si5","Journal of Alloys Compd.","2000","299","","6","8","","","","","","","","","","","","","","","","","","","","","","has coordinates","142093","2020-10-21","18:00:00",""
"1521878","7.5351","","4.3081","","7.3653","","90","","90","","90","","239.092","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Ce Rh As","","- As Ce Rh -","- As Ce Rh -","- As4 Ce4 Rh4 -","4","0.5","","Salamakha, P.S.; Sologub, O.L.; Takabatake, T.; Suemitsu, T.","Crystal structure of ternary Ce Rh X compounds, X = As, Sb, Bi","Journal of Alloys Compd.","2000","313","","5","9","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521879","5.4401","","5.4401","","13.1446","","90","","90","","120","","336.893","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","(La0.8 Eu0.2) (Ni O3)","","- Eu0.2 La0.8 Ni O3 -","- Eu0.2 La0.8 Ni O3 -","- Eu1.2 La4.8 Ni6 O18 -","6","0.166667","","Sanchez, R.D.; Causa, M.T.; Seoane, A.; Rivas, J.; Rivadulla, F.; Blasco, J.; Perez Cacho, J.J.; Lopez-Quintela, M.A.; Garcia, J.","Metal-insulator transition and magnetic properties of La1-x Eux Ni O3 (0<x<1)","Journal of Solid State Chemistry","2000","151","","1","11","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521880","5.4257","","5.3979","","7.6405","","90","","90","","90","","223.77","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","(La0.6 Eu0.4) (Ni O3)","","- Eu0.4 La0.6 Ni O3 -","- Eu0.4 La0.6 Ni O3 -","- Eu1.6 La2.4 Ni4 O12 -","4","0.5","","Sanchez, R.D.; Lopez-Quintela, M.A.; Causa, M.T.; Seoane, A.; Rivas, J.; Rivadulla, F.; Garcia, J.; Blasco, J.; Perez Cacho, J.J.","Metal-insulator transition and magnetic properties of La1-x Eux Ni O3 (0<x<1)","Journal of Solid State Chemistry","2000","151","","1","11","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521881","5.3918","","5.4029","","7.6189","","90","","90","","90","","221.949","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","(La0.4 Eu0.6) (Ni O3)","","- Eu0.6 La0.4 Ni O3 -","- Eu0.6 La0.4 Ni O3 -","- Eu2.4 La1.6 Ni4 O12 -","4","0.5","","Sanchez, R.D.; Rivadulla, F.; Seoane, A.; Causa, M.T.; Rivas, J.; Perez Cacho, J.J.; Lopez-Quintela, M.A.; Garcia, J.; Blasco, J.","Metal-insulator transition and magnetic properties of La1-x Eux Ni O3 (0<x<1)","Journal of Solid State Chemistry","2000","151","","1","11","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521882","5.3515","","5.4264","","7.5892","","90","","90","","90","","220.386","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","(La0.2 Eu0.8) (Ni O3)","","- Eu0.8 La0.2 Ni O3 -","- Eu0.8 La0.2 Ni O3 -","- Eu3.2 La0.8 Ni4 O12 -","4","0.5","","Sanchez, R.D.; Perez Cacho, J.J.; Causa, M.T.; Seoane, A.; Rivas, J.; Blasco, J.; Rivadulla, F.; Lopez-Quintela, M.A.; Garcia, J.","Metal-insulator transition and magnetic properties of La1-x Eux Ni O3 (0<x<1)","Journal of Solid State Chemistry","2000","151","","1","11","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521885","10.06","","10.06","","10.06","","90","","90","","90","","1018.11","","","","","","","","","","","","","4","F m -3 m","-F 4 2 3","225","","(Ni (N D3)6) Cl2","","- Cl2 D18 N6 Ni -","- Cl2 D18 N6 Ni -","- Cl8 D72 N24 Ni4 -","4","0.0208333","","Schiebel, P.; Kearley, G.J.; Burger, K.; Lehmann, M.; Buettner, H.G.; Prandl, W.","(N D3)-density distribution in orientationally disordered Ni (N D3)6 Cl2 observed by means of neutron Laue diffraction","Journal of Physics: Condensed Matter","2000","12","","8567","8576","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521888","5.582","","7.845","","5.553","","90","","90","","90","","243.17","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","La (Mn0.5 Rh0.5) O3","","- La Mn0.5 O3 Rh0.5 -","- La Mn0.5 O3 Rh0.5 -","- La4 Mn2 O12 Rh2 -","4","0.5","","Schinzer, C.","A new ferromagnetic perovskite: La Mn1/2 Rh1/2 O3","Journal of Physics and Chemistry of Solids","2000","61","","1543","1551","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521894","5.3053","","5.3053","","12.662","","90","","90","","90","","356.387","","","","","","","","","","","","","3","I 41/a m d :2","-I 4bd 2","141","","Fe3.44 (P O4)1.98 O2.08","","- Fe3.44 O10 P1.98 -","- Fe3.44 O10 P1.98 -","- Fe6.88 O20 P3.96 -","2","0.0625","","Schmid-Beurmann, P.","Synthesis and phase characterization of a solid solution series between beta-(Fe2 (P O4) O) and Fe4 (P O4)3 (O H)3","Journal of Solid State Chemistry","2000","153","","237","247","","","","","","","","","","","","","","","","","","","","","","has coordinates","142110","2020-10-21","18:00:00",""
"1521895","5.2718","","5.2718","","12.7817","","90","","90","","90","","355.227","","","","","","","","","","","","","4","I 41/a m d :2","-I 4bd 2","141","","Fe3.32 (P O4)1.96 O0.92 (O H)1.24","","- Fe3.32 H1.24 O10 P1.96 -","- Fe3.32 O10 P1.96 -","- Fe6.64 O20 P3.92 -","2","0.0625","","Schmid-Beurmann, P.","Synthesis and phase characterization of a solid solution series between beta-(Fe2 (P O4) O) and Fe4 (P O4)3 (O H)3","Journal of Solid State Chemistry","2000","153","","237","247","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521896","5.2536","","5.2536","","12.8325","","90","","90","","90","","354.181","","","","","","","","","","","","","4","I 41/a m d :2","-I 4bd 2","141","","Fe3.16 (P O4)1.96 O0.71 (O H)1.45","","- Fe3.16 H1.45 O10 P1.96 -","- Fe3.16 O10 P1.96 -","- Fe6.32 O20 P3.92 -","2","0.0625","","Schmid-Beurmann, P.","Synthesis and phase characterization of a solid solution series between beta-(Fe2 (P O4) O) and Fe4 (P O4)3 (O H)3","Journal of Solid State Chemistry","2000","153","","237","247","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521897","5.2273","","5.2273","","12.891","","90","","90","","90","","352.242","","","","","","","","","","","","","4","I 41/a m d :2","-I 4bd 2","141","","Fe3.08 (P O4)2.04 O0.31 (O H)1.53","","- Fe3.08 H1.53 O10 P2.04 -","- Fe3.08 O10 P2.04 -","- Fe6.16 O20 P4.08 -","2","0.0625","","Schmid-Beurmann, P.","Synthesis and phase characterization of a solid solution series between beta-(Fe2 (P O4) O) and Fe4 (P O4)3 (O H)3","Journal of Solid State Chemistry","2000","153","","237","247","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521909","10.7341","","10.7341","","10.7341","","90","","90","","90","","1236.79","","","","","","","","","","","","","3","P m -3 n","-P 4n 2 3","223","","Sr8 Ga16 Ge30","","- Ga16 Ge30 Sr8 -","- Ga15.9994 Ge30.0006 Sr8 -","- Ga15.9994 Ge30.0006 Sr8 -","1","0.0208333","","Schujman, S. B.; Nolas, G. S.; Ulutagay, M.; Young, R. A.; Lind, C.; Slack, G. A.; Patschke, R.; Wilkinson, A. P.; Kanatzidis, M. G.; Hwu, S.-J.","Structural analysis of Sr~8~Ga~16~Ge~30~ clathrate compound","Journal of Applied Physics","2000","87","3","1529","1533","10.1063/1.372044","","","","","","","","","","","","","","","","","","","","","has coordinates","175098","2020-10-21","18:00:00",""
"1521916","12.1476","","12.1476","","7.5636","","90","","90","","90","","1116.12","","","","","","","","","","","","","7","I 4/m","-I 4","87","","(Na1.17 K0.20 Ca2.82) (Si7.1 Al4.9 O24) Cl0.19 (C O3)0.88","","- Al4.9 Ca2.82 Cl0.19 K0.2 Na1.17 O24 Si7.1 -","- Al4.9 Ca2.82 Cl0.19 K0.2 Na1.17 O24 Si7.1 -","- Al9.8 Ca5.64 Cl0.38 K0.4 Na2.34 O48 Si14.2 -","2","0.125","","Sherriff, B.L.; Jaeger, C.; Sokolova, E.V.; Schneider, J.; Jenkins, D.M.; Goetz, S.; Kabalov, Yu.K.; Kunath-Fandrei, G.","Meionite: Rietveld structure-refinement, (29)Si MAS and (27)Al SATRAS NMR spectroscopy, and comments on the marialite-meionite series","Canadian Mineralogist","2000","38","","1201","1213","","","","","","","","","","","","","","","","","","","","","","has coordinates","142133","2020-10-21","18:00:00",""
"1521917","12.1637","","12.1637","","7.5739","","90","","90","","90","","1120.6","","","","","","","","","","","","","8","I 4/m","-I 4","87","","(Na0.78 K0.01 Ca2.86) (Si6.8 Al5.2 O24) Cl0.02 (S O4)0.32 (C O3)0.66","","- Al5.2 Ca2.86 Cl0.02 K0.01 Na0.78 O24 S0.32 Si6.8 -","- Al5.2 Ca2.86 Cl0.02 K0.01 Na0.78 O24 S0.32 Si6.8 -","- Al10.4 Ca5.72 Cl0.04 K0.02 Na1.56 O48 S0.64 Si13.6 -","2","0.125","","Sherriff, B.L.; Kabalov, Yu.K.; Sokolova, E.V.; Jenkins, D.M.; Kunath-Fandrei, G.; Goetz, S.; Jaeger, C.; Schneider, J.","Meionite: Rietveld structure-refinement, (29)Si MAS and (27)Al SATRAS NMR spectroscopy, and comments on the marialite-meionite series","Canadian Mineralogist","2000","38","","1201","1213","","","","","","","","","","","","","","","","","","","","","","has coordinates","142134","2020-10-21","18:00:00",""
"1521918","12.1969","","12.1969","","7.5763","","90","","90","","90","","1127.08","","","","","","","","","","","","","8","I 4/m","-I 4","87","","(Na0.05 K0.02 Ca3.84) (Si6.1 Al5.9 O24) Cl0.02 (S O4)0.03 (C O3)0.91","","- Al5.9 Ca3.84 Cl0.02 K0.02 Na0.05 O24 S0.03 Si6.1 -","- Al5.9 Ca3.84 Cl0.02 K0.02 Na0.05 O24 S0.03 Si6.1 -","- Al11.8 Ca7.68 Cl0.04 K0.04 Na0.1 O48 S0.06 Si12.2 -","2","0.125","","Sherriff, B.L.; Sokolova, E.V.; Kabalov, Yu.K.; Jenkins, D.M.; Jaeger, C.; Goetz, S.; Kunath-Fandrei, G.; Schneider, J.","Meionite: Rietveld structure-refinement, (29)Si MAS and (27)Al SATRAS NMR spectroscopy, and comments on the marialite-meionite series","Canadian Mineralogist","2000","38","","1201","1213","","","","","","","","","","","","","","","","","","","","","","has coordinates","142135","2020-10-21","18:00:00",""
"1521919","12.2119","","12.2119","","7.5811","","90","","90","","90","","1130.57","","","","","","","","","","","","","4","I 4/m","-I 4","87","","Ca4 (Al6 Si6 O24) (C O3)","","- Al6 Ca4 O24 Si6 -","- Al6 Ca4 O24 Si6 -","- Al12 Ca8 O48 Si12 -","2","0.125","","Sherriff, B.L.; Sokolova, E.V.; Kabalov, Yu.K.; Schneider, J.; Jenkins, D.M.; Kunath-Fandrei, G.; Goetz, S.; Jaeger, C.","Meionite: Rietveld structure-refinement, (29)Si MAS and (27)Al SATRAS NMR spectroscopy, and comments on the marialite-meionite series","Canadian Mineralogist","2000","38","","1201","1213","","","","","","","","","","","","","","","","","","","","","","has coordinates","142136","2020-10-21","18:00:00",""
"1521924","3.2922","","3.2922","","17.388","","90","","90","","120","","163.212","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","","","- Cu In O2 -","- Cu In O2 -","- Cu3 In3 O6 -","3","0.0833333","","Shimode, M.; Sasaki, M.; Mukaida, K.","Synthesis of the delafossite-type Cu In O2","Journal of Solid State Chemistry","2000","151","","16","20","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521926","14.69","","8.195","","25.645","","90","","125.39","","90","","2516.82","","","","","","","","","","","","","3","P 1 c 1","P -2yc","7","","Rb3 (Bi2 I9)","","- Bi2 I9 Rb3 -","- Bi2 I9 Rb3 -","- Bi8 I36 Rb12 -","4","2","","Sidey, V.I.; Voroshilov, Yu.V.; Kun, S.V.; Peresh, E.Yu.","Crystal growth and X-ray structure determination of Rb3 Bi2 I9","Journal of Alloys Compd.","2000","296","","53","58","","","","","","","","","","","","","","","","","","","","","","has coordinates","142143","2020-10-21","18:00:00",""
"1521927","3.8526","","3.8746","","50.41049","","90","","90","","90","","752.492","","","","","","","","","","","","","5","A m m m","-A 2 2","65","","Ba4 Er2 Cu6.58 Al0.42 O14.88","","- Al0.42 Ba4 Cu6.58 Er2 O14.88 -","- Al0.416 Ba4 Cu6.584 Er2 O14.88 -","- Al0.832 Ba8 Cu13.168 Er4 O29.76 -","2","0.125","","Siegrist, T.; Waszczak, J.V.; van Dover, R.B.; Schneemeyer, L.F.","Structural effects of impurities in Ba4 Er2 Cu7 O15-d: incorporation of Au and of Al","Journal of Solid State Chemistry","2000","150","","228","232","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521932","5.75271","","5.75271","","21.04729","","90","","90","","120","","603.215","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","Ba2 La0.667 V2 O8","","- Ba2 La0.667 O8 V2 -","- Ba2 La0.6666 O8 V2 -","- Ba6 La1.9998 O24 V6 -","3","0.0833333","","Skakle, J.M.S.; Coats, A.M.; Marr, J.","The crystal structures of Ba2 R2/3 V2 O8 (R = La, Nd) and Sr2 La2/3 V2 O8; palmierite derivatives","Journal of Materials Science","2000","35","","3251","3256","","","","","","","","","","","","","","","","","","","","","","has coordinates","142149","2020-10-21","18:00:00",""
"1521933","5.6295","","5.6295","","19.9534","","90","","90","","120","","547.63","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","Sr2 La0.667 V2 O8","","- La0.667 O8 Sr2 V2 -","- La0.6666 O8 Sr2 V2 -","- La1.9998 O24 Sr6 V6 -","3","0.0833333","","Skakle, J.M.S.; Coats, A.M.; Marr, J.","The crystal structures of Ba2 R2/3 V2 O8 (R = La, Nd) and Sr2 La2/3 V2 O8; palmierite derivatives","Journal of Materials Science","2000","35","","3251","3256","","","","","","","","","","","","","","","","","","","","","","has coordinates","142150","2020-10-21","18:00:00",""
"1521934","5.6336","","5.6336","","20.08749","","90","","90","","120","","552.113","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","Ba2 Nd0.667 V2 O8","","- Ba2 Nd0.667 O8 V2 -","- Ba2 Nd0.6666 O8 V2 -","- Ba6 Nd1.9998 O24 V6 -","3","0.0833333","","Skakle, J.M.S.; Coats, A.M.; Marr, J.","The crystal structures of Ba2 R2/3 V2 O8 (R = La, Nd) and Sr2 La2/3 V2 O8; palmierite derivatives","Journal of Materials Science","2000","35","","3251","3256","","","","","","","","","","","","","","","","","","","","","","has coordinates","142151","2020-10-21","18:00:00",""
"1521946","7.783","","7.783","","11.488","","90","","90","","90","","695.887","","","","","","","","","","","","","3","I 4/m c m","-I 4 2c","140","","Tb Co9 Si4","","- Co9 Si4 Tb -","- Co9 Si4 Tb -","- Co36 Si16 Tb4 -","4","0.125","","Skolozdra, R.V.; Bodak, O.I.; Shchebra, I.D.; Melnyk, G.A.; Lobojko, V.S.; Yarovets, V.I.; Dobryanska, L.O.; Gorelenko, Yu.K.","Magnetic properties, electronic structure and X-ray spectra of R Co9 Si4 compounds (R = Y, Gd, Tb)","Journal of Alloys Compd.","2000","296","","272","275","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521947","8.1551","","8.1551","","8.1551","","90","","90","","90","","542.36","","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Zr Ti2 D3.896","","- D3.896 Ti2 Zr -","- D3.896 Ti2 Zr -","- D31.168 Ti16 Zr8 -","8","0.0416667","","Skripov, A.V.; Udovic, T.J.; Huang, Q.; Cook, J.C.; Kozhanov, V.N.","Neutron diffraction study of the location of deuterium in the deuterium-stabilized Zr Ti2 D3.83 phase","Journal of Alloys Compd.","2000","311","","234","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521951","5.211","","5.211","","29.689","","90","","90","","120","","698.182","","","","","","","","","","","","","8","P 31 1 2","P 31 2 (0 0 4)","151","","K (Al1.21 Mg0.75 Fe0.04) (Al0.19 Si3.81) O10 ((O H)1.2 F0.8)","","- Al1.4 F0.8 Fe0.04 H1.2 K Mg0.75 O11.2 Si3.81 -","- Al1.402 F0.8 Fe0.04 H1.2 K1.001 Mg0.75 O11.2 Si3.808 -","- Al4.206 F2.4 Fe0.12 H3.6 K3.003 Mg2.25 O33.6 Si11.424 -","3","0.5","","Smyth, J.R.; Jacobsen, S.D.; Domanik, K.; Swope, R.J.; Arlt, T.; Angel, R.J.; Holloway, J.R.","Crystal structures and compressibilities of synthetic 2M1 and 3T phengite micas","European Journal of Mineralogy (1,1989-)","2000","12","","955","963","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521955","12.342","","8.932","","7.985","","90","","90","","90","","880.256","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Ce5 Rh Ge2","","- Ce5 Ge2 Rh -","- Ce5 Ge2 Rh -","- Ce20 Ge8 Rh4 -","4","0.5","","Sologub, O.L.; Salamakha, P.S.; Godart, C.","Formation, crystal structure and magnetism of ternary compounds Ce5 M Ge2 (M = Co, Ni, Ru, Rh, Pd, Ir, Pt)","Journal of Alloys Compd.","2000","307","","31","39","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521956","7.861","","7.861","","13.858","","90","","90","","90","","856.36","","","","","","","","","","","","","3","I 4/m c m","-I 4 2c","140","","Ce5 (Ni0.81 Ge1.19) Ge","","- Ce5 Ge2.19 Ni0.81 -","- Ce5 Ge2.19 Ni0.81 -","- Ce20 Ge8.76 Ni3.24 -","4","0.125","","Sologub, O.L.; Salamakha, P.S.; Godart, C.","Formation, crystal structure and magnetism of ternary compounds Ce5 M Ge2 (M = Co, Ni, Ru, Rh, Pd, Ir, Pt)","Journal of Alloys Compd.","2000","307","","31","39","","","","","","","","","","","","","","","","","","","","","","has coordinates","142173","2020-10-21","18:00:00",""
"1521957","8.891","","8.891","","6.691","","90","","90","","120","","458.061","","","","","","","","","","","","","3","P 63/m c m","-P 6c 2","193","","Ce5 (Pd1.05 Ge1.95)","","- Ce5 Ge1.95 Pd1.05 -","- Ce5 Ge1.95 Pd1.05 -","- Ce10 Ge3.9 Pd2.1 -","2","0.0833333","","Sologub, O.L.; Salamakha, P.S.; Godart, C.","Formation, crystal structure and magnetism of ternary compounds Ce5 M Ge2 (M = Co, Ni, Ru, Rh, Pd, Ir, Pt)","Journal of Alloys Compd.","2000","307","","31","39","","","","","","","","","","","","","","","","","","","","","","has coordinates","142174","2020-10-21","18:00:00",""
"1521958","7.873","","7.873","","13.796","","90","","90","","90","","855.133","","","","","","","","","","","","","3","I 4/m c m","-I 4 2c","140","","Ce5 (Rh0.453 Si2.547)","","- Ce5 Rh0.453 Si2.547 -","- Ce5 Rh0.453 Si2.547 -","- Ce20 Rh1.812 Si10.188 -","4","0.125","","Sologub, O.L.; Salamakha, P.S.; Godart, C.; Bocelli, G.; Takabatake, T.","Formation and crystal structure of ternary Ce5 (M, Si)3 compounds, M = Ru, Rh","Journal of Alloys Compd.","2000","312","","172","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","142175","2020-10-21","18:00:00",""
"1521959","7.8466","","7.8466","","13.622","","90","","90","","90","","838.695","","","","","","","","","","","","","3","I 4/m c m","-I 4 2c","140","","Ce5 (Ru0.68 Si2.32)","","- Ce5 Ru0.68 Si2.32 -","- Ce5 Ru0.68 Si2.32 -","- Ce20 Ru2.72 Si9.28 -","4","0.125","","Sologub, O.L.; Salamakha, P.S.; Takabatake, T.; Godart, C.; Bocelli, G.","Formation and crystal structure of ternary Ce5 (M, Si)3 compounds, M = Ru, Rh","Journal of Alloys Compd.","2000","312","","172","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","142176","2020-10-21","18:00:00",""
"1521960","7.8592","","7.8592","","13.657","","90","","90","","90","","843.552","","","","","","","","","","","","","3","I 4/m c m","-I 4 2c","140","","Ce5 (Rh0.9 Si2.1)","","- Ce5 Rh0.9 Si2.1 -","- Ce5 Rh0.9 Si2.1 -","- Ce20 Rh3.6 Si8.4 -","4","0.125","","Sologub, O.L.; Salamakha, P.S.; Bocelli, G.; Takabatake, T.; Godart, C.","Formation and crystal structure of ternary Ce5 (M, Si)3 compounds, M = Ru, Rh","Journal of Alloys Compd.","2000","312","","172","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","142177","2020-10-21","18:00:00",""
"1521961","10.607","","3.904","","6.715","","90","","127.58","","90","","220.368","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","Yb Fe Ge","","- Fe Ge Yb -","- Fe Ge Yb -","- Fe4 Ge4 Yb4 -","4","0.5","","Sologub, O.L.; Salamakha, P.S.; Otani, S.; Bocelli, G.; Takabatake, T.","Yb Fe Ge, a new structure type of equiatomic ternary germanides","Journal of Alloys Compd.","2000","312","","196","200","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521966","7.626","","7.626","","6.515","","90","","90","","90","","378.886","","","","","","","","","","","","","3","I 4/m c m","-I 4 2c","140","","Th2 Al D3.71","","- Al D3.71 Th2 -","- Al D3.708 Th2 -","- Al4 D14.832 Th8 -","4","0.125","","Sorby, M.H.; Fjellvag, H.; Hauback, B.C.; Maeland, A.J.; Yartys', V.A.","Crystal structure of Th2 Al deuterides","Journal of Alloys Compd.","2000","309","","154","164","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521967","7.6796","","7.6796","","19.073","","90","","90","","90","","1124.85","","","","","","","","","","","","","3","P -4 2 m","P -4 2","111","","Th2 Al D2.75","","- Al D2.75 Th2 -","- Al D2.75 Th2 -","- Al12 D33 Th24 -","12","1.5","","Sorby, M.H.; Yartys', V.A.; Fjellvag, H.; Maeland, A.J.; Hauback, B.C.","Crystal structure of Th2 Al deuterides","Journal of Alloys Compd.","2000","309","","154","164","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521968","7.7014","","7.7014","","6.2816","","90","","90","","90","","372.572","","","","","","","","","","","","","3","I 4/m c m","-I 4 2c","140","","Th2 Al D2.29","","- Al D2.29 Th2 -","- Al D2.292 Th2 -","- Al4 D9.168 Th8 -","4","0.125","","Sorby, M.H.; Fjellvag, H.; Hauback, B.C.; Yartys', V.A.; Maeland, A.J.","Crystal structure of Th2 Al deuterides","Journal of Alloys Compd.","2000","309","","154","164","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521986","8.9975","","8.9975","","18.212","","90","","90","","90","","1474.35","","","","","","","","","","","","","2","P 4","P 4","75","","","","- Ce Te2 -","- Ce Te2 -","- Ce16 Te32 -","16","4","","Stoewe, K.","Crystal structure and magnetic properties of Ce Te2","Journal of Alloys Compd.","2000","307","","101","110","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521987","12.953","","12.953","","6.173","","90","","90","","90","","1035.71","","","","","","","","","","","","","2","I 4/m c m","-I 4 2c","140","","Tl Te","","- Te Tl -","- Te Tl -","- Te16 Tl16 -","16","0.5","","Stoewe, K.","The phase transition of Tl Te: crystal structure","Journal of Solid State Chemistry","2000","149","","123","132","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521988","18.229","","18.229","","6.157","","90","","90","","90","","2045.95","","","","","","","","","","","","","2","P 42/n m c :2","-P 4ac 2a","137","","Tl Te","","- Te Tl -","- Te Tl -","- Te32 Tl32 -","32","2","","Stoewe, K.","The phase transition of Tl Te: crystal structure","Journal of Solid State Chemistry","2000","149","","123","132","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521989","9.19","","9.107","","9.07","","90","","90.04","","90","","759.098","","","","","","","","","","","","","2","P 1 c 1","P -2yc","7","","","","- La Te2 -","- La Te2 -","- La8 Te16 -","8","4","","Stoewe, K.","Crystal structure and electronic band structure of La Te2","Journal of Solid State Chemistry","2000","149","","155","166","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1522000","28.19699","","28.23499","","28.16089","","90","","90","","90","","22420.1","","","","","","","","","","","","","2","P b c a","-P 2ac 2ab","61","","Sm2.75 C60","","- C60 Sm2.75 -","- C60 Sm2.75 -","- C1920 Sm88 -","32","4","","Sun, Z.; Chen, X.H.; Takenobu, T.; Iwasa, Y.","Structure and Raman behaviour of Sm2.75 C60","Journal of Physics: Condensed Matter","2000","12","","8919","8926","","","","","","","","","","","","","","","","","","","","","","has coordinates","142219","2020-10-21","18:00:00",""
"1522005","8.3903","","8.3903","","8.3903","","90","","90","","90","","590.653","","","","","","","","","","","","","4","F m -3 m","-F 4 2 3","225","","Ba2 Yb Ta O6","","- Ba2 O6 Ta Yb -","- Ba2 O6 Ta Yb -","- Ba8 O24 Ta4 Yb4 -","4","0.0208333","","Taira, N.; Hinatsu, Y.","Magnetic susceptibility of Ba2 Yb Ta O6 with the ordered perovskite structure and electron paramagnetic resonance of Yb(3+) doped in Ba2 Lu Ta O6","Journal of Solid State Chemistry","2000","150","","31","35","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522008","4.014","","4.014","","5.287","","90","","90","","90","","85.185","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Ce Cr2 Si2 C","","- C Ce Cr2 Si2 -","- C Ce Cr2 Si2 -","- C Ce Cr2 Si2 -","1","0.0625","","Tang, C.C.; Fan, S.-S.; Zhu, M.-J.","Structure and magnetic properties of Ce Cr2 Si2 C","Journal of Alloys Compd.","2000","299","","1","4","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522009","3.837","","3.837","","19.582","","90","","90","","90","","288.297","","","","","","","","","","","","","6","I 4/m m m","-I 4 2","139","","(La1.7 Sr0.3) (Ca0.7 Na0.3) Cu2 O5.86","","- Ca0.7 Cu2 La1.7 Na0.3 O5.86 Sr0.3 -","- Ca0.7 Cu2 La1.7 Na0.3 O5.86 Sr0.3 -","- Ca1.4 Cu4 La3.4 Na0.6 O11.72 Sr0.6 -","2","0.0625","","Tao, F.; Zhou, X.J.; Che Guangcan; Zhao, B.J.; Zhu, S.F.; Xu, J.H.","New La326 type compounds substituted with sodium and potassium","Journal of Alloys Compd.","2000","296","","46","52","","","","","","","","","","","","","","","","","","","","","","has coordinates","142228","2020-10-21","18:00:00",""
"1522037","3.916","","20.25","","5.586","","90","","90","","90","","442.964","","","","","","","","","","","","","4","P m c 21","P 2c -2","26","","La3 ((Ti1.92 Ta1.08) O11)","","- La3 O11 Ta1.08 Ti1.92 -","- La3 O11 Ta1.08 Ti1.92 -","- La6 O22 Ta2.16 Ti3.84 -","2","0.5","","Titov, Yu.A.; Sych, A.M.; Kapshuk, A.A.; Yashchuk, V.P.; Markiv, V.Ya.; Belyavina, N.M.","Heteroblock perovskite-like structure of La3 Ti2 Ta O11","Dopov. Nats. Akad. Nauk. Ukr.","2000","2000","","148","152","","","","","","","","","","","","","","","","","","","","","","has coordinates","142256","2020-10-21","18:00:00",""
"1522038","7.592","","5.4673","","7.7022","","90","","100.032","","90","","314.813","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Nd (Ta O4)","","- Nd O4 Ta -","- Nd O4 Ta -","- Nd4 O16 Ta4 -","4","1","","Titov, Yu.A.; Belyavina, N.M.; Sych, A.M.; Sokolov, A.N.; Markiv, V.Ya.; Kapshuk, A.A.","Crystal structure of the high-pressure modification of Nd Ta O4","Journal of Alloys Compd.","2000","311","","252","255","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522044","10.183","","9.1328","","22.905","","90","","105.207","","90","","2055.56","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- Ce5 Mo32 O54 -","- Ce5 Mo32 O54 -","- Ce10 Mo64 O108 -","2","0.5","","Tortelier, J.; Gall, P.; Noel, H.; Gougeon, P.","Synthesis, structural studies, and physical properties of the RE5 Mo32 O54 (RE = La, Ce, Pr, Nd) compounds containing trans-bicapped Mo8 octahedral clusters and Mo7 - Mo10 - Mo7 triclusters","Journal of Solid State Chemistry","2000","152","","403","411","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1522045","10.177","","9.1171","","22.88","","90","","105.186","","90","","2048.78","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Pr5 Mo32 O54","","- Mo32 O54 Pr5 -","- Mo32 O54 Pr5 -","- Mo64 O108 Pr10 -","2","0.5","","Tortelier, J.; Gall, P.; Noel, H.; Gougeon, P.","Synthesis, structural studies, and physical properties of the RE5 Mo32 O54 (RE = La, Ce, Pr, Nd) compounds containing trans-bicapped Mo8 octahedral clusters and Mo7 - Mo10 - Mo7 triclusters","Journal of Solid State Chemistry","2000","152","","403","411","","","","","","","","","","","","","","","","","","","","","","has coordinates","142264","2020-10-21","18:00:00",""
"1522046","10.16","","9.115","","22.85","","90","","105.28","","90","","2041.3","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Nd5 Mo32 O54","","- Mo32 Nd5 O54 -","- Mo32 Nd5 O54 -","- Mo64 Nd10 O108 -","2","0.5","","Tortelier, J.; Gougeon, P.; Noel, H.; Gall, P.","Synthesis, structural studies, and physical properties of the RE5 Mo32 O54 (RE = La, Ce, Pr, Nd) compounds containing trans-bicapped Mo8 octahedral clusters and Mo7 - Mo10 - Mo7 triclusters","Journal of Solid State Chemistry","2000","152","","403","411","","","","","","","","","","","","","","","","","","","","","","has coordinates","142265","2020-10-21","18:00:00",""
"1522047","7.843","","7.843","","42.26","","90","","90","","120","","2251.25","","","","","","","","","","","","","4","R -3 :H","-R 3","148","","Sr0.926 (Si0.867 Nb0.132) Nb10 O19","","- Nb10.132 O19 Si0.867 Sr0.926 -","- Nb10.132 O19 Si0.867 Sr0.926 -","- Nb60.792 O114 Si5.202 Sr5.556 -","6","0.333333","","Tortelier, J.; Emge, T.J.; Veith, G.; Greenblatt, M.","Synthesis, crystal structure, and physical properties of Sr0.93 (Six Nb1-x) Nb10 O19 (x=0.87)","Journal of Solid State Chemistry","2000","152","","540","545","","","","","","","","","","","","","","","","","","","","","","has coordinates","142266","2020-10-21","18:00:00",""
"1522048","9.3895","","9.3895","","6.895","","90","","90","","120","","526.441","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","(Ca1.57 Sm0.43 Na2) (Ca4.43 Sm1.57) (P O4)6 F2","","- Ca6 F2 Na2 O24 P6 Sm2 -","- Ca6 F2 Na2 O24 P6 Sm2 -","- Ca6 F2 Na2 O24 P6 Sm2 -","1","0.0833333","","Toumi, M.; Smiri-Dogguy, L.; Bulou, A.","Crystal structure and polarized Raman spectra of Ca6 Sm2 Na2 (P O4)6 F2","Journal of Solid State Chemistry","2000","149","","308","313","","","","","","","","","","","","","","","","","","","","","","has coordinates","142267","2020-10-21","18:00:00",""
"1522050","3.90362","","3.90362","","7.60938","","90","","90","","90","","115.954","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Nd Ba Co2 O5.76","","- Ba Co2 Nd O5.76 -","- Ba Co2 Nd O5.756 -","- Ba Co2 Nd O5.756 -","1","0.0625","","Troyanchuk, I.O.; Solovykh, T.K.; Khalyavin, D.D.; Szymczak, H.; Huang, Q.; Lynn, J.W.","Magnetic and crystal structure phase transitions in R1-x Bax Co O3-y (R = Nd, Gd)","Journal of Physics: Condensed Matter","2000","12","","2485","2493","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522058","9.026","","9.338","","9.508","","95.1","","104.1","","96.6","","766.381","","","","","","","","","","","","","4","P 1","P 1","1","","Al (P O4) (H2 O)2","","- Al H4 O6 P -","- Al O6 P -","- Al6 O36 P6 -","6","6","","Tuel, A.; Baerlocher, C.; Meden, A.; Caldarelli, S.; McCusker, L.B.; Kaucic, V.; Ristic, A.; Rajic, N.; Mali, G.","NMR characterization and Rietveld refinement of the structure of rehydrated (Al P O4)-34","J. Phys. Chem. B","2000","104","","5697","5705","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522060","8.753","","8.753","","8.753","","90","","90","","90","","670.611","","","","","","","","","","","","","3","P a -3","-P 2ac 2ab 3","205","","Hf (V2 O7)","","- Hf O7 V2 -","- Hf O7 V2 -","- Hf4 O28 V8 -","4","0.166667","","Turquat, C.; Muller, C.; Nigrelli, E.; Leroux, C.; Soubeyroux, J.L.; Nihoul, G.","Structural investigation of temperature-induced phase transitions in Hf V2 O7","The European Physical Journal Apllied Physics","2000","10","","15","27","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522061","4.20391","","4.20391","","4.20391","","90","","90","","90","","74.295","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","(Ba0.8 La0.2) In O2.6","","- Ba0.8 In La0.2 O2.6 -","- Ba0.8 In La0.2 O2.598 -","- Ba0.8 In La0.2 O2.598 -","1","0.0208333","","Uchimoto, Y.; Yao, T.; Yoshida, H.; Takagi, H.; Inagaki, T.","Crystal structure of (Ba1-x Lax)2 In2 O5+x and its oxide ion conductivity","Electrochemistry (Tokyo)","2000","68","","531","533","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522062","4.17214","","4.17214","","4.17214","","90","","90","","90","","72.623","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","(Ba0.6 La0.4) In O2.7","","- Ba0.6 In La0.4 O2.7 -","- Ba0.6 In La0.4 O2.7 -","- Ba0.6 In La0.4 O2.7 -","1","0.0208333","","Uchimoto, Y.; Inagaki, T.; Yao, T.; Takagi, H.; Yoshida, H.","Crystal structure of (Ba1-x Lax)2 In2 O5+x and its oxide ion conductivity","Electrochemistry (Tokyo)","2000","68","","531","533","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522068","3.81766","","3.81766","","28.911","","90","","90","","90","","421.364","","","","","","","","","","","","","7","I 4/m m m","-I 4 2","139","","Tl1.3 Hg0.7 Ba0.74 Sr1.35 Ca0.91 Cu2 O7.9","","- Ba0.74 Ca0.91 Cu2 Hg0.7 O7.9 Sr1.35 Tl1.3 -","- Ba0.74 Ca0.91 Cu2 Hg0.7 O7.9 Sr1.35 Tl1.3 -","- Ba1.48 Ca1.82 Cu4 Hg1.4 O15.8 Sr2.7 Tl2.6 -","2","0.0625","","Valldor, M.; Boullay, P.; Axnas, J.; Bryntse, I.","X-ray diffraction studies of 2212-type superconductors in the Tl - Hg - Ba - Sr - Ca - Cu - O system","Journal of Solid State Chemistry","2000","153","","106","117","","","","","","","","","","","","","","","","","","","","","","has coordinates","142287","2020-10-21","18:00:00",""
"1522070","3.81884","","3.81884","","28.86649","","90","","90","","90","","420.976","","","","","","","","","","","","","7","I 4/m m m","-I 4 2","139","","Tl1.3 Hg0.7 Ba0.64 Sr1.64 Ca0.72 Cu2 O8","","- Ba0.64 Ca0.72 Cu2 Hg0.7 O8 Sr1.64 Tl1.3 -","- Ba0.64 Ca0.72 Cu2 Hg0.7 O8 Sr1.64 Tl1.3 -","- Ba1.28 Ca1.44 Cu4 Hg1.4 O16 Sr3.28 Tl2.6 -","2","0.0625","","Valldor, M.; Boullay, P.; Axnas, J.; Bryntse, I.","X-ray diffraction studies of 2212-type superconductors in the Tl - Hg - Ba - Sr - Ca - Cu - O system","Journal of Solid State Chemistry","2000","153","","106","117","","","","","","","","","","","","","","","","","","","","","","has coordinates","142289","2020-10-21","18:00:00",""
"1522072","3.83149","","3.83149","","29.12253","","90","","90","","90","","427.528","","","","","","","","","","","","","7","I 4/m m m","-I 4 2","139","","Tl1.3 Hg0.7 Ba1.06 Sr1.34 Ca0.6 Cu2 O7.5","","- Ba1.06 Ca0.6 Cu2 Hg0.7 O7.5 Sr1.34 Tl1.3 -","- Ba1.06 Ca0.6 Cu2 Hg0.7 O7.5 Sr1.34 Tl1.3 -","- Ba2.12 Ca1.2 Cu4 Hg1.4 O15 Sr2.68 Tl2.6 -","2","0.0625","","Valldor, M.; Boullay, P.; Axnas, J.; Bryntse, I.","X-ray diffraction studies of 2212-type superconductors in the Tl - Hg - Ba - Sr - Ca - Cu - O system","Journal of Solid State Chemistry","2000","153","","106","117","","","","","","","","","","","","","","","","","","","","","","has coordinates","142291","2020-10-21","18:00:00",""
"1522074","3.84372","","3.84372","","29.3876","","90","","90","","90","","434.178","","","","","","","","","","","","","7","I 4/m m m","-I 4 2","139","","Tl1.3 Hg0.7 Ba1.66 Sr0.44 Ca0.90 Cu2 O7.4","","- Ba1.66 Ca0.9 Cu2 Hg0.7 O7.4 Sr0.44 Tl1.3 -","- Ba1.66 Ca0.9 Cu2 Hg0.7 O7.4 Sr0.44 Tl1.3 -","- Ba3.32 Ca1.8 Cu4 Hg1.4 O14.8 Sr0.88 Tl2.6 -","2","0.0625","","Valldor, M.; Axnas, J.; Boullay, P.; Bryntse, I.","X-ray diffraction studies of 2212-type superconductors in the Tl - Hg - Ba - Sr - Ca - Cu - O system","Journal of Solid State Chemistry","2000","153","","106","117","","","","","","","","","","","","","","","","","","","","","","has coordinates","142293","2020-10-21","18:00:00",""
"1522076","3.8486","","3.8486","","29.41789","","90","","90","","90","","435.73","","","","","","","","","","","","","7","I 4/m m m","-I 4 2","139","","Tl1.3 Hg0.7 Ba1.4 Sr1.17 Ca0.43 Cu2 O7.42","","- Ba1.4 Ca0.43 Cu2 Hg0.7 O7.42 Sr1.17 Tl1.3 -","- Ba1.4 Ca0.43 Cu2 Hg0.7 O7.42 Sr1.17 Tl1.3 -","- Ba2.8 Ca0.86 Cu4 Hg1.4 O14.84 Sr2.34 Tl2.6 -","2","0.0625","","Valldor, M.; Boullay, P.; Bryntse, I.; Axnas, J.","X-ray diffraction studies of 2212-type superconductors in the Tl - Hg - Ba - Sr - Ca - Cu - O system","Journal of Solid State Chemistry","2000","153","","106","117","","","","","","","","","","","","","","","","","","","","","","has coordinates","142295","2020-10-21","18:00:00",""
"1522078","3.86031","","3.86031","","29.60219","","90","","90","","90","","441.132","","","","","","","","","","","","","7","I 4/m m m","-I 4 2","139","","Tl1.3 Hg0.7 Ba1.5 Sr1.22 Ca0.28 Cu2 O7.54","","- Ba1.5 Ca0.28 Cu2 Hg0.7 O7.54 Sr1.22 Tl1.3 -","- Ba1.5 Ca0.28 Cu2 Hg0.7 O7.54 Sr1.22 Tl1.3 -","- Ba3 Ca0.56 Cu4 Hg1.4 O15.08 Sr2.44 Tl2.6 -","2","0.0625","","Valldor, M.; Boullay, P.; Axnas, J.; Bryntse, I.","X-ray diffraction studies of 2212-type superconductors in the Tl - Hg - Ba - Sr - Ca - Cu - O system","Journal of Solid State Chemistry","2000","153","","106","117","","","","","","","","","","","","","","","","","","","","","","has coordinates","142297","2020-10-21","18:00:00",""
"1522080","3.85299","","3.85299","","29.48779","","90","","90","","90","","437.762","","","","","","","","","","","","","7","I 4/m m m","-I 4 2","139","","Tl1.3 Hg0.7 Ba1.62 Sr0.85 Ca0.53 Cu2 O7.44","","- Ba1.62 Ca0.53 Cu2 Hg0.7 O7.44 Sr0.85 Tl1.3 -","- Ba1.62 Ca0.53 Cu2 Hg0.7 O7.44 Sr0.85 Tl1.3 -","- Ba3.24 Ca1.06 Cu4 Hg1.4 O14.88 Sr1.7 Tl2.6 -","2","0.0625","","Valldor, M.; Boullay, P.; Axnas, J.; Bryntse, I.","X-ray diffraction studies of 2212-type superconductors in the Tl - Hg - Ba - Sr - Ca - Cu - O system","Journal of Solid State Chemistry","2000","153","","106","117","","","","","","","","","","","","","","","","","","","","","","has coordinates","142299","2020-10-21","18:00:00",""
"1522082","3.84456","","3.84456","","29.32875","","90","","90","","90","","433.498","","","","","","","","","","","","","7","I 4/m m m","-I 4 2","139","","Tl1.3 Hg0.7 Ba1.4 Sr1.03 Ca0.57 Cu2 O6.94","","- Ba1.4 Ca0.57 Cu2 Hg0.7 O6.94 Sr1.03 Tl1.3 -","- Ba1.4 Ca0.57 Cu2 Hg0.7 O6.94 Sr1.03 Tl1.3 -","- Ba2.8 Ca1.14 Cu4 Hg1.4 O13.88 Sr2.06 Tl2.6 -","2","0.0625","","Valldor, M.; Axnas, J.; Boullay, P.; Bryntse, I.","X-ray diffraction studies of 2212-type superconductors in the Tl - Hg - Ba - Sr - Ca - Cu - O system","Journal of Solid State Chemistry","2000","153","","106","117","","","","","","","","","","","","","","","","","","","","","","has coordinates","142301","2020-10-21","18:00:00",""
"1522084","3.84781","","3.84781","","29.51044","","90","","90","","90","","436.921","","","","","","","","","","","","","6","I 4/m m m","-I 4 2","139","","Tl1.3 Hg0.7 Ba2 Ca Cu2 O7.8","","- Ba2 Ca Cu2 Hg0.7 O7.8 Tl1.3 -","- Ba2 Ca Cu2 Hg0.7 O7.8 Tl1.3 -","- Ba4 Ca2 Cu4 Hg1.4 O15.6 Tl2.6 -","2","0.0625","","Valldor, M.; Boullay, P.; Axnas, J.; Bryntse, I.","X-ray diffraction studies of 2212-type superconductors in the Tl - Hg - Ba - Sr - Ca - Cu - O system","Journal of Solid State Chemistry","2000","153","","106","117","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522088","3.976","","3.976","","3.976","","90","","90","","90","","62.855","","","","","","","","","","","","","5","P m -3 m","-P 4 2 3","221","","(Ba0.829 Sr0.171) (Ti0.89 Ce0.11) O3","","- Ba0.829 Ce0.11 O3 Sr0.171 Ti0.89 -","- Ba0.829 Ce0.11 O3 Sr0.171 Ti0.89 -","- Ba0.829 Ce0.11 O3 Sr0.171 Ti0.89 -","1","0.0208333","","Varatharajan, R.; Santhanaraghavan, P.; Right, L.; Bocelli, G.; Jayavel, R.; Ramasamy, P.","Ba Sr Ti Ce O3 : growth and crystal structure","Crystal Engineering","2000","3","","195","2000","","","","","","","","","","","","","","","","","","","","","","has coordinates","142307","2020-10-21","18:00:00",""
"1522090","3.985","","3.985","","3.985","","90","","90","","90","","63.283","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","(Ba0.592 Sr0.408) Ti O3","","- Ba0.592 O3 Sr0.408 Ti -","- Ba0.592 O3 Sr0.408 Ti -","- Ba0.592 O3 Sr0.408 Ti -","1","0.0208333","","Varatharajan, R.; Santhanaraghavan, P.; Jayavel, R.; Bocelli, G.; Right, L.; Ramasamy, P.","Ba Sr Ti Ce O3 : growth and crystal structure","Crystal Engineering","2000","3","","195","2000","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522092","3.99","","3.99","","3.99","","90","","90","","90","","63.521","","","","","","","","","","","","","5","P m -3 m","-P 4 2 3","221","","(Ba0.994 Sr0.006) (Ti0.937 Ce0.063) O3","","- Ba0.994 Ce0.063 O3 Sr0.006 Ti0.937 -","- Ba0.994 Ce0.063 O3 Sr0.006 Ti0.937 -","- Ba0.994 Ce0.063 O3 Sr0.006 Ti0.937 -","1","0.0208333","","Varatharajan, R.; Santhanaraghavan, P.; Jayavel, R.; Bocelli, G.; Right, L.; Ramasamy, P.","Ba Sr Ti Ce O3 : growth and crystal structure","Crystal Engineering","2000","3","","195","2000","","","","","","","","","","","","","","","","","","","","","","has coordinates","142311","2020-10-21","18:00:00",""
"1522094","5.4176","","5.4952","","7.6871","","90","","90","","90","","228.851","","","","","","","","","","","","","3","P b n m","-P 2c 2ab","62","","Nd (Ga O3)","","- Ga Nd O3 -","- Ga Nd O3 -","- Ga4 Nd4 O12 -","4","0.5","","Vasylechko, L.; Morgenroth, W.; Aksel'rud, L.G.; Matkovskii, A.; Bismayer, U.; Savytskii, D.","The crystal structure of Nd Ga O3 at 100 K and 293 K based on synchrotron data","Journal of Alloys Compd.","2000","297","","46","52","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522096","5.49169","","5.48958","","7.7596","","90","","90","","90","","233.929","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","(La0.73 Nd0.27) (Ga O3)","","- Ga La0.73 Nd0.27 O3 -","- Ga La0.73 Nd0.27 O3 -","- Ga4 La2.92 Nd1.08 O12 -","4","0.5","","Vasylechko, L.O.; Piekarczyk, W.; Berkowski, M.; Savytskii, D.; Matkovskii, A.","Structure peculiarities of the La1-x Ndx Ga O3 solid solutions","Journal of Alloys Compd.","2000","300","","471","474","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522097","5.4865","","5.48968","","7.7558","","90","","90","","90","","233.598","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","(La0.63 Nd0.37) Ga O3","","- Ga La0.63 Nd0.37 O3 -","- Ga La0.63 Nd0.37 O3 -","- Ga4 La2.52 Nd1.48 O12 -","4","0.5","","Vasylechko, L.O.; Berkowski, M.; Matkovskii, A.; Piekarczyk, W.; Savytskii, D.","Structure peculiarities of the La1-x Ndx Ga O3 solid solutions","Journal of Alloys Compd.","2000","300","","471","474","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522098","5.4764","","5.49016","","7.7491","","90","","90","","90","","232.987","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","(La0.56 Nd0.44) Ga O3","","- Ga La0.56 Nd0.44 O3 -","- Ga La0.56 Nd0.44 O3 -","- Ga4 La2.24 Nd1.76 O12 -","4","0.5","","Vasylechko, L.O.; Berkowski, M.; Matkovskii, A.; Savytskii, D.; Piekarczyk, W.","Structure peculiarities of the La1-x Ndx Ga O3 solid solutions","Journal of Alloys Compd.","2000","300","","471","474","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522099","5.46754","","5.49118","","7.74241","","90","","90","","90","","232.452","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","(La0.47 Nd0.53) Ga O3","","- Ga La0.47 Nd0.53 O3 -","- Ga La0.47 Nd0.53 O3 -","- Ga4 La1.88 Nd2.12 O12 -","4","0.5","","Vasylechko, L.O.; Berkowski, M.; Matkovskii, A.; Piekarczyk, W.; Savytskii, D.","Structure peculiarities of the La1-x Ndx Ga O3 solid solutions","Journal of Alloys Compd.","2000","300","","471","474","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522100","3.65855","","3.65855","","11.9787","","90","","90","","90","","160.335","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","(Ca Gd0.9 Er0.1) (Al O4)","","- Al Ca Er0.1 Gd0.9 O4 -","- Al Ca Er0.1 Gd0.9 O4 -","- Al2 Ca2 Er0.2 Gd1.8 O8 -","2","0.0625","","Vasylechko, L.O.; Kodama, N.; Matkovskii, A.; Zhydachevskii, Ya.","Crystal structure and optical spectroscopy of Ca Gd Al O4 : Er single crystal","Journal of Alloys Compd.","2000","300","","475","478","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522104","5.72059","","5.72059","","28.40729","","90","","90","","120","","805.086","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","Ba Ir0.5 Co0.5 O3","","- Ba Co0.5 Ir0.5 O3 -","- Ba Co0.5 Ir0.5 O3 -","- Ba12 Co6 Ir6 O36 -","12","0.333333","","Vente, J.F.; Battle, P.D.","Structural chemistry and electronic properties of the hexagonal perovskites Ba Ir1-x Cox O3-d (x = 0.5, 0.7, 0.8)","Journal of Solid State Chemistry","2000","152","","361","373","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522105","9.8359","","5.7299","","10.0421","","90","","109.786","","90","","532.548","","","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","Ba Ir0.5 Co0.5 O3","","- Ba Co0.5 Ir0.5 O3 -","- Ba Co0.5 Ir0.5 O3 -","- Ba8 Co4 Ir4 O24 -","8","1","","Vente, J.F.; Battle, P.D.","Structural chemistry and electronic properties of the hexagonal perovskites Ba Ir1-x Cox O3-d (x = 0.5, 0.7, 0.8)","Journal of Solid State Chemistry","2000","152","","361","373","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522106","5.70747","","5.70747","","23.84619","","90","","90","","120","","672.724","","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","Ba (Ir0.3 Co0.7) O2.828","","- Ba Co0.7 Ir0.3 O2.828 -","- Ba Co0.7 Ir0.3 O2.8284 -","- Ba10 Co7 Ir3 O28.284 -","10","0.416667","","Vente, J.F.; Battle, P.D.","Structural chemistry and electronic properties of the hexagonal perovskites Ba Ir1-x Cox O3-d (x= 0.5, 0.7, 0.8)","Journal of Solid State Chemistry","2000","152","","361","373","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522107","5.7179","","5.7179","","11.9865","","90","","90","","120","","339.388","","","","","","","","","","","","","4","P -3 m 1","-P 3 2""","164","","Ba Ir0.2 Co0.8 O2.83","","- Ba Co0.8 Ir0.2 O2.83 -","- Ba Co0.7996 Ir0.2004 O2.83 -","- Ba5 Co3.998 Ir1.002 O14.15 -","5","0.416667","","Vente, J.F.; Battle, P.D.","Structural chemistry and electronic properties of the hexagonal perovskites Ba Ir1-x Cox O3-d (x = 0.5, 0.7, 0.8)","Journal of Solid State Chemistry","2000","152","","361","373","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522109","8.097","","8.097","","16.464","","90","","90","","120","","934.79","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","Y8 Ga6.01 Ge7.43","","- Ga6.01 Ge7.43 Y8 -","- Ga6.009 Ge7.431 Y8 -","- Ga12.018 Ge14.862 Y16 -","2","0.0833333","","Venturini, G.; Verniere, A.","New Al B2 - and Gd Si2 - type derivative compounds in the Y Ga - Ge system","Journal of Alloys Compd.","2000","298","","213","219","","","","","","","","","","","","","","","","","","","","","","has coordinates","142329","2020-10-21","18:00:00",""
"1522110","8.044","","8.044","","4.131","","90","","90","","120","","231.489","","","","","","","","","","","","","3","P -6 m 2","P -6 2","187","","Y (Ga0.486 Ge1.189)","","- Ga0.486 Ge1.189 Y -","- Ga0.48575 Ge1.18925 Y -","- Ga1.943 Ge4.757 Y4 -","4","0.333333","","Venturini, G.; Verniere, A.","New Al B2 - and Gd Si2 - type derivative compounds in the Y Ga - Ge system","Journal of Alloys Compd.","2000","298","","213","219","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522111","4.094","","4.074","","13.842","","90","","90","","90","","230.87","","","","","","","","","","","","","3","I m m a","-I 2b 2","74","","Y (Ga0.363 Ge1.367)","","- Ga0.363 Ge1.367 Y -","- Ga0.364 Ge1.366 Y -","- Ga1.456 Ge5.464 Y4 -","4","0.25","","Venturini, G.; Verniere, A.","New Al B2 - and Gd Si2 - type derivative compounds in the Y Ga - Ge system","Journal of Alloys Compd.","2000","298","","213","219","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522112","4.098","","4.077","","13.93","","90","","90","","90","","232.736","","","","","","","","","","","","","3","I m m a","-I 2b 2","74","","Y (Ga0.555 Ge1.195)","","- Ga0.555 Ge1.195 Y -","- Ga0.555 Ge1.195 Y -","- Ga2.22 Ge4.78 Y4 -","4","0.25","","Venturini, G.; Verniere, A.","New Al B2 - and Gd Si2 - type derivative compounds in the Y Ga - Ge system","Journal of Alloys Compd.","2000","298","","213","219","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522113","7.728","","7.728","","10.806","","90","","90","","90","","645.356","","","","","","","","","","","","","3","I 4/m c m","-I 4 2c","140","","Tm3 Ga2 Ge3","","- Ga2 Ge3 Tm3 -","- Ga2 Ge3 Tm3 -","- Ga8 Ge12 Tm12 -","4","0.125","","Venturini, G.; Welter, R.","Single crystal refinement of tetragonal Tm3 (Ga, Ge)5 with anti-(Cr5 B3) structure","Journal of Alloys Compd.","2000","299","","9","11","","","","","","","","","","","","","","","","","","","","","","has coordinates","142333","2020-10-21","18:00:00",""
"1522114","4.154","","4.154","","14.403","","90","","90","","90","","248.534","","","","","","","","","","","","","3","I 41/a m d :2","-I 4bd 2","141","","Gd (Ga0.636 Ge0.364)2","","- Ga1.272 Gd Ge0.728 -","- Ga1.272 Gd Ge0.728 -","- Ga5.088 Gd4 Ge2.912 -","4","0.125","","Venturini, G.; Verniere, A.","Crystallographic data and magnetic properties of new Th Si2 and Gd Si2 derivative compounds in the Gd - Ga - Ge system","Journal of Alloys Compd.","2000","305","","7","13","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522115","4.128","","4.101","","13.912","","90","","90","","90","","235.515","","","","","","","","","","","","","3","I m m a","-I 2b 2","74","","Gd (Ga0.291 Ge1.541)","","- Ga0.291 Gd Ge1.541 -","- Ga0.291 Gd Ge1.541 -","- Ga1.164 Gd4 Ge6.164 -","4","0.25","","Venturini, G.; Verniere, A.","Crystallographic data and magnetic properties of new Th Si2 and Gd Si2 derivative compounds in the Gd - Ga - Ge system","Journal of Alloys Compd.","2000","305","","7","13","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522116","4.132","","4.118","","13.92","","90","","90","","90","","236.857","","","","","","","","","","","","","3","I m m a","-I 2b 2","74","","Gd (Ga0.339 Ge1.497)","","- Ga0.339 Gd Ge1.497 -","- Ga0.339 Gd Ge1.497 -","- Ga1.356 Gd4 Ge5.988 -","4","0.25","","Venturini, G.; Verniere, A.","Crystallographic data and magnetic properties of new Th Si2 and Gd Si2 derivative compounds in the Gd - Ga - Ge system","Journal of Alloys Compd.","2000","305","","7","13","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522117","4.122","","4.089","","13.997","","90","","90","","90","","235.917","","","","","","","","","","","","","3","I m m a","-I 2b 2","74","","Gd (Ga0.373 Ge1.415)","","- Ga0.373 Gd Ge1.415 -","- Ga0.373 Gd Ge1.415 -","- Ga1.492 Gd4 Ge5.66 -","4","0.25","","Venturini, G.; Verniere, A.","Crystallographic data and magnetic properties of new Th Si2 and Gd Si2 derivative compounds in the Gd - Ga - Ge system","Journal of Alloys Compd.","2000","305","","7","13","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522118","4.128","","4.1","","14.036","","90","","90","","90","","237.556","","","","","","","","","","","","","3","I m m a","-I 2b 2","74","","Gd (Ga0.478 Ge1.406)","","- Ga0.478 Gd Ge1.406 -","- Ga0.478 Gd Ge1.406 -","- Ga1.912 Gd4 Ge5.624 -","4","0.25","","Venturini, G.; Verniere, A.","Crystallographic data and magnetic properties of new Th Si2 and Gd Si2 derivative compounds in the Gd - Ga - Ge system","Journal of Alloys Compd.","2000","305","","7","13","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522119","4.141","","4.138","","13.962","","90","","90","","90","","239.245","","","","","","","","","","","","","3","I m m a","-I 2b 2","74","","Gd (Ga0.553 Ge1.335)","","- Ga0.553 Gd Ge1.335 -","- Ga0.553 Gd Ge1.335 -","- Ga2.212 Gd4 Ge5.34 -","4","0.25","","Venturini, G.; Verniere, A.","Crystallographic data and magnetic properties of new Th Si2 and Gd Si2 derivative compounds in the Gd - Ga - Ge system","Journal of Alloys Compd.","2000","305","","7","13","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522120","49.54","","8.2","","28.46999","","90","","150.4","","90","","5712.59","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","Gd24 (Ga12.3 Ge30.7)","","- Ga12.3 Gd24 Ge30.7 -","- Ga12.298 Gd24 Ge30.702 -","- Ga49.192 Gd96 Ge122.808 -","4","0.5","","Venturini, G.; Verniere, A.","Crystallographic data and magnetic properties of new Th Si2 and Gd Si2 derivative compounds in the Gd - Ga - Ge system","Journal of Alloys Compd.","2000","305","","7","13","","","","","","","","","","","","","","","","","","","","","","has coordinates","142340","2020-10-21","18:00:00",""
"1522121","3.878","","4.034","","22.559","","90","","90","","90","","352.91","","","","","","","","","","","","","2","P m m a","-P 2a 2a","51","","Tm Ge1.891","","- Ge1.891 Tm -","- Ge1.89067 Tm -","- Ge11.344 Tm6 -","6","0.75","","Venturini, G.","Orthorhombic Tm Ge1.9, with a (Zr Si2)-(Er Ge1.83) intergrowth structure","Journal of Alloys Compd.","2000","308","","200","204","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522125","4.1143","","4.1143","","6.766","","90","","90","","90","","114.531","","","","","","","","","","","","","2","I 4/m m m","-I 4 2","139","","Sr C2","","- C2 Sr -","- C2 Sr -","- C4 Sr2 -","2","0.0625","","Vohn, V.; Knapp, M.; Ruschewitz, U.","Synthesis and crystal structure of Sr C2","Journal of Solid State Chemistry","2000","151","","111","116","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522126","6.2134","","6.2134","","6.2134","","90","","90","","90","","239.877","","","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","Sr C2","","- C2 Sr -","- C2 Sr -","- C4 Sr2 -","2","0.0104167","","Vohn, V.; Knapp, M.; Ruschewitz, U.","Synthesis and crystal structure of Sr C2","Journal of Solid State Chemistry","2000","151","","111","116","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522127","7.0455","","4.4681","","7.6836","","90","","107.22","","90","","231.037","","","","","","","","","","","","","2","C 1 2/c 1","-C 2yc","15","","Sr C2","","- C2 Sr -","- C2 Sr -","- C8 Sr4 -","4","0.5","","Vohn, V.; Knapp, M.; Ruschewitz, U.","Synthesis and crystal structure of Sr C2","Journal of Solid State Chemistry","2000","151","","111","116","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522128","4.00604","","4.00604","","4.01222","","90","","90","","90","","64.39","","","","","","","","","","","","","3","P 4 m m","P 4 -2","99","","Ba0.92 Ti0.90 O2.89","","- Ba0.92 O2.89 Ti0.9 -","- Ba0.92 O2.89 Ti0.9 -","- Ba0.92 O2.89 Ti0.9 -","1","0.125","","Wada, S.; Yano, M.; Suzuki, T.; Noma, T.","Crystal structure of barium titanate fine particles including Mg and analysis of their lattice vibrations","Journal of Materials Science","2000","35","","3889","3902","","","","","","","","","","","","","","","","","","","","","","has coordinates","142348","2020-10-21","18:00:00",""
"1522129","4.0074","","4.0074","","4.0074","","90","","90","","90","","64.356","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","Ba0.93 (Ti0.79 Mg0.21) O2.97","","- Ba0.93 Mg0.21 O2.97 Ti0.79 -","- Ba0.93 Mg0.21 O2.97 Ti0.79 -","- Ba0.93 Mg0.21 O2.97 Ti0.79 -","1","0.0208333","","Wada, S.; Suzuki, T.; Yano, M.; Noma, T.","Crystal structure of barium titanate fine particles including Mg and analysis of their lattice vibrations","Journal of Materials Science","2000","35","","3889","3902","","","","","","","","","","","","","","","","","","","","","","has coordinates","142349","2020-10-21","18:00:00",""
"1522130","7.9974","","7.9974","","13.8536","","90","","90","","90","","886.054","","","","","","","","","","","","","4","I 4/m c m","-I 4 2c","140","","","","- Ba La2 Mn S5 -","- Ba La2 Mn S5 -","- Ba4 La8 Mn4 S20 -","4","0.125","","Wakeshima, M.; Hinatsu, Y.","Crystal structures and magnetic properties of quaternary manganese sulfides, Ba Ln2 Mn S5 (Ln = La, Ce, and Pr)","Journal of Solid State Chemistry","2000","153","","330","335","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1522131","7.9257","","7.9257","","13.83","","90","","90","","90","","868.755","","","","","","","","","","","","","4","I 4/m c m","-I 4 2c","140","","","","- Ba Ce2 Mn S5 -","- Ba Ce2 Mn S5 -","- Ba4 Ce8 Mn4 S20 -","4","0.125","","Wakeshima, M.; Hinatsu, Y.","Crystal structures and magnetic properties of quaternary manganese sulfides, Ba Ln2 Mn S5 (Ln = La, Ce, and Pr)","Journal of Solid State Chemistry","2000","153","","330","335","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1522132","7.8868","","7.8868","","13.8004","","90","","90","","90","","858.407","","","","","","","","","","","","","4","I 4/m c m","-I 4 2c","140","","Ba Pr2 Mn S5","","- Ba Mn Pr2 S5 -","- Ba Mn Pr2 S5 -","- Ba4 Mn4 Pr8 S20 -","4","0.125","","Wakeshima, M.; Hinatsu, Y.","Crystal structures and magnetic properties of quaternary manganese sulfides, Ba Ln2 Mn S5 (Ln = La, Ce, and Pr)","Journal of Solid State Chemistry","2000","153","","330","335","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522135","5.62176","","5.62176","","17.31609","","90","","90","","120","","473.942","","","","","","","","","","","","","4","R -3 :H","-R 3","148","","La2 Ca2 Mn O7","","- Ca2 La2 Mn O7 -","- Ca2 La2 Mn O7.0002 -","- Ca6 La6 Mn3 O21.0006 -","3","0.166667","","Wang, Y.-X.; Lin, J.-H.; Du, Y.; Loong, C.-K.; Qin, R.-W.; Han, B.","A hexagonal perovskite intergrowth compound: La2 Ca2 Mn O7","Angew. Chem. Int. ed.","2000","39","","2730","2732","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522136","7.706","","4.5583","","20.187","","90","","92.334","","90","","708.506","","","","","","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","(Ti0.621 Cr0.19 Fe0.087 Mg0.055 Al0.033 V0.011 Nb0.0045) O1.491 (O H)0.509","Carmichaelite","- Al0.033 Cr0.19 Fe0.087 H0.509 Mg0.055 Nb0.0045 O2 Ti0.621 V0.011 -","- Al0.0327273 Cr0.19 Fe0.0872727 Mg0.0545455 Nb0.00454545 O2 Ti0.620909 V0.0109091 -","- Al0.72 Cr4.18 Fe1.92 Mg1.2 Nb0.1 O44 Ti13.66 V0.24 -","22","5.5","","Wang, L.-P.; Peacor, D.R.; Rouse, R.C.; Essene, E.J.; Zhang, Y.-X.","Carmichaelite, a new hydroxyl-bearing titanate from Garnet Ridge, Arizona","American Mineralogist","2000","85","","792","800","","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:11:46",""
"1522137","12.457","","12.457","","3.942","","90","","90","","90","","611.707","","","","","","","","","","","","","5","P 4 b m","P 4 -2ab","100","","Ba3.75 (Y0.833 Sm0.833)0.5 Nb10 O30","","- Ba3.75 Nb10 O30 Sm0.4165 Y0.4165 -","- Ba3.75 Nb10 O30 Sm0.4166 Y0.4166 -","- Ba3.75 Nb10 O30 Sm0.4166 Y0.4166 -","1","0.125","","Wang, J.-K.; Mizutani, N.; Wakiya, N.; Shinozaki, K.","Structural and ferroelectric properties of (1-X)(Ba~3.75~Y~0.83~Nb~10~O~30~) - X(Ba~3.75~Sm~0.83~Nb~10~O~30~) solid solutions","Journal of the Ceramic Society of Japan","2000","108","1253","36","39","10.2109/jcersj.108.36","","","","","","","","","","","","","","","","","","","","","has coordinates","175216","2020-10-21","18:00:00",""
"1522144","8.684","","8.684","","17.238","","90","","90","","90","","1299.95","","","","","","","","","","","","","3","I 4/m","-I 4","87","","","","- Bi14 Cr O24 -","- Bi14 Cr O24.04 -","- Bi28 Cr2 O48.08 -","2","0.125","","Warda, S.A.; Kesper, U.; Pietzuch, W.; Massa, W.; Reinen, D.","Color and constitution of Cr(VI)-doped Bi2 O3 phases: the structure of Bi14 Cr O24","Journal of Solid State Chemistry","2000","149","","209","217","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1522158","5.76205","","5.76188","","8.24301","","87.877","","71.968","","69.34","","242.691","","","","","","","","","","","","","3","P -1","-P 1","2","","Na4 (Fe O4)","","- Fe Na4 O4 -","- Fe Na4 O4 -","- Fe2 Na8 O8 -","2","1","","Weller, M.T.; Hector, A.L.","The structure of the (Fe(IV) O4)(4-) ion","Angew. Chem. Int. ed.","2000","39","","4162","4163","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522159","4.058","","4.058","","15.286","","90","","90","","90","","251.72","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Tb (Ti0.87 Mo0.13) Ge","","- Ge Mo0.13 Tb Ti0.87 -","- Ge Mo0.13 Tb Ti0.87 -","- Ge4 Mo0.52 Tb4 Ti3.48 -","4","0.125","","Welter, R.; Morozkin, A.V.; Klosek, V.; Malaman, B.; Verniere, A.","Single crystal refinements of Tb Ti Ge, Gd Ti Ge and Tb Ti0.85 Mo0.15 Ge with (Ce Fe Si)- and (Ce Sc Ci)-type structures","Journal of Alloys Compd.","2000","307","","207","211","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522160","4.067","","4.067","","15.475","","90","","90","","90","","255.964","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","Gd Ti Ge","","- Gd Ge Ti -","- Gd Ge Ti -","- Gd4 Ge4 Ti4 -","4","0.125","","Welter, R.; Morozkin, A.V.; Malaman, B.; Klosek, V.; Verniere, A.","Single crystal refinements of Tb Ti Ge, Gd Ti Ge and Tb Ti0.85 Mo0.15 Ge with (Ce Fe Si)- and (Ce Sc Ci)-type structures","Journal of Alloys Compd.","2000","307","","207","211","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522161","4.059","","4.059","","7.673","","90","","90","","90","","126.416","","","","","","","","","","","","","3","P 4/n m m :2","-P 4a 2a","129","","Tb Ti Ge","","- Ge Tb Ti -","- Ge Tb Ti -","- Ge2 Tb2 Ti2 -","2","0.125","","Welter, R.; Malaman, B.; Klosek, V.; Morozkin, A.V.; Verniere, A.","Single crystal refinements of Tb Ti Ge, Gd Ti Ge and Tb Ti0.85 Mo0.15 Ge with (Ce Fe Si)- and (Ce Sc Ci)-type structures","Journal of Alloys Compd.","2000","307","","207","211","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522162","10.057","","14.064","","29.526","","90","","90","","90","","4176.21","","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- Ba3 I2 Si -","- Ba3 I2 Si -","- Ba48 I32 Si16 -","16","0.5","","Wengert, S.; Nesper, R.","Ba3 Si I2, a double salt of barium iodide and the Zintl phase Ba2 Si","Journal of Solid State Chemistry","2000","152","","460","465","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1522163","10.064","","14.082","","29.605","","90","","90","","90","","4195.66","","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","Ba3 I2 Ge","","- Ba3 Ge I2 -","- Ba3 Ge I2 -","- Ba48 Ge16 I32 -","16","0.5","","Wengert, S.; Nesper, R.","Ba3 Si I2, a double salt of barium iodide and the Zintl phase Ba2 Si","Journal of Solid State Chemistry","2000","152","","460","465","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522171","7.9885","","8.0322","","10.2413","","90.2","","95.16","","89.92","","654.468","","","","","","","","","","","","","4","C -1","-P 1 (1/2*x+1/2*y,1/2*x-1/2*y,-z)","2","","La5 (Re3 Mn O16)","","- La5 Mn O16 Re3 -","- La5 Mn O16 Re3 -","- La10 Mn2 O32 Re6 -","2","","","Wiebe, C.R.; Gourrier, A.; Langet, T.; Britten, J.F.; Greedan, J.E.","Synthesis, structure, and magnetic behavior of La5 Re3 Mn O16: a new perovskite-like material","Journal of Solid State Chemistry","2000","151","","31","39","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522173","3.9746","","3.9746","","12.3647","","90","","90","","90","","195.331","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","(La Nd) Cu O4","","- Cu La Nd O4 -","- Cu La Nd O4 -","- Cu2 La2 Nd2 O8 -","2","0.0625","","Wilhelm, H.; Cros, C.; Reny, E.; Demazeau, G.; Hanfland, M.","Pressure-induced structural phase transitions in Ln2-x Ndx Cu O4 for Ln= La (0.6< x<2) and Ln= Pr (x= 0)","Journal of Solid State Chemistry","2000","151","","231","240","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522176","5.2431","","12.7848","","5.2931","","90","","90","","90","","354.807","","","","","","","","","","","","","4","C m c a","-C 2ac 2","64","","(La Nd) Cu O4","","- Cu La Nd O4 -","- Cu La Nd O4 -","- Cu4 La4 Nd4 O16 -","4","","","Wilhelm, H.; Cros, C.; Hanfland, M.; Reny, E.; Demazeau, G.","Pressure-induced structural phase transitions in Ln2-x Ndx Cu O4 for Ln= La (0.6< x<2) and Ln= Pr (x= 0)","Journal of Solid State Chemistry","2000","151","","231","240","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522178","3.9609","","3.9609","","12.2395","","90","","90","","90","","192.022","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","Pr2 Cu O4","","- Cu O4 Pr2 -","- Cu O4 Pr2 -","- Cu2 O8 Pr4 -","2","0.0625","","Wilhelm, H.; Cros, C.; Demazeau, G.; Reny, E.; Hanfland, M.","Pressure-induced structural phase transitions in Ln2-x Ndx Cu O4 for Ln= La (0.6< x<2) and Ln= Pr (x= 0)","Journal of Solid State Chemistry","2000","151","","231","240","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522181","5.25","","12.748","","5.319","","90","","90","","90","","355.985","","","","","","","","","","","","","3","C m c a","-C 2ac 2","64","","Pr2 Cu O4","","- Cu O4 Pr2 -","- Cu O4 Pr2 -","- Cu4 O16 Pr8 -","4","","","Wilhelm, H.; Cros, C.; Reny, E.; Demazeau, G.; Hanfland, M.","Pressure-induced structural phase transitions in Ln2-x Ndx Cu O4 for Ln= La (0.6< x<2) and Ln= Pr (x= 0)","Journal of Solid State Chemistry","2000","151","","231","240","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522185","10.974","","7.3908","","7.5239","","90","","90","","90","","610.238","","","","","","","","","","","","","3","C m c m","-C 2c 2","63","","Pr3 (Ru O7)","","- O7 Pr3 Ru -","- O7 Pr3 Ru -","- O28 Pr12 Ru4 -","4","0.25","","Wiss, F.; Raju, N.P.; Wills, A.S.; Greedan, J.E.","Structure and magnetism in Pr3 Ru O7","International Journal of Inorganic Materials","2000","2","","53","59","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522201","9.1364","","12.5913","","9.056","","90","","90","","90","","1041.8","","","","","","","","","","","","","3","P n c a","-P 2a 2n","60","","Al2 (W O4)3","","- Al2 O12 W3 -","- Al2 O12 W3 -","- Al8 O48 W12 -","4","0.5","","Woodcock, D.A.; Ritter, C.; Lightfoot, P.","Negative thermal expansion in Y2 (W O4)3","Journal of Solid State Chemistry","2000","149","","92","98","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1522204","10.07","","13.937","","9.98","","90","","90","","90","","1400.65","","","","","","","","","","","","","3","P n c a","-P 2a 2n","60","","Y2 (W O4)3","","- O12 W3 Y2 -","- O12 W3 Y2 -","- O48 W12 Y8 -","4","0.5","","Woodcock, D.A.; Lightfoot, P.; Ritter, C.","Negative thermal expansion in Y2 (W O4)3","Journal of Solid State Chemistry","2000","149","","92","98","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1522227","6.006","","11.058","","6.129","","90","","112.98","","90","","374.75","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Sr2 Sn (O H)8","","- H8 O8 Sn Sr2 -","- H8 O8 Sn Sr2 -","- H16 O16 Sn2 Sr4 -","2","0.5","","Wu, M.-M.; Li, X.-L.; Shen, G.-P.; Xu, R.-R.; Li, J.; Proserpio, D.M.","Hydrothermal synnthesis and structural characterization of a novel hydroxo stannate: Sr2 Sn (O H)8","Journal of Solid State Chemistry","2000","151","","56","60","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522258","9.067","","9.067","","9.067","","90","","90","","90","","745.403","","","","","","","","","","","","","4","F m -3 m","-F 4 2 3","225","","Cs2 K Mn F6","","- Cs2 F6 K Mn -","- Cs2 F6 K Mn -","- Cs8 F24 K4 Mn4 -","4","0.0208333","","Xu, Y.; Carlson, S.; Norrestam, R.; Sjoedin, A.","Phase transition in Cs2 K Mn F6: crystal structures of lowand high-temperature modifications","Journal of Solid State Chemistry","2000","150","","399","403","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522259","9.356","","7.224","","11.898","","90","","90","","90","","804.159","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Cs2 (Cu Cl4)","","- Cl4 Cs2 Cu -","- Cl4 Cs2 Cu -","- Cl16 Cs8 Cu4 -","4","0.5","","Xu, Y.; Carlson, S.; Soederberg, K.; Norrestam, R.","High-pressure studies of Cs2 Cu Cl4 and Cs2 Co Cl4 by X-ray diffraction methods","Journal of Solid State Chemistry","2000","153","","212","217","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522260","6.126","","6.126","","8.981","","90","","90","","90","","337.038","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Cs2 K (Mn F6)","","- Cs2 F6 K Mn -","- Cs2 F6 K Mn -","- Cs4 F12 K2 Mn2 -","2","0.0625","","Xu, Y.; Soederberg, K.; Norrestam, R.","High-pressure phase transition in Cs2 K Mn F6","Journal of Solid State Chemistry","2000","153","","248","253","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522264","5.2916","","5.2916","","4.9987","","90","","90","","120","","121.216","","","","","","","","","","","","","3","P -3 1 m","-P 3 2","162","","Nb2 (N0.86 O0.14)","","- N0.86 Nb2 O0.14 -","- N0.86 Nb2 O0.14 -","- N2.58 Nb6 O0.42 -","3","0.25","","Yamada, K.; Sato, N.; Masuda, H.; Fujino, T.","Synthesis and crystal structure of a new niobium oxynitride, Nb2 N0.88 O0.12","Journal of Solid State Chemistry","2000","150","","36","42","","","","","","","","","","","","","","","","","","","","","","has coordinates","142485","2020-10-21","18:00:00",""
"1522275","8.152","","8.152","","25.21","","90","","90","","90","","1675.33","","","","","","","","","","","","","4","I 4/m c m","-I 4 2c","140","","Nd6 Fe13 Ga D12.25","","- D12.25 Fe13 Ga Nd6 -","- D12.25 Fe13 Ga Nd6 -","- D49 Fe52 Ga4 Nd24 -","4","0.125","","Yartys', V.A.; Denys, R.V.; Hauback, B.C.; Delaplane, R.G.; Bulyk, I.I.","Powder neutron diffraction study of Nd6 Fe13 Ga D12.3 with a filled(Nd6 Fe13 Si)-type structure","Journal of Alloys Compd.","2000","312","","158","164","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522277","6.549","","3.883","","7.506","","90","","90","","90","","190.876","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Hf Pt Si -","- Hf Pt Si -","- Hf4 Pt4 Si4 -","4","0.5","","Yashiro, S.; Nagata, Y.; Samata, H.; Abe, S.","Magnetism and transport properties of Hf M Si (M = Pt, Pd) and Hf Rh1-x Pdx Si","Journal of Alloys Compd.","2000","298","","51","58","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1522279","6.57","","3.874","","7.565","","90","","90","","90","","192.546","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Hf Pd Si -","- Hf Pd Si -","- Hf4 Pd4 Si4 -","4","0.5","","Yashiro, S.; Nagata, Y.; Samata, H.; Abe, S.","Magnetism and transport properties of Hf M Si (M = Pt, Pd) and Hf Rh1-x Pdx Si","Journal of Alloys Compd.","2000","298","","51","58","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1522281","6.411","","3.817","","7.356","","90","","90","","90","","180.007","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Nb Pt Si -","- Nb Pt Si -","- Nb4 Pt4 Si4 -","4","0.5","","Yashiro, S.; Kasahi, A.; Kasai, R.; Nagata, Y.; Samata, H.","New equiatomic silicides of M M' Si (M = Nb, Ta; M' = Pt, Rh) and superconductivity of Ta1-x Nbx Pt Si","Journal of Alloys Compd.","2000","309","","51","56","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1522283","6.376","","3.743","","7.283","","90","","90","","90","","173.811","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Nb Rh Si -","- Nb Rh Si -","- Nb4 Rh4 Si4 -","4","0.5","","Yashiro, S.; Kasahi, A.; Samata, H.; Kasai, R.; Nagata, Y.","New equiatomic silicides of M M' Si (M = Nb, Ta; M' = Pt, Rh) and superconductivity of Ta1-x Nbx Pt Si","Journal of Alloys Compd.","2000","309","","51","56","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1522285","6.366","","3.747","","7.298","","90","","90","","90","","174.082","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Ta Rh Si","","- Rh Si Ta -","- Rh Si Ta -","- Rh4 Si4 Ta4 -","4","0.5","","Yashiro, S.; Kasai, R.; Kasahi, A.; Nagata, Y.; Samata, H.","New equiatomic silicides of M M' Si (M = Nb, Ta; M' = Pt, Rh) and superconductivity of Ta1-x Nbx Pt Si","Journal of Alloys Compd.","2000","309","","51","56","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522291","3.8815","","3.8621","","7.7497","","90","","90","","90","","116.174","","","","","","","","","","","","","3","P m m m","-P 2 2","47","","Ce0.667 Ti O3","","- Ce0.667 O3 Ti -","- Ce0.667 O3 Ti -","- Ce1.334 O6 Ti2 -","2","0.25","","Yoshii, K.","Structural and magnetic studies of the lanthanide deficient perovskite Ce2/3 Ti O3","Journal of Alloys Compd.","2000","305","","72","75","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522293","3.944","","3.944","","3.944","","90","","90","","90","","61.349","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","Sr ((Co0.5 Nb0.5) O3)","","- Co0.5 Nb0.5 O3 Sr -","- Co0.5 Nb0.5 O3 Sr -","- Co0.5 Nb0.5 O3 Sr -","1","0.0208333","","Yoshii, K.","Structural and magnetic properties of the perovskites Srn+1 (Co0.5 Nb0.5)n O3n+1 (n=infty, 2 and 1)","Journal of Alloys Compd.","2000","307","","119","123","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522295","3.9155","","3.9155","","20.39949","","90","","90","","90","","312.747","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Sr3 ((Co0.5 Nb0.5)2 O7)","","- Co Nb O7 Sr3 -","- Co Nb O7 Sr3 -","- Co2 Nb2 O14 Sr6 -","2","0.0625","","Yoshii, K.","Structural and magnetic properties of the perovskites Srn+1 (Co0.5 Nb0.5)n O3n+1 (n=infty, 2 and 1)","Journal of Alloys Compd.","2000","307","","119","123","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522297","3.892","","3.892","","12.6391","","90","","90","","90","","191.453","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Sr2 ((Co0.5 Nb0.5) O4)","","- Co0.5 Nb0.5 O4 Sr2 -","- Co0.5 Nb0.5 O4 Sr2 -","- Co Nb O8 Sr4 -","2","0.0625","","Yoshii, K.","Structural and magnetic properties of the perovskites Srn+1 (Co0.5 Nb0.5)n O3n+1 (n=infty, 2 and 1)","Journal of Alloys Compd.","2000","307","","119","123","","","","","","","","","","","","","","","","","","","","","","has coordinates","142518","2020-10-21","18:00:00",""
"1522299","4.0789","","4.0789","","4.0789","","90","","90","","90","","67.862","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","Ba (Co0.5 Nb0.5) O3","","- Ba Co0.5 Nb0.5 O3 -","- Ba Co0.5 Nb0.5 O3 -","- Ba Co0.5 Nb0.5 O3 -","1","0.0208333","","Yoshii, K.","Magnetic transition in the perovskite Ba2 Co Nb O6","Journal of Solid State Chemistry","2000","151","","294","297","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522311","7.399","","10.259","","8.207","","90","","106.48","","90","","597.371","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","K (Ti P2 O7)","","- K O7 P2 Ti -","- K O7 P2 Ti -","- K4 O28 P8 Ti4 -","4","1","","Zatovsky, I.V.; Slobodyanik, N.S.; Kowalski, A.; Slyva, T.Yu.","Synthesis and structure of binary diphosphate K Ti P2 O7","Dopov. Nats. Akad. Nauk. Ukr.","2000","2000","","151","155","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522313","12.161","","12.161","","12.161","","90","","90","","90","","1798.49","","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Zr3 V3 O0.67","","- O0.67 V3 Zr3 -","- O0.67 V3 Zr3 -","- O10.72 V48 Zr48 -","16","0.0833333","","Zavaliy, I.Yu.; Yelon, W.B.; Zavalii, P.Yu.; Pecharskii, V.K.; Saldan, I.V.","The crystal structure of the oxygen-stabilized eta-phase Zr3 V3 Ox D9.6","Journal of Alloys Compd.","2000","309","","75","82","","","","","","","","","","","","","","","","","","","","","","has coordinates","142535","2020-10-21","18:00:00",""
"1522315","13.0264","","13.0264","","13.0264","","90","","90","","90","","2210.41","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","Zr3 V3 O0.31 D9.566","","- D9.566 O0.31 V3 Zr3 -","- D9.566 O0.31 V3 Zr3 -","- D153.056 O4.96 V48 Zr48 -","16","0.0833333","","Zavaliy, I.Yu.; Yelon, W.B.; Zavalii, P.Yu.; Pecharskii, V.K.; Saldan, I.V.","The crystal structure of the oxygen-stabilized eta-phase Zr3 V3 Ox D9.6","Journal of Alloys Compd.","2000","309","","75","82","","","","","","","","","","","","","","","","","","","","","","has coordinates","142537","2020-10-21","18:00:00",""
"1522317","13.0258","","13.0258","","13.0258","","90","","90","","90","","2210.11","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","Zr3 V3 O0.24 D9.566","","- D9.566 O0.24 V3 Zr3 -","- D9.566 O0.24 V3 Zr3 -","- D153.056 O3.84 V48 Zr48 -","16","0.0833333","","Zavaliy, I.Yu.; Yelon, W.B.; Pecharskii, V.K.; Zavalii, P.Yu.; Saldan, I.V.","The crystal structure of the oxygen-stabilized eta-phase Zr3 V3 Ox D9.6","Journal of Alloys Compd.","2000","309","","75","82","","","","","","","","","","","","","","","","","","","","","","has coordinates","142539","2020-10-21","18:00:00",""
"1522324","9.2213","","9.2213","","9.2213","","90","","90","","90","","784.109","","","","","","","","","","","","","3","I m -3","-I 2 2 3","204","","","","- La0.1 Rh8 Sb24 -","- La0.1 Rh8 Sb24 -","- La0.1 Rh8 Sb24 -","1","0.0208333","","Zeng, L.-M.; Franzen, H.F.","Lanthanum rhodium antimonide, La0.1 Rh8 Sb24","Journal of Alloys Compd.","2000","311","","224","225","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1522330","8.6335","","5.455","","7.0482","","90","","90.295","","90","","331.936","","","","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","Na3 In (P O4)2","","- In Na3 O8 P2 -","- In Na3 O8 P2 -","- In2 Na6 O16 P4 -","2","0.5","","Zhizhin, M.G.; Lazoryak, B.I.; Morozov, V.A.; Bobylev, A.P.; Popov, A.M.; Spiridonov, F.M.; Komissarova, L.N.","Structure of polymorphous modifications of double sodium and indiumphosphate","Journal of Solid State Chemistry","2000","149","","99","106","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522338","25.083","","25.083","","25.083","","90","","90","","90","","15781.1","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","K90.1 (Al92 Si100 O384)","","- Al92 K90.1 O384 Si100 -","- Al92.0064 K90.0992 O384 Si99.9936 -","- Al92.0064 K90.0992 O384 Si99.9936 -","1","0.00520833","","Zhu, L.; Seff, K.","Cation crowding in zeolites. Reinvestigation of the crystal structure of dehydrated potassium-exchanged zeolite X","J. Phys. Chem. B","2000","104","","8946","8951","","","","","","","","","","","","","","","","","","","","","","has coordinates","142560","2020-10-21","18:00:00",""
"1522340","3.831","","3.831","","15.951","","90","","90","","90","","234.106","","","","","","","","","","","","","5","P 4/n m m :2","-P 4a 2a","129","","Sr2 Cu Mn O3 S","","- Cu Mn O3 S Sr2 -","- Cu Mn O3 S Sr2 -","- Cu2 Mn2 O6 S2 Sr4 -","2","0.125","","Zhu, W.J.; Hor, P.H.","Synthesis and structure of layered manganese oxychalcogenides: Sr2 Cu Mn O3 S and Sr4 Cu2 Mn3 O7.5 Q2 (Q = S, Se)","Journal of Solid State Chemistry","2000","153","","26","29","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522342","3.89","","3.89","","34.341","","90","","90","","90","","519.651","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","Sr4 Cu2 Mn3 O7.5 S2","","- Cu2 Mn3 O7.5 S2 Sr4 -","- Cu2 Mn3 O7.5 S2 Sr4 -","- Cu4 Mn6 O15 S4 Sr8 -","2","0.0625","","Zhu, W.J.; Hor, P.H.","Synthesis and structure of layered manganese oxychalcogenides: Sr2 Cu Mn O3 S and Sr4 Cu2 Mn3 O7.5 Q2 (Q = S, Se)","Journal of Solid State Chemistry","2000","153","","26","29","","","","","","","","","","","","","","","","","","","","","","has coordinates","142564","2020-10-21","18:00:00",""
"1522344","3.888","","3.888","","35.29","","90","","90","","90","","533.463","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","Sr4 Cu2 Mn3 O7.5 Se2","","- Cu2 Mn3 O7.5 Se2 Sr4 -","- Cu2 Mn3 O7.5 Se2 Sr4 -","- Cu4 Mn6 O15 Se4 Sr8 -","2","0.0625","","Zhu, W.J.; Hor, P.H.","Synthesis and structure of layered manganese oxychalcogenides: Sr2 Cu Mn O3 S and Sr4 Cu2 Mn3 O7.5 Q2 (Q = S, Se)","Journal of Solid State Chemistry","2000","153","","26","29","","","","","","","","","","","","","","","","","","","","","","has coordinates","142566","2020-10-21","18:00:00",""
"1522346","8.688","","8.688","","4.848","","90","","90","","90","","365.934","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Gd1.2 Fe9.04 Mo2 N1.03","","- Fe9.04 Gd1.2 Mo2 N1.03 -","- Fe9.04 Gd1.2 Mo2 N1.03 -","- Fe18.08 Gd2.4 Mo4 N2.06 -","2","0.0625","","Zinkevitch, M.; Mattern, N.; Gebel, B.; Wetzig, K.","Phase transformations of the Gd - Fe - Mo ternary compounds with Th Mn12 - type structure under nitrogen atmosphere","Journal of Alloys Compd.","2000","298","","226","236","","","","","","","","","","","","","","","","","","","","","","has coordinates","142568","2020-10-21","18:00:00",""
"1522350","10.7793","","10.7793","","10.7793","","90","","90","","90","","1252.48","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","Bi2 (In Nb O7)","","- Bi2 In Nb O7 -","- Bi2 In Nb O7 -","- Bi16 In8 Nb8 O56 -","8","0.0416667","","Zou, Z.; Ye, J.; Arakawa, H.","Preparation, structural and photophysical properties of Bi2 In Nb O7 compound","Journal of Materials Science. Letters","2000","19","","1909","1911","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1524955","5.453","","5.453","","9.091","","90","","90","","120","","234.106","","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","(La0.025 Sr0.975) Mn O3","","- La0.025 Mn O1.5 Sr0.975 -","- La0.025 Mn O1.5 Sr0.975 -","- La0.1 Mn4 O6 Sr3.9 -","4","0.166667","","Mori, T.; Kamegashira, N.","The layered structuure of La substituted Sr Mn O3","Journal of Alloys Compd.","2000","313","","1","4","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525546","9.929","","6.048","","14.519","","90","","109.94","","90","","819.606","","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","K2 ((O3 S)2 C F2)","","- C F2 K2 O6 S2 -","- C F2 K2 O6 S2 -","- C4 F8 K8 O24 S8 -","4","1","","Abrahams, C.T.; Gatehouse, B.M.; Blackshaw, R.; Deacon, G.B.; Henkel, G.; Sartori, P.; Herkelmann, R.; Jueschke, R.; Philosof, A.; Rieland, P.","Barium, potassium, and tris(ethane-1,2-diamine) nickel(II) fluoroalkanedisulfonates and the X-ray crystal structures of K2 (O3 S)2 C H F, K2 (O3 S)2 C F2, K2 (O3 S)2 (C F2)3 * (H2 O) and (Nien)3 ((O3 S)2 (C F2)n) (n=1,3)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","2012","2019","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525547","5.966","","10.925","","17.633","","90","","99.3","","90","","1134.19","","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","K2 ((O3 S)2 (C F2)3) (H2 O)","","- C3 H2 F6 K2 O7 S2 -","- C3 H2 F6 K2 O7 S2 -","- C12 H8 F24 K8 O28 S8 -","4","1","","Abrahams, C.T.; Herkelmann, R.; Deacon, G.B.; Blackshaw, R.; Henkel, G.; Gatehouse, B.M.; Jueschke, R.; Philosof, A.; Rieland, P.; Sartori, P.","Barium, potassium, and tris(ethane-1,2-diamine) nickel(II) fluoroalkanedisulfonates and the X-ray crystal structures of K2 (O3S)2 C H F, K2 (O3 S)2 C F2, K2 (O3 S)2 (C F2)3 * (H2 O) and (Nien)3((O3 S)2 (C F2)n) (n=1,3)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","2012","2019","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1525548","6.8373","","7.0932","","19.873","","90","","90","","90","","963.807","","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","Sb5 O6 (P O4)","","- O10 P Sb5 -","- O10 P Sb5 -","- O40 P4 Sb20 -","4","1","","Adair, B.A.; Cheetham, A.K.","Synthesis and structure of Sb5 P O10, a new phosphate of antimony(III)","Journal of Solid State Chemistry","2000","155","","451","454","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525549","3.86117","","3.86117","","3.86117","","90","","90","","90","","57.565","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","Sr (Fe0.9 Ti0.1) O2.95","","- Fe0.9 O2.95 Sr Ti0.1 -","- Fe0.9 O2.949 Sr Ti0.1 -","- Fe0.9 O2.949 Sr Ti0.1 -","1","0.0208333","","Adler, P.; Eriksson, S.","Structural properties, Moessbauer spectra and magnetism of perovskite-type oxides Sr Fe1-x Tix O3-y","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","118","124","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525550","3.88521","","3.88521","","3.88521","","90","","90","","90","","58.647","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","Sr (Fe0.5 Ti0.5) O2.9","","- Fe0.5 O2.9 Sr Ti0.5 -","- Fe0.5 O2.901 Sr Ti0.5 -","- Fe0.5 O2.901 Sr Ti0.5 -","1","0.0208333","","Adler, P.; Eriksson, S.","Structural properties, Moessbauer spectra and magnetism of perovskite-type oxides Sr Fe1-x Tix O3-y","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","118","124","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525552","15.79","","11.488","","7.939","","90","","90","","90","","1440.1","","","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","(Cr (N O) (N H3)5) (Cl O4)2","","- Cl2 Cr H15 N6 O9 -","- Cl2 Cr H15 N6 O9 -","- Cl8 Cr4 H60 N24 O36 -","4","0.5","","Akashi, H.","X-ray structure determination of (Cr (N O) (N H3)5) (Cl O4)2","Bull. Res. Inst. Nat. Sci. Okayama Univ. of Sci.","2000","26","","111","113","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525553","2.8899","","2.8899","","14.1938","","90","","90","","120","","102.659","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","(Li0.744 Ni0.256) (Li0.18 Ni0.82) O2","","- Li0.924 Ni1.076 O2 -","- Li0.924 Ni1.076 O2 -","- Li2.772 Ni3.228 O6 -","3","0.0833333","","Akimoto, J.; Gotoh, Y.","Single crystal growth, structure and physical property of Li Co O2 and Li Ni O2","Molecular Crystals and Liquid Crystals","2000","341","","143","146","","","","","","","","","","","","","","","","","","","","","","has coordinates","146564","2020-10-21","18:00:00",""
"1525568","5.4711","","5.4711","","13.404","","90","","90","","120","","347.468","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","(La0.5 Li0.5) (Ti O3)","","- La0.5 Li0.5 O3 Ti -","- La0.504 Li0.486 O3 Ti -","- La3.024 Li2.916 O18 Ti6 -","6","0.166667","","Alonso, J.A.; Sanz, J.; Paris, M.A.; Ibarra, J.; Santamaria, J.; Fernandez, M.T.; Leon, C.; Varez, A.","Relationship between crystal structure and Li(+)-conductivity in La0.5 Li0.5 Ti O3 perovskite","Materials Research Society Symposia Proceedings","2000","575","","337","342","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525569","5.1614","","5.511","","7.3997","","90","","90.112","","90","","210.48","","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Er (Ni O3)","","- Er Ni O3 -","- Er Ni O3 -","- Er4 Ni4 O12 -","4","1","","Alonso, J.A.; Martinez-Lope, M.J.; Casais, M.T.; Garcia-Munoz, J.L.; Fernandez-Diaz, M.T.","Room-temperature monoclinic distortion due to charge disproportionation in R Ni O3 perovskites with small rare-earth cations (R = Ho, Y, Er, Tm, Yb and Lu): a neutron diffraction study","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2000","61","","1756","1763","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525570","5.1453","","5.5038","","7.375","","90","","90.115","","90","","208.85","","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Tm (Ni O3)","","- Ni O3 Tm -","- Ni O3 Tm -","- Ni4 O12 Tm4 -","4","1","","Alonso, J.A.; Martinez-Lope, M.J.; Casais, M.T.; Garcia-Munoz, J.L.; Fernandez-Diaz, M.T.","Room-temperature monoclinic distortion due to charge disproportionation in R Ni O3 perovskites with small rare-earth cations (R = Ho, Y, Er, Tm, Yb and Lu): a neutron diffraction study","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2000","61","","1756","1763","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525571","5.1298","","5.4996","","7.3404","","90","","90.125","","90","","207.086","","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Yb (Ni O3)","","- Ni O3 Yb -","- Ni O3 Yb -","- Ni4 O12 Yb4 -","4","1","","Alonso, J.A.; Martinez-Lope, M.J.; Garcia-Munoz, J.L.; Fernandez-Diaz, M.T.; Casais, M.T.","Room-temperature monoclinic distortion due to charge disproportionation in R Ni O3 perovskites with small rare-earth cations (R = Ho, Y, Er, Tm, Yb and Lu): a neutron diffraction study","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2000","61","","1756","1763","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525572","5.1109","","5.4984","","7.3404","","90","","90.163","","90","","206.277","","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Lu (Ni O3)","","- Lu Ni O3 -","- Lu Ni O3 -","- Lu4 Ni4 O12 -","4","1","","Alonso, J.A.; Garcia-Munoz, J.L.; Casais, M.T.; Martinez-Lope, M.J.; Fernandez-Diaz, M.T.","Room-temperature monoclinic distortion due to charge disproportionation in R Ni O3 perovskites with small rare-earth cations (R= Ho, Y, Er, Tm, Yb and Lu): a neutron diffraction study","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2000","61","","1756","1763","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525573","6.72785","","6.72785","","6.72785","","90","","90","","90","","304.529","","","","","","","","","","","","","4","P 21 3","P 2ac 2ab 3","198","","Sr (O H) Br","","- Br H O Sr -","- Br H O Sr -","- Br4 H4 O4 Sr4 -","4","0.333333","","Altorfer, F.; Peter, S.; Lutz, H.D.","Investigation of (O H) disorder in Sr (O H) Br","Physik (Berlin)","2000","276","","280","281","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525574","5.431","","2.807","","5.385","","90","","115.98","","90","","73.798","","","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","Li (Cr0.05 Mn0.95) O2","","- Cr0.05 Li Mn0.95 O2 -","- Cr0.05 Li Mn0.95 O2 -","- Cr0.1 Li2 Mn1.9 O4 -","2","0.25","","Ammundsen, B.; Steiner, R.; Desilvestro, J.; Groutso, T.; Hassell, D.; Regan, E.; Pickering, P.J.; Metson, J.B.","Formation and structural properties of layered Li Mn O2 cathode materials","Electrochemical Society Proceedings","2000","99","","57","67","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525576","9.8142","","5.7893","","4.782","","90","","90","","90","","271.701","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Fe (P O4)","","- Fe O4 P -","- Fe O4 P -","- Fe4 O16 P4 -","4","0.5","","Andersson, A.S.; Kalska, B.; Haeggstroem, L.; Thomas, J.O.","Lithium extraction/insertion in Li Fe P O4: an X-ray diffraction and Mossbauer spectroscopy study","Solid State Ionics","2000","130","","41","52","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525577","7.8511","","7.8511","","56.843","","90","","90","","90","","3503.79","","","","","","","","","","","","","6","P 43 21 2","P 4nw 2abw","96","","(Np O2 (N C S) (C O (N H2)2)4) (C O (N H2)2)0.5","","- C5.5 H18 N10 Np O6.5 S -","- C5.5 H18 N10 Np O6.5 S -","- C44 H144 N80 Np8 O52 S8 -","8","1","","Andreev, G.B.; Fedoseev, A.M.; Budantseva, N.A.; Antipin, M.Yu.","Crystal structure and properties of (isothiocyanato) dioxotetrakis(urea) neptunium * hemi(urea) (Np O2 (N C S) (O C (N H2)2)4)2 * O C (N H2)2","Doklady Akad. Nauk","2000","375","","778","781","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525580","14.259","","14.234","","14.238","","90","","90","","90","","2889.78","","","","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Na Zn (P O3)3","","- Na O9 P3 Zn -","- Na O9 P3 Zn -","- Na16 O144 P48 Zn16 -","16","2","","Aouad, H.; Maazaz, M.; Belharouak, I.","Crystal structure and luminescence properties of silver(I) doped polyphosphate Na Zn (P O3)3","Materials Research Bulletin","2000","35","","2457","2467","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525582","9.495","","6.716","","11.709","","90","","95.09","","90","","743.72","","","","","","","","","","","","","4","P 1 2 1","P 2y","3","","Ba5 (B20 O33 (O H)4) (H2 O)","","- B20 Ba5 H6 O38 -","- B20 Ba5 H4 O38 -","- B20 Ba5 H4 O38 -","1","0.5","","Arakcheeva, A.V.; Vinogradova, S.A.; Pushcharovskii, D.Yu.; Hostettler, M.; Chapuis, G.; Dimitrova, O.V.","New boron-oxygen layer in the structure of barium hydrodecaborate Ba5 (B20 O33 (O H)4) * (H2 O)","Kristallografiya","2000","45","","448","451","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525584","7.861","","12.415","","10.569","","90","","110.78","","90","","964.376","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","K Sm (P4 O12)","","- K O12 P4 Sm -","- K O12 P4 Sm -","- K4 O48 P16 Sm4 -","4","0.5","","Arbi, K.; Ben Hassan-Chehimi, D.; Trabelsi-Ayadi, M.; Silvestre, J.P.","Structure refinement of potassium-samarium cyclotetraphosphate K Sm P4 O12","Materials Research Bulletin","2000","35","","1533","1539","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525585","10.5036","","10.5036","","10.5036","","90","","90","","90","","1158.82","","","","","","","","","","","","","4","I -4 3 d","I -4bd 2c 3","220","","Ba3 Bi (P O4)3","","- Ba3 Bi O12 P3 -","- Ba3 Bi O12 P3 -","- Ba12 Bi4 O48 P12 -","4","0.0833333","","Arbib, E.H.; Elouadi, B.; Chaminade, J.P.; Darriet, J.","The crystal structure of the phosphate eulytite Ba3 Bi (P O4)3","Materials Research Bulletin","2000","35","","761","773","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525586","15.569","","15.569","","11.841","","90","","90","","90","","2870.19","","","","","","","","","","","","","7","P 4 n c","P 4 -2n","104","","Ca19 Al10.144 Mg Fe1.821 Si18 O69 (O H)9","","- Al10.144 Ca19 Fe1.821 H9 Mg O78 Si18 -","- Al10.144 Ca19 Fe1.821 H9 Mg O78 Si18 -","- Al20.288 Ca38 Fe3.642 H18 Mg2 O156 Si36 -","2","0.25","","Armbruster, T.; Gnos, E.","""Rod"" polytypism in vesuvianite: crystal structure of a low-temperature P4nc vesuvianite with pronounced octahderal cation ordering","Schweizerische Mineralogische und Petrographische Mitteilungen","2000","80","","109","116","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525587","7.84","","7.84","","7.84","","90","","90","","90","","481.89","","","","","","","","","","","","","4","F m -3 m","-F 4 2 3","225","","Sr2 Cr Mo O6","","- Cr Mo O6 Sr2 -","- Cr Mo O6 Sr2 -","- Cr4 Mo4 O24 Sr8 -","4","0.0208333","","Arulraj, A.; Ramesha, K.; Gopalakrishnan, J.; Rao, C.N.R.","Magnetoresistance in the double perovskite Sr2 Cr Mo O6","Journal of Solid State Chemistry","2000","155","","233","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525588","7.899","","7.899","","7.899","","90","","90","","90","","492.852","","","","","","","","","","","","","4","F m -3 m","-F 4 2 3","225","","Sr2 Fe Mo O6","","- Fe Mo O6 Sr2 -","- Fe Mo O6 Sr2 -","- Fe4 Mo4 O24 Sr8 -","4","0.0208333","","Arulraj, A.; Rao, C.N.R.; Gopalakrishnan, J.; Ramesha, K.","Magnetoresistance in the double perovskite Sr2 Cr Mo O6","Journal of Solid State Chemistry","2000","155","","233","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525589","5.503","","7.138","","24.78799","","90","","90","","90","","973.683","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","S C (N H2)2","","- C H4 N2 S -","- C H4 N2 S -","- C12 H48 N24 S12 -","12","1.5","","Asahi, T.; Onodera, A.; Hasebe, K.","Crystal structure of the high pressure phase VI of thiourea","Journal of the Physical Society of Japan","2000","69","","2895","2899","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525590","13.85","","13.85","","18.493","","90","","90","","120","","3072.12","","","","","","","","","","","","","5","P -3 c 1","-P 3 2""c","165","","Na4.11 (In8 (H P O4)14 (H2 O)6) (H2 O)12.03","","- H50.06 In8 Na4.11 O74.03 P14 -","- H25.998 In8 Na4.11 O74.03 P14 -","- H51.996 In16 Na8.22 O148.06 P28 -","2","0.166667","","Attfield, M.P.; Cheetham, A.K.; Natarajan, S.","The direct synthesis and characterization of the pillared layer indium phosphate Na4 (In8 (H P O4)14 (H2 O)6) * 12(H2 O)","Materials Research Bulletin","2000","35","","1007","1015","","","","","","","","","","","","","","","","","","","","","","has coordinates","146607","2020-10-21","18:00:00",""
"1525592","3.8261","","3.88536","","11.69967","","90","","90","","90","","173.925","","","","","","","","","","","","","5","P m m m","-P 2 2","47","","(Er0.91 Ca0.09) Ba2 Cu3 O6.92","","- Ba2 Ca0.09 Cu3 Er0.91 O6.92 -","- Ba2 Ca0.092 Cu3 Er0.908 O6.916 -","- Ba2 Ca0.092 Cu3 Er0.908 O6.916 -","1","0.125","","Awana, V.P.S.; Malik, S.K.; Yelon, W.B.; Cardoso, C.A.; de Lima, O.F.; Gupta, A.; Narlikar, A.V.; Sedky, A.","Neutron diffraction on Er1-x Cax Ba2 Cu3 O7-d (0.0<x<0.3) system: possible oxygen vacancies in Cu-O2 planes","Physica C (Amsterdam)","2000","338","","197","204","","","","","","","","","","","","","","","","","","","","","","has coordinates","146609","2020-10-21","18:00:00",""
"1525593","3.82713","","3.88389","","11.70076","","90","","90","","90","","173.922","","","","","","","","","","","","","5","P m m m","-P 2 2","47","","(Er0.85 Ca0.15) Ba2 Cu3 O6.79","","- Ba2 Ca0.15 Cu3 Er0.85 O6.79 -","- Ba2 Ca0.152 Cu3 Er0.848 O6.794 -","- Ba2 Ca0.152 Cu3 Er0.848 O6.794 -","1","0.125","","Awana, V.P.S.; Malik, S.K.; Narlikar, A.V.; Yelon, W.B.; Cardoso, C.A.; Sedky, A.; de Lima, O.F.; Gupta, A.","Neutron diffraction on Er1-x Cax Ba2 Cu3 O7-d (0.0<x<0.3) system: possible oxygen vacancies in Cu-O2 planes","Physica C (Amsterdam)","2000","338","","197","204","","","","","","","","","","","","","","","","","","","","","","has coordinates","146610","2020-10-21","18:00:00",""
"1525594","3.82713","","3.88389","","11.70076","","90","","90","","90","","173.922","","","","","","","","","","","","","5","P m m m","-P 2 2","47","","(Er0.71 Ca0.29) Ba2 Cu3 O6.74","","- Ba2 Ca0.29 Cu3 Er0.71 O6.74 -","- Ba2 Ca0.291 Cu3 Er0.709 O6.738 -","- Ba2 Ca0.291 Cu3 Er0.709 O6.738 -","1","0.125","","Awana, V.P.S.; Cardoso, C.A.; Malik, S.K.; de Lima, O.F.; Yelon, W.B.; Gupta, A.; Narlikar, A.V.; Sedky, A.","Neutron diffraction on Er1-x Cax Ba2 Cu3 O7-d (0.0<x<0.3) system: possible oxygen vacancies in Cu-O2 planes","Physica C (Amsterdam)","2000","338","","197","204","","","","","","","","","","","","","","","","","","","","","","has coordinates","146611","2020-10-21","18:00:00",""
"1525595","5.865","","7.491","","10.021","","90","","90","","90","","440.27","","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","K Sr (V O4)","","- K O4 Sr V -","- K O4 Sr V -","- K4 O16 Sr4 V4 -","4","1","","Azrour, M.; El Ammari, L.; le Fur, Y.; Elouadi, B.","Synthesis and crystal structure of a noncentrosymmetric form of potassium strontium monovanadate K Sr V O4","Materials Research Bulletin","2000","35","","263","270","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525602","24.788","","24.788","","24.788","","90","","90","","90","","15230.9","","","","","","","","","","","","","5","F d -3 :2","-F 2uv 2vw 3","203","","Ni2 (Ni (O H))35 (Ni4 Al O4)2 (H3 O)46 (Al91 Si101 O384) (H2 O)55","","- Al93 H283 Ni45 O528 Si101 -","- Al92.8944 Ni45.0208 O527.795 Si101.002 -","- Al92.8944 Ni45.0208 O527.795 Si101.002 -","1","0.0104167","","Bae, D.H.; Seff, K.","Crystal structure of zeolite X nickel(II) exchanged at pH 4.3 and partially dehydrated, Ni2 (Ni O H)35 (Ni4 Al O4)2 (H3 O)46 Si101 Al91 O384","Microporous and Mesoporous Materials","2000","40","","219","232","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525603","24.75","","24.75","","24.75","","90","","90","","90","","15160.9","","","","","","","","","","","","","4","F d -3 :2","-F 2uv 2vw 3","203","","Zn54.6 (H3 O)37.2 (Al92 Si100 O384) (O H)54.4","","- Al91.9968 O432.8 Si100.003 Zn54.672 -","- Al91.9968 O432.8 Si100.003 Zn54.672 -","- Al91.9968 O432.8 Si100.003 Zn54.672 -","1","0.0104167","","Bae, D.H.; Seff, K.","Extensive intrazeolitic hydrolysis of Zn(II): partial structures of partially and fully hydrated Zn(II) exchanged zeolite X","Microporous and Mesoporous Materials","2000","40","","232","245","","","","","","","","","","","","","","","","","","","","","","has coordinates","146622","2020-10-21","18:00:00",""
"1525604","24.872","","24.872","","24.872","","90","","90","","90","","15386.2","","","","","","","","","","","","","4","F d -3 :2","-F 2uv 2vw 3","203","","Zn55.3 (H3 O)40 (Al92 Si100 O384) (O H)58.85","","- Al91.9968 O434.656 Si100.003 Zn55.296 -","- Al91.9968 O434.656 Si100.003 Zn55.296 -","- Al91.9968 O434.656 Si100.003 Zn55.296 -","1","0.0104167","","Bae, D.H.; Seff, K.","Extensive intrazeolitic hydrolysis of Zn(II): partial structures of partially and fully hydrated Zn(II)-exchanged zeolite X","Microporous and Mesoporous Materials","2000","40","","232","245","","","","","","","","","","","","","","","","","","","","","","has coordinates","146623","2020-10-21","18:00:00",""
"1525615","12.922","","6.262","","14.042","","90","","112.88","","90","","1046.85","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Cu9 O2 (Se O3)4 Cl6","","- Cl6 Cu9 O14 Se4 -","- Cl6 Cu9 O14 Se4 -","- Cl12 Cu18 O28 Se8 -","2","0.5","","Bastide, B.; Millet, P.; Johnsson, M.; Galy, J.","Synthesis of copper(II) and selenium(IV) oxochlorides by chemical transport reaction: crystal structure of Cu9 O2 (Se O3)4 Cl6","Materials Research Bulletin","2000","35","","847","855","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1525622","5.755","","5.755","","14.178","","90","","90","","120","","406.664","","","","","","","","","","","","","5","R 3 c :H","R 3 -2""c","161","","(Pb0.94 Sr0.06) ((Zr0.6 Ti0.4) O3)","","- O3 Pb0.94 Sr0.06 Ti0.4 Zr0.6 -","- O3 Pb0.94 Sr0.06 Ti0.4 Zr0.6 -","- O18 Pb5.64 Sr0.36 Ti2.4 Zr3.6 -","6","0.333333","","Bedoya, C.; Roubin, M.; Muller, C.; Baudour, J.L.; Anne, M.; Madigou, V.","Sr-doped Pb Zr1-x Tix O3 ceramic: structural study and fieldinduced reorientation of ferroelectric domains","Materials Science and Engineering B","2000","75","","43","52","","","","","","","","","","","","","","","","","","","","","","has coordinates","146650","2020-10-21","18:00:00",""
"1525623","4.04","","4.04","","4.123","","90","","90","","90","","67.294","","","","","","","","","","","","","5","P 4 m m","P 4 -2","99","","(Pb0.91 Sr0.06) ((Zr0.5 Ti0.5) O3)","","- O3 Pb0.91 Sr0.06 Ti0.5 Zr0.5 -","- O3 Pb0.91 Sr0.06 Ti0.5 Zr0.5 -","- O3 Pb0.91 Sr0.06 Ti0.5 Zr0.5 -","1","0.125","","Bedoya, C.; Anne, M.; Muller, C.; Baudour, J.L.; Madigou, V.; Roubin, M.","Sr-doped Pb Zr1-x Tix O3 ceramic: structural study and fieldinduced reorientation of ferroelectric domains","Materials Science and Engineering B","2000","75","","43","52","","","","","","","","","","","","","","","","","","","","","","has coordinates","146651","2020-10-21","18:00:00",""
"1525625","17.24399","","22.42899","","5.586","","90","","90.486","","90","","2160.39","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Bi2 (Mo O6)","","- Bi2 Mo O6 -","- Bi2 Mo O6 -","- Bi32 Mo16 O96 -","16","4","","Begue, P.; Enjalbert, R.; Galy, J.; Castro, A.","Single-crystal X-ray investigations of the structures of gamma(H)Bi2 Mo O6 and its partially substituted As(3+) and Sb(3+) homologues","Solid State Sciences","2000","2","","637","653","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525626","17.226","","22.42799","","5.581","","90","","90.683","","90","","2156.04","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Bi1.55 Sb0.45 (Mo O6)","","- Bi1.55 Mo O6 Sb0.45 -","- Bi1.55 Mo O6 Sb0.45 -","- Bi24.8 Mo16 O96 Sb7.2 -","16","4","","Begue, P.; Enjalbert, R.; Galy, J.; Castro, A.","Single-crystal X-ray investigations of the structures of gamma(H)Bi2 Mo O6 and its partially substituted As(3+) and Sb(3+)homologues","Solid State Sciences","2000","2","","637","653","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525627","17.19099","","22.428","","5.537","","90","","90.257","","90","","2134.82","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Bi1.65 As0.35 (Mo O6)","","- As0.35 Bi1.65 Mo O6 -","- As0.35 Bi1.65 Mo O6 -","- As5.6 Bi26.4 Mo16 O96 -","16","4","","Begue, P.; Castro, A.; Enjalbert, R.; Galy, J.","Single-crystal X-ray investigations of the structures of gamma(H)Bi2 Mo O6 and its partially substituted As(3+) and Sb(3+)homologues","Solid State Sciences","2000","2","","637","653","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525629","7.547","","12.065","","11.697","","90","","101.111","","90","","1045.1","","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Ba (N H4) (P3 O9) (H2 O)2","","- Ba H8 N O11 P3 -","- Ba H8 N O11 P3 -","- Ba4 H32 N4 O44 P12 -","4","1","","Belaaouad, S.; Sbai, K.; Pierrot, M.; Kenz, A.","Chemical preparation, thermal behaviour and crystal structure of ammonium barium cyclotriphosphate dihydrate","Materials Research Innovation","2000","3","","352","359","","","","","","","","","","","","","","","","","","","","","","has coordinates","186594","2020-10-21","18:00:00",""
"1525630","9.126","","8.157","","15.256","","90","","90","","90","","1135.67","","","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","Sr (N H4) (P3 O9) (H2 O)3","","- H10 N O12 P3 Sr -","- H10 N O12 P3 Sr -","- H40 N4 O48 P12 Sr4 -","4","0.5","","Belaaouad, S.; Sbai, K.; Jouini, A.","Chemical preparation, thermal behavior and crystal structure of a new cyclotriphosphate: Sr N H4 P3 O9 * 3(H2 O)","Solid State Sciences","2000","2","","655","661","","","","","","","","","","","","","","","","","","","","","","has coordinates","186594","2020-10-21","18:00:00",""
"1525634","10.8592","","10.8592","","38.035","","90","","90","","120","","3884.27","","","","","","","","","","","","","4","R 3 c :H","R 3 -2""c","161","","Ca9 Tb (V O4)7","","- Ca9 O28 Tb V7 -","- Ca9 O28 Tb V7 -","- Ca54 O168 Tb6 V42 -","6","0.333333","","Belik, A.A.; Kotov, R.N.; Morozov, V.A.; Khasanov, S.S.; Lazoryak, B.I.","Crystal structures of double vanadates Ca9 R (V O4)7. II. R= Tb, Dy, Ho, Y","Kristallografiya","2000","45","","432","437","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525635","10.8564","","10.8564","","38.009","","90","","90","","120","","3879.62","","","","","","","","","","","","","4","R 3 c :H","R 3 -2""c","161","","Ca9 Dy (V O4)7","","- Ca9 Dy O28 V7 -","- Ca9 Dy O28 V7 -","- Ca54 Dy6 O168 V42 -","6","0.333333","","Belik, A.A.; Morozov, V.A.; Lazoryak, B.I.; Khasanov, S.S.; Kotov, R.N.","Crystal structures of double vanadates Ca9 R (V O4)7. II. R= Tb, Dy, Ho, Y","Kristallografiya","2000","45","","432","437","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525636","10.8565","","10.8565","","37.995","","90","","90","","120","","3878.26","","","","","","","","","","","","","4","R 3 c :H","R 3 -2""c","161","","Ca9 Ho (V O4)7","","- Ca9 Ho O28 V7 -","- Ca9 Ho O28 V7 -","- Ca54 Ho6 O168 V42 -","6","0.333333","","Belik, A.A.; Morozov, V.A.; Khasanov, S.S.; Kotov, R.N.; Lazoryak, B.I.","Crystal structures of double vanadates Ca9 R (V O4)7. II. R= Tb, Dy, Ho, Y","Kristallografiya","2000","45","","432","437","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525637","10.8588","","10.8588","","37.995","","90","","90","","120","","3879.9","","","","","","","","","","","","","4","R 3 c :H","R 3 -2""c","161","","Ca9 Y (V O4)7","","- Ca9 O28 V7 Y -","- Ca8.99 O28 V7 Y1.01 -","- Ca53.94 O168 V42 Y6.06 -","6","0.333333","","Belik, A.A.; Morozov, V.A.; Khasanov, S.S.; Kotov, R.N.; Lazoryak, B.I.","Crystal structures of double vanadates Ca9 R (V O4)7. II. R= Tb, Dy, Ho, Y","Kristallografiya","2000","45","","432","437","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525638","10.872","","10.872","","38.121","","90","","90","","120","","3902.24","","","","","","","","","","","","","4","R 3 c :H","R 3 -2""c","161","","Ca9 Nd (V O4)7","","- Ca9 Nd O28 V7 -","- Ca9.01 Nd0.99 O28 V7 -","- Ca54.06 Nd5.94 O168 V42 -","6","0.333333","","Belik, A.A.; Morozov, V.A.; Grechkin, S.V.; Khasanov, S.S.; Lazoryak, B.I.","Crystal structures of double vanadates Ca9 R (V O4)7. III. R= Nd, Sm, Gd or Ce","Kristallografiya","2000","45","","798","803","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525639","10.8652","","10.8652","","38.098","","90","","90","","120","","3895.01","","","","","","","","","","","","","4","R 3 c :H","R 3 -2""c","161","","Ca9 Sm (V O4)7","","- Ca9 O28 Sm V7 -","- Ca9.001 O28 Sm0.999 V7 -","- Ca54.006 O168 Sm5.994 V42 -","6","0.333333","","Belik, A.A.; Morozov, V.A.; Khasanov, S.S.; Grechkin, S.V.; Lazoryak, B.I.","Crystal structures of double vanadates Ca9 R (V O4)7. III. R= Nd, Sm, Gd or Ce","Kristallografiya","2000","45","","798","803","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525640","10.8631","","10.8631","","38.072","","90","","90","","120","","3890.84","","","","","","","","","","","","","4","R 3 c :H","R 3 -2""c","161","","Ca9 Gd (V O4)7","","- Ca9 Gd O28 V7 -","- Ca9.001 Gd0.999 O28 V7 -","- Ca54.006 Gd5.994 O168 V42 -","6","0.333333","","Belik, A.A.; Lazoryak, B.I.; Morozov, V.A.; Khasanov, S.S.; Grechkin, S.V.","Crystal structures of double vanadates Ca9 R (V O4)7. III. R= Nd, Sm, Gd or Ce","Kristallografiya","2000","45","","798","803","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525641","10.8552","","10.8552","","38.037","","90","","90","","120","","3881.62","","","","","","","","","","","","","4","R 3 c :H","R 3 -2""c","161","","Ca9.812 Ce0.414 (V O4)7","","- Ca9.812 Ce0.414 O28 V7 -","- Ca9.812 Ce0.414 O28 V7 -","- Ca58.872 Ce2.484 O168 V42 -","6","0.333333","","Belik, A.A.; Morozov, V.A.; Lazoryak, B.I.; Grechkin, S.V.; Khasanov, S.S.","Crystal structures of double vanadates Ca9 R (V O4)7. III. R= Nd, Sm, Gd or Ce","Kristallografiya","2000","45","","798","803","","","","","","","","","","","","","","","","","","","","","","has coordinates","146669","2020-10-21","18:00:00",""
"1525642","10.8554","","10.8554","","37.967","","90","","90","","120","","3874.61","","","","","","","","","","","","","4","R 3 c :H","R 3 -2""c","161","","Ca9 Er (V O4)7","","- Ca9 Er O28 V7 -","- Ca9.019 Er0.981 O28 V7 -","- Ca54.114 Er5.886 O168 V42 -","6","0.333333","","Belik, A.A.; Dmitrienko, L.O.; Grechkin, S.V.; Morozov, V.A.; Khasanov, S.S.; Lazoryak, B.I.","Crystal structures of double vanadates Ca9 R (V O4)7. IV. R= Er, Tm, Yb and Lu","Kristallografiya","2000","45","","976","981","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525643","10.855","","10.855","","37.95","","90","","90","","120","","3872.59","","","","","","","","","","","","","4","R 3 c :H","R 3 -2""c","161","","Ca9 Tm (V O4)7","","- Ca9 O28 Tm V7 -","- Ca9 O28 Tm V7 -","- Ca54 O168 Tm6 V42 -","6","0.333333","","Belik, A.A.; Grechkin, S.V.; Dmitrienko, L.O.; Morozov, V.A.; Khasanov, S.S.; Lazoryak, B.I.","Crystal structures of double vanadates Ca9 R (V O4)7. IV. R= Er, Tm, Yb and Lu","Kristallografiya","2000","45","","976","981","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525644","10.8564","","10.8564","","37.924","","90","","90","","120","","3870.94","","","","","","","","","","","","","4","R 3 c :H","R 3 -2""c","161","","Ca9 Yb (V O4)7","","- Ca9 O28 V7 Yb -","- Ca8.998 O28 V7 Yb1.002 -","- Ca53.988 O168 V42 Yb6.012 -","6","0.333333","","Belik, A.A.; Grechkin, S.V.; Lazoryak, B.I.; Dmitrienko, L.O.; Morozov, V.A.; Khasanov, S.S.","Crystal structures of double vanadates Ca9 R (V O4)7. IV. R= Er, Tm, Yb and Lu","Kristallografiya","2000","45","","976","981","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525645","10.8566","","10.8566","","37.88","","90","","90","","120","","3866.59","","","","","","","","","","","","","4","R 3 c :H","R 3 -2""c","161","","Ca9 Lu (V O4)7","","- Ca9 Lu O28 V7 -","- Ca9.001 Lu0.999 O28 V7 -","- Ca54.006 Lu5.994 O168 V42 -","6","0.333333","","Belik, A.A.; Grechkin, S.V.; Dmitrienko, L.O.; Lazoryak, B.I.; Morozov, V.A.; Khasanov, S.S.","Crystal structures of double vanadates Ca9 R (V O4)7. IV. R= Er, Tm, Yb and Lu","Kristallografiya","2000","45","","976","981","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525646","7.424","","7.424","","7.424","","90","","90","","90","","409.18","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","Na3 (P O4)","","- Na3 O4 P -","- Na3.0048 O3.9936 P -","- Na12.0192 O15.9744 P4 -","4","0.0208333","","Belik, A.A.; Bykov, A.B.; Ivanov-Shits, A.K.; Verin, I.A.; Golubev, A.M.; Nistyuk, A.v.","Structure and electric conductivity of Na3 P O4 single crystals","Kristallografiya","2000","45","","982","986","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525647","7.8313","","9.2645","","6.2185","","107.202","","100.916","","106.408","","394.677","","","","","","","","","","","","","4","P -1","-P 1","2","","Cu3 Cr4 (P O4)6","","- Cr4 Cu3 O24 P6 -","- Cr4 Cu3 O24 P6 -","- Cr4 Cu3 O24 P6 -","1","0.5","","Belik, A.A.; Pokholok, K.V.; Khasanov, S.S.; Malakho, A.P.; Lazoryak, B.I.","Synthesis and structure of phosphates M3 R4 (P O4)6 (M = Cu, Co; R = Fe, Cr, Ga, In) and their interaction with hydrogen","Zhurnal Neorganicheskoi Khimii","2000","45","","1633","1648","","","","","","","","","","","","","","","","","","","","","","has coordinates","146675","2020-10-21","18:00:00",""
"1525648","7.9096","","9.2885","","6.3419","","108.487","","101.518","","104.666","","407.1","","","","","","","","","","","","","4","P -1","-P 1","2","","Co3 Fe4 (P O4)6","","- Co3 Fe4 O24 P6 -","- Co3 Fe4 O24 P6 -","- Co3 Fe4 O24 P6 -","1","0.5","","Belik, A.A.; Pokholok, K.V.; Malakho, A.P.; Khasanov, S.S.; Lazoryak, B.I.","Synthesis and structure of phosphates M3 R4 (P O4)6 (M = Cu, Co; R = Fe, Cr, Ga, In) and their interaction with hydrogen","Zhurnal Neorganicheskoi Khimii","2000","45","","1633","1648","","","","","","","","","","","","","","","","","","","","","","has coordinates","146676","2020-10-21","18:00:00",""
"1525649","7.8561","","9.235","","6.2785","","108.173","","101.808","","105.329","","396.379","","","","","","","","","","","","","4","P -1","-P 1","2","","Co3 Cr4 (P O4)6","","- Co3 Cr4 O24 P6 -","- Co3 Cr4 O24 P6 -","- Co3 Cr4 O24 P6 -","1","0.5","","Belik, A.A.; Pokholok, K.V.; Malakho, A.P.; Khasanov, S.S.; Lazoryak, B.I.","Synthesis and structure of phosphates M3 R4 (P O4)6 (M = Cu, Co; R = Fe, Cr, Ga, In) and their interaction with hydrogen","Zhurnal Neorganicheskoi Khimii","2000","45","","1633","1648","","","","","","","","","","","","","","","","","","","","","","has coordinates","146677","2020-10-21","18:00:00",""
"1525650","6.5079","","6.5079","","6.5079","","94.37","","94.37","","94.37","","273.094","","","","","","","","","","","","","4","R -3 :R","-P 3*","148","","Ni1.99 Mo6 (Se2.18 S5.82)","","- Mo6 Ni1.99 S5.82 Se2.18 -","- Mo6 Ni1.986 S5.82 Se2.18 -","- Mo6 Ni1.986 S5.82 Se2.18 -","1","0.166667","","Belin, S.; Chevrel, R.; Sergent, M.","Single crystal structural investigation on Niy Mo6 Se8-x Sx solid solution: a new location of nickel counterions","Journal of Solid State Chemistry","2000","155","","250","258","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1525651","6.5628","","6.5628","","6.5628","","94.055","","94.055","","94.055","","280.433","","","","","","","","","","","","","4","R -3 :R","-P 3*","148","","Ni1.85 Mo6 (Se3.46 S4.54)","","- Mo6 Ni1.85 S4.54 Se3.46 -","- Mo6 Ni1.848 S4.54 Se3.46 -","- Mo6 Ni1.848 S4.54 Se3.46 -","1","0.166667","","Belin, S.; Chevrel, R.; Sergent, M.","Single crystal structural investigation on Niy Mo6 Se8-x Sx solid solution: a new location of nickel counterions","Journal of Solid State Chemistry","2000","155","","250","258","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1525652","6.579","","6.579","","6.579","","93.875","","93.875","","93.875","","282.714","","","","","","","","","","","","","4","R -3 :R","-P 3*","148","","Ni1.82 Mo6 (Se4.11 S3.89)","","- Mo6 Ni1.82 S3.89 Se4.11 -","- Mo6 Ni1.818 S3.89 Se4.11 -","- Mo6 Ni1.818 S3.89 Se4.11 -","1","0.166667","","Belin, S.; Chevrel, R.; Sergent, M.","Single crystal structural investigation on Niy Mo6 Se8-x Sx solid solution: a new location of nickel counterions","Journal of Solid State Chemistry","2000","155","","250","258","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1525653","6.6313","","6.6313","","6.6313","","93.106","","93.106","","93.106","","290.272","","","","","","","","","","","","","4","R -3 :R","-P 3*","148","","Ni1.28 Mo6 (Se5.72 S2.28)","","- Mo6 Ni1.28 S2.28 Se5.72 -","- Mo6 Ni1.278 S2.28 Se5.72 -","- Mo6 Ni1.278 S2.28 Se5.72 -","1","0.166667","","Belin, S.; Chevrel, R.; Sergent, M.","Single crystal structural investigation on Niy Mo6 Se8-x Sx solid solution: a new location of nickel counterions","Journal of Solid State Chemistry","2000","155","","250","258","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1525654","6.7316","","6.7316","","6.7316","","91.183","","91.183","","91.183","","304.841","","","","","","","","","","","","","3","R -3 :R","-P 3*","148","","Ni1.25 Mo6 Se8","","- Mo6 Ni1.25 Se8 -","- Mo6 Ni1.248 Se8 -","- Mo6 Ni1.248 Se8 -","1","0.166667","","Belin, S.; Chevrel, R.; Sergent, M.","Single crystal structural investigation on Niy Mo6 Se8-x Sx solid solution: a new location of nickel counterions","Journal of Solid State Chemistry","2000","155","","250","258","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1525655","6.483","","6.483","","6.483","","93.59","","93.59","","93.59","","270.801","","","","","","","","","","","","","3","R -3 :R","-P 3*","148","","Mo6.41 Se2.24 S5.76","","- Mo6.41 S5.76 Se2.24 -","- Mo6.414 S5.76 Se2.24 -","- Mo6.414 S5.76 Se2.24 -","1","0.166667","","Belin, S.; Burel, L.; Chevrel, R.; Sergent, M.","Self-molybdenum intercalation: stabilization of metastable pseudo-binary Chevrel phases in Mo6 Se8 - Mo6 S8 system","Materials Research Bulletin","2000","35","","151","168","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1525656","6.553","","6.553","","6.553","","92.76","","92.76","","92.76","","280.386","","","","","","","","","","","","","3","R -3 :R","-P 3*","148","","Mo6.22 Se4.06 S3.94","","- Mo6.22 S3.94 Se4.06 -","- Mo6.216 S3.94 Se4.06 -","- Mo6.216 S3.94 Se4.06 -","1","0.166667","","Belin, S.; Burel, L.; Chevrel, R.; Sergent, M.","Self-molybdenum intercalation: stabilization of metastable pseudo-binary Chevrel phases in Mo6 Se8 - Mo6 S8 system","Materials Research Bulletin","2000","35","","151","168","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1525657","6.565","","6.565","","6.565","","93.11","","93.11","","93.11","","281.649","","","","","","","","","","","","","3","R -3 :R","-P 3*","148","","Mo6.3 Se4.16 S3.84","","- Mo6.3 S3.84 Se4.16 -","- Mo6.3 S3.84 Se4.16 -","- Mo6.3 S3.84 Se4.16 -","1","0.166667","","Belin, S.; Burel, L.; Chevrel, R.; Sergent, M.","Self-molybdenum intercalation: stabilization of metastable pseudo-binary Chevrel phases in Mo6 Se8 - Mo6 S8 system","Materials Research Bulletin","2000","35","","151","168","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1525658","6.603","","6.603","","6.603","","92.85","","92.85","","92.85","","286.783","","","","","","","","","","","","","3","R -3 :R","-P 3*","148","","Mo6.28 Se5.76 S2.24","","- Mo6.28 S2.24 Se5.76 -","- Mo6.282 S2.24 Se5.76 -","- Mo6.282 S2.24 Se5.76 -","1","0.166667","","Belin, S.; Burel, L.; Chevrel, R.; Sergent, M.","Self-molybdenum intercalation: stabilization of metastable pseudo-binary Chevrel phases in Mo6 Se8 - Mo6 S8 system","Materials Research Bulletin","2000","35","","151","168","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1525659","5.402","","5.419","","36.957","","90","","90","","90","","1081.86","","","","","","","","","","","","","6","A 2 a a","A -2a 2","37","","(Bi1.7 Pb0.3) Sr2 (Ca1.7 Bi0.3) Cu3 O10","","- Bi2 Ca1.7 Cu3 O10 Pb0.3 Sr2 -","- Bi2 Ca1.7 Cu3 O10 Pb0.3 Sr2 -","- Bi8 Ca6.8 Cu12 O40 Pb1.2 Sr8 -","4","0.5","","Bellingeri, E.; Fluekiger, R.; Grasso, G.; Gladyshevskii, R.E.; Dhalle, M.","New Bi-based high-Tc superconducting phases obtained by low-temperature fluorination","Physica C (Amsterdam)","2000","329","","267","278","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1525660","5.409","","5.407","","38.792","","90","","90","","90","","1134.53","","","","","","","","","","","","","7","A 2 a a","A -2a 2","37","","(Bi1.7 Pb0.3) Sr2 (Ca1.7 Bi0.3) Cu3 O8 F4","","- Bi2 Ca1.7 Cu3 F4 O8 Pb0.3 Sr2 -","- Bi2 Ca1.7 Cu3 F4 O8 Pb0.3 Sr2 -","- Bi8 Ca6.8 Cu12 F16 O32 Pb1.2 Sr8 -","4","0.5","","Bellingeri, E.; Dhalle, M.; Gladyshevskii, R.E.; Grasso, G.; Fluekiger, R.","New Bi-based high-Tc superconducting phases obtained by low-temperature fluorination","Physica C (Amsterdam)","2000","329","","267","278","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1525664","11.51","","11.45","","6.563","","90","","90","","90","","864.934","","","","","","","","","","","","","6","P n n 2","P 2 -2n","34","","Na0.5 Pb2 (B5 O9) Cl (O H)0.5","","- B5 Cl H0.5 Na0.5 O9.5 Pb2 -","- B5 Cl Na0.5 O9.5 Pb2 -","- B20 Cl4 Na2 O38 Pb8 -","4","1","","Belokoneva, E.L.; Stefanovich, S.Yu.; Dimitrova, O.V.; Korchemkina, T.A.","Na0.5 Pb2 (B5 O9) Cl (O H)0.5, a new polar modification of hilgardite containing Na cations in the cavities of the framework. The OD-family of the 5:(2Delta+3*(box)) pentaborates:hilgardites, heidornite, probertite and ulexite","Kristallografiya","2000","45","","814","823","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525665","10.905","","8.88","","8.78","","90","","90","","113","","782.635","","","","","","","","","","","","","3","B 1 1 2/b","-B 2b","15","","Pb3 (P O4)2","","- O8 P2 Pb3 -","- O8 P2 Pb3 -","- O32 P8 Pb12 -","4","0.5","","Belokoneva, E.L.; Gurbanova, O.A.; Dimitrova, O.V.","A new crystal structure of Pb3 (P O4)2 and its comparison with formula analogues","Zhurnal Neorganicheskoi Khimii","2000","45","","1448","1452","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1525669","5.67","","7.08","","7.9","","76.98","","82.5","","67.78","","285.675","","","","","","","","","","","","","4","P -1","-P 1","2","","Na2 Cd3 (P2 O7)2","","- Cd3 Na2 O14 P4 -","- Cd3 Na2 O14 P4 -","- Cd3 Na2 O14 P4 -","1","0.5","","Bennazha, J.; Erragh, F.; Holt, E. M.; Boukhari, A.","Identification of a new family of diphosphate compounds, A(I)2 B(II)3 (P~2~O~7~)~2~: structures of Ag~2~Co~3~(P~2~O~7~)~2~, Ag~2~Mn~3~(P~2~O~7~)~2~, and Na~2~Cd~3~(P~2~O7)~2~","Journal of Chemical Crystallography","2000","30","11","705","716","10.1023/A:1012294026877","","","","","","","","","","","","","","","","","","","","","has coordinates","174906","2020-10-21","18:00:00",""
"1525674","11.789","","13.855","","21.534","","90","","91.94","","90","","3515.27","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(Co ((O H)2 Co (N H3)4)3) (N O3)5 (O H) (H2 O)4","","- Co4 H51 N17 O26 -","- Co4 N17 O26 -","- Co16 N68 O104 -","4","1","","Bernal, I.; Cetrullo, J.; Berhane, S.","The crystal and molecular structures of two derivatives of Werner's hexol cluster cation: (Co ((O H)2 Co (N H3)4)3) (N O3)5 (O H) * 4(H2 O) (I) and (Co ((O H)2 Co (N H3)4)3) (N O3)6 * 2(H2 O) (II)","Journal of Coordination Chemistry","2000","52","","185","205","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525675","12.858","","12.475","","12.114","","98.06","","96.63","","61.71","","1691.46","","","","","","","","","","","","","4","P -1","-P 1","2","","(Co ((O H)2 Co (N H3)4)3) (N O3)6 (H2 O)2","","- Co4 H46 N18 O26 -","- Co4 N18 O26 -","- Co8 N36 O52 -","2","1","","Bernal, I.; Cetrullo, J.; Berhane, S.","The crystal and molecular structures of two derivatives of Werner's hexol cluster cation: (Co ((O H)2 Co (N H3)4)3) (N O3)5 (O H) * 4(H2 O) (I) and (Co ((O H)2 Co (N H3)4)3) (N O3)6 * 2(H2 O) (II)","Journal of Coordination Chemistry","2000","52","","185","205","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525680","8.236","","8.236","","4.0107","","90","","90","","120","","235.604","","","","","","","","","","","","","3","P -6 2 m","P -6 -2","189","","","","- Dy6 Fe Te2 -","- Dy6 Fe Te2 -","- Dy6 Fe Te2 -","1","0.0833333","","Bestaoui, N.; Corbett, J.D.; Herle, P.S.","New ternary lanthanide transition-metal tellurides: Dy6 M Te2, M = Fe, Co, Ni","Journal of Solid State Chemistry","2000","155","","9","14","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1525681","11.98","","11.98","","11.98","","90","","90","","90","","1719.37","","","","","","","","","","","","","2","P a -3","-P 2ac 2ab 3","205","","Si I4","","- I4 Si -","- I4 Si -","- I32 Si8 -","8","0.333333","","Biehl, E.; Schubert, U.","Reaktionen von Siliciummonoxid mit Muenzmetallhalogeniden","Monatshefte fuer Chemie und verwandte Teile anderer Wissenschaften (109,1978-)","2000","131","","813","818","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525688","5.3019","","5.8557","","7.4009","","90","","90","","90","","229.771","","","","","","","","","","","","","3","P b n m","-P 2c 2ab","62","","Tb (Mn O3)","","- Mn O3 Tb -","- Mn O3 Tb -","- Mn4 O12 Tb4 -","4","0.5","","Blasco, J.; Ritter, C.; Garcia, J.; Perez-Cacho, J.; de Teresa, J.M.; Ibarra, M.R.","Structural and magnetic study of Tb1-x Cax Mn O3 perovskites","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2000","62","","5609","5618","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525689","5.318","","5.5997","","7.4879","","90","","90","","90","","222.984","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","(Tb0.75 Ca0.25) (Mn O3)","","- Ca0.25 Mn O3 Tb0.75 -","- Ca0.25 Mn O3 Tb0.75 -","- Ca Mn4 O12 Tb3 -","4","0.5","","Blasco, J.; Ritter, C.; Garcia, J.; Perez-Cacho, J.; de Teresa, J.M.; Ibarra, M.R.","Structural and magnetic study of Tb1-x Cax Mn O3 perovskites","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2000","62","","5609","5618","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525690","5.2824","","5.3133","","7.4731","","90","","90","","90","","209.747","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","(Tb0.15 Ca0.85) (Mn O3)","","- Ca0.85 Mn O3 Tb0.15 -","- Ca0.85 Mn O3 Tb0.15 -","- Ca3.4 Mn4 O12 Tb0.6 -","4","0.5","","Blasco, J.; Ritter, C.; Ibarra, M.R.; de Teresa, J.M.; Garcia, J.; Perez-Cacho, J.","Structural and magnetic study of Tb1-x Cax Mn O3 perovskites","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2000","62","","5609","5618","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525691","5.3156","","5.678","","7.4297","","90","","90","","90","","224.243","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","(Tb0.85 Ca0.15) (Mn O3)","","- Ca0.15 Mn O3 Tb0.85 -","- Ca0.15 Mn O3 Tb0.85 -","- Ca0.6 Mn4 O12 Tb3.4 -","4","0.5","","Blasco, J.; Ritter, C.; Perez-Cacho, J.; de Teresa, J.M.; Garcia, J.; Ibarra, M.R.","Structural and magnetic study of Tb1-x Cax Mn O3 perovskites","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2000","62","","5609","5618","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525692","5.3266","","5.5367","","7.4628","","90","","90","","90","","220.091","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","(Tb0.67 Ca0.33) (Mn O3)","","- Ca0.33 Mn O3 Tb0.67 -","- Ca0.33 Mn O3 Tb0.67 -","- Ca1.32 Mn4 O12 Tb2.68 -","4","0.5","","Blasco, J.; Ritter, C.; Garcia, J.; de Teresa, J.M.; Perez-Cacho, J.; Ibarra, M.R.","Structural and magnetic study of Tb1-x Cax Mn O3 perovskites","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2000","62","","5609","5618","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525693","5.3175","","5.388","","7.4157","","90","","90","","90","","212.465","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","(Tb0.35 Ca0.65) (Mn O3)","","- Ca0.65 Mn O3 Tb0.35 -","- Ca0.65 Mn O3 Tb0.35 -","- Ca2.6 Mn4 O12 Tb1.4 -","4","0.5","","Blasco, J.; Perez-Cacho, J.; Ritter, C.; de Teresa, J.M.; Ibarra, M.R.; Garcia, J.","Structural and magnetic study of Tb1-x Cax Mn O3 perovskites","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2000","62","","5609","5618","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525694","5.3245","","7.4223","","5.2841","","90","","91.02","","90","","208.795","","","","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","(Tb0.15 Ca0.85) (Mn O3)","","- Ca0.85 Mn O3 Tb0.15 -","- Ca0.85 Mn O3 Tb0.15 -","- Ca3.4 Mn4 O12 Tb0.6 -","4","1","","Blasco, J.; Ritter, C.; Garcia, J.; de Teresa, J.M.; Perez-Cacho, J.; Ibarra, M.R.","Structural and magnetic study of Tb1-x Cax Mn O3 perovskites","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2000","62","","5609","5618","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525697","10.643","","7.345","","7.38","","90","","90","","90","","576.916","","","","","","","","","","","","","3","C m c m","-C 2c 2","63","","Gd3 Ru O7","","- Gd3 O7 Ru -","- Gd3 O7 Ru -","- Gd12 O28 Ru4 -","4","0.25","","Bontchev, R.P.; Jacobson, A.J.; Popov, V.N.; Gospodinov, M.M.; Skumryev, V.; Lorenz, B.; Iliev, M.N.; Litvinchuk, A.P.; Meng, R.L.","Crystal structure, electric and magnetic properties, and Raman spectroscopy of Gd3 Ru O7","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2000","62","","12235","12240","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525700","5.4759","","7.6968","","5.4031","","90","","90","","90","","227.724","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Na Mg (H1.832 F1.168)","","- F1.168 H1.832 Mg Na -","- F1.168 H1.832 Mg Na -","- F4.672 H7.328 Mg4 Na4 -","4","0.5","","Bouamrane, A.; Laval, J.P.; Soulie, J.P.; Bastide, J.P.","Structural characterization of Na Mg H2 F and Na Mg H3","Materials Research Bulletin","2000","35","","545","549","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525701","5.4634","","7.703","","5.4108","","90","","90","","90","","227.711","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Na Mg H3","","- H3 Mg Na -","- H3 Mg Na -","- H12 Mg4 Na4 -","4","0.5","","Bouamrane, A.; Laval, J.P.; Soulie, J.P.; Bastide, J.P.","Structural characterization of Na Mg H2 F and Na Mg H3","Materials Research Bulletin","2000","35","","545","549","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525704","10.7785","","4.2717","","10.1829","","90","","118.432","","90","","412.295","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","Tb2 Ru Ge2","","- Ge2 Ru Tb2 -","- Ge2 Ru Tb2 -","- Ge8 Ru4 Tb8 -","4","0.5","","Boulet, P.; Weitzer, F.; Hiebl, K.; Noel, H.","Structural chemistry, magnetic properties and electrical resistivity of the ternary germanides R2 Ru Ge2 (R = Y, La-Nd, Gd- Er)","Physik (Berlin)","2000","292","","302","319","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525706","3.5948","","3.5948","","5.1824","","90","","90","","90","","66.97","","","","","","","","","","","","","2","P 42/n m c :2","-P 4ac 2a","137","","Zr O2","","- O2 Zr -","- O2 Zr -","- O4 Zr2 -","2","0.125","","Bouvier, P.; Djurado, E.; Lucazeau, G.; Le Bihan, T.","High-pressure structural evolution of undoped tetragonal nanocrystalline zirconia","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2000","62","","8731","8737","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525707","4.925","","4.925","","4.925","","90","","90","","90","","119.459","","","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","Zr O2","","- O2 Zr -","- O2 Zr -","- O8 Zr4 -","4","0.0208333","","Bouvier, P.; Djurado, E.; Lucazeau, G.; Le Bihan, T.","High-pressure structural evolution of undoped tetragonal nanocrystalline zirconia","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2000","62","","8731","8737","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525708","6.689","","7.663","","14.216","","90","","90","","90","","728.681","","","","","","","","","","","","","4","P n 21 a","P -2ac -2n","33","","Sm3 Nb O4 S3","","- Nb O4 S3 Sm3 -","- Nb O4 S3 Sm3 -","- Nb4 O16 S12 Sm12 -","4","1","","Boyer-Candalen, C.; Meerschaut, A.; Palvadeau, P.","Crystal structure determination of the new compound Sm3 Nb O4 S3","Materials Research Bulletin","2000","35","","1593","1601","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525709","4.304","","4.304","","4.304","","90","","90","","90","","79.729","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","(Ba0.63 K0.37) (Bi O3)","","- Ba0.63 Bi K0.37 O3 -","- Ba0.62 Bi K0.38 O3 -","- Ba0.62 Bi K0.38 O3 -","1","0.0208333","","Braden, M.; Reichardt, W.; Lauriat, J.P.; Elkaim, E.; Shiryaev, S.; Barilo, S.N.","Structural distortion in superconducting Ba1-x Kx Bi O3","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2000","62","","6708","6715","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525710","6.047","","6.047","","8.552","","90","","90","","90","","312.714","","","","","","","","","","","","","4","I 4/m c m","-I 4 2c","140","","(Ba0.63 K0.37) (Bi O3)","","- Ba0.63 Bi K0.37 O3 -","- Ba0.65 Bi K0.35 O3 -","- Ba2.6 Bi4 K1.4 O12 -","4","0.125","","Braden, M.; Lauriat, J.P.; Reichardt, W.; Elkaim, E.; Shiryaev, S.; Barilo, S.N.","Structural distortion in superconducting Ba1-x Kx Bi O3","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2000","62","","6708","6715","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525713","10.72","","10.67","","7.24","","109.27","","110.14","","83.33","","733.929","","","","","","","","","","","","","3","P -1","-P 1","2","","Pb5 Al3 F19","","- Al3 F19 Pb5 -","- Al3 F19 Pb5 -","- Al6 F38 Pb10 -","2","1","","Bravic, G.; von der Muehll, R.; Ravez, J.","Crystal structure of ferroelastic Pb5 Al2.96 Cr0.04 F19 at 300 K","Journal of Solid State Chemistry","2000","155","","427","432","","","","","","","","","","","","","","","","","","","","","","has coordinates","146749","2020-10-21","18:00:00",""
"1525717","19.286","","3.523","","8.164","","90","","105.38","","90","","534.835","","","","","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","Li2 Mn (V O3)4 (H2 O)2","","- H4 Li2 Mn O14 V4 -","- Li2 Mn O14 V4 -","- Li4 Mn2 O28 V8 -","2","0.25","","Legagneur, V.; Guyomard, D.; Liao, J.-H.; An, Y.; Verbaere, A.; le Gal la Salle, A.; Piffard, Y.","Li2 Mn (V O3)4 * 2(H2 O) : synthesis, crystal structure, thermal behavior and lithium insertion/deinsertion properties","Solid State Ionics","2000","133","","161","170","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525730","6.8413","","7.078","","6.5153","","90","","103.322","","90","","306.999","","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","La (P O4)","","- La O4 P -","- La O4 P -","- La4 O16 P4 -","4","1","","Callejas, G.; Crespo, P.; Cabrera, S.; Blanco, M.; Choque, V.; Prieto, O.; Luna, I.","Simulacion de la estructura cristalina de la fase La P O4 monacita de baja temperatura a partir de difractogramas de rayos X de polvo","Revista Boliviana de Quimica","2000","17","","22","27","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525736","3.1997","","3.1997","","5.1802","","90","","90","","120","","45.93","","","","","","","","","","","","","5","P 63 m c","P 6c -2c","186","","(Cd0.25 Zn1.13 Ge0.62) (O0.76 N1.24)","","- Cd0.25 Ge0.62 N1.24 O0.76 Zn1.13 -","- Cd0.25 Ge0.62 N1.24 O0.76 Zn1.13 -","- Cd0.25 Ge0.62 N1.24 O0.76 Zn1.13 -","1","0.0833333","","Capitan, M.J.; Louis dit Picard, C.; Laurent, Y.; Odriozola, J.A.","The crystalline structure of germanium oxynitrides within the Cd Zn Ge O N family","Materials Science Forum","2000","325","","25","30","","","","","","","","","","","","","","","","","","","","","","has coordinates","146781","2020-10-21","18:00:00",""
"1525738","5.768","","6.806","","5.396","","90","","90","","90","","211.831","","","","","","","","","","","","","4","P n a 21","P 2c -2n","33","","(Cd0.8 Ge0.87) (O0.9 N1.1)","","- Cd0.8 Ge0.87 N1.1 O0.9 -","- Cd0.8 Ge0.87 N1.1 O0.9 -","- Cd3.2 Ge3.48 N4.4 O3.6 -","4","1","","Capitan, M.J.; Laurent, Y.; Louis dit Picard, C.; Odriozola, J.A.","The crystalline structure of germanium oxynitrides within the Cd Zn Ge O N family","Materials Science Forum","2000","325","","25","30","","","","","","","","","","","","","","","","","","","","","","has coordinates","146783","2020-10-21","18:00:00",""
"1525746","3.83158","","3.83158","","12.5106","","90","","90","","90","","183.668","","","","","","","","","","","","","5","P 4/n m m :2","-P 4a 2a","129","","(Nd0.6 Sr0.4) (Nd0.6 Y0.4) Cu O3.765","","- Cu Nd1.2 O3.765 Sr0.4 Y0.4 -","- Cu Nd1.2 O3.763 Sr0.4 Y0.4 -","- Cu2 Nd2.4 O7.526 Sr0.8 Y0.8 -","2","0.125","","Caruntu, G.; Archaimbault, F.; Choisnet, J.; Crespin, M.; Mouron, P.","T(*)-type substituted neodymium cuprates Nd1.2 Sr0.8-x Y(Ho, Er, Yb)x Cu O4-d","Physica C (Amsterdam)","2000","334","","15","24","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525748","3.83212","","3.83212","","12.4984","","90","","90","","90","","183.541","","","","","","","","","","","","","5","P 4/n m m :2","-P 4a 2a","129","","(Nd0.6 Sr0.4) (Nd0.6 Ho0.4) Cu O3.846","","- Cu Ho0.4 Nd1.2 O3.846 Sr0.4 -","- Cu Ho0.4 Nd1.2 O3.848 Sr0.4 -","- Cu2 Ho0.8 Nd2.4 O7.696 Sr0.8 -","2","0.125","","Caruntu, G.; Archaimbault, F.; Crespin, M.; Choisnet, J.; Mouron, P.","T(*)-type substituted neodymium cuprates Nd1.2 Sr0.8-x Y(Ho, Er, Yb)x Cu O4-d","Physica C (Amsterdam)","2000","334","","15","24","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525756","2.8154","","2.8154","","14.046","","90","","90","","120","","96.419","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Li Co0.91 O1.84","","- Co0.91 Li O1.84 -","- Co0.91 Li O1.84 -","- Co2.73 Li3 O5.52 -","3","0.0833333","","Levasseur, S.; Menetrier, M.; Suard, E.; Delmas, C.","Evidence for structural defects in non-stoichiometric HT-(Li Co O2): electrochemical, electronic properties and (7)Li NMR studies","Solid State Ionics","2000","128","","11","24","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525759","10.46","","16.981","","14.994","","90","","95.46","","90","","2651.17","","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(Ga (C2 H4 (N H2)2)3) (In3 Te7)","","- C6 H24 Ga In3 N6 Te7 -","- C6 Ga In3 N6 Te7 -","- C24 Ga4 In12 N24 Te28 -","4","1","","Li, J.; Proserpio, D.M.","Crystal structure and properties of indium telluride (Ga (en)3) In3Te7","Hua Hsueh Hsueh Pao","2000","58","","835","839","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525760","12.674","","12.674","","11.72","","90","","90","","90","","1882.59","","","","","","","","","","","","","2","P -4 21 m","P -4 2ab","113","","","","- Eu16 Sb11 -","- Eu16 Sb11 -","- Eu32 Sb22 -","2","0.25","","Chan, J.Y.; Olmstead, M.M.; Hope, H.; Kauzlarich, S.M.","Synthesis, structure, and properties of Eu16 Sb11 and Eu16 Bi11","Journal of Solid State Chemistry","2000","155","","168","176","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1525761","27.259","","6.897","","17.721","","90","","90","","90","","3331.64","","","","","","","","","","","","","5","P b c n","-P 2n 2ab","60","","Na10 Np2 (S O4)9 (H2 O)4","","- H8 Na10 Np2 O40 S9 -","- Na10 Np2 O40 S9 -","- Na40 Np8 O160 S36 -","4","0.5","","Charushnikova, I.A.; Krot, N.N.; Starikova, Z.A.","Crystal structure and spectral characteristics of double sodium neptunium(IV) sulfate","Radiokhimiya","2000","42","","36","39","","","","","","","","","","","","","","","","","","","","","","has coordinates","146811","2020-10-21","18:00:00",""
"1525762","5.4231","","5.4168","","24.25049","","90","","90","","90","","712.379","","","","","","","","","","","","","4","P b a n :2","-P 2ab 2b","50","","Sr3 (Ru2 O7 F2)","","- F2 O7 Ru2 Sr3 -","- F2 O7 Ru2 Sr3 -","- F8 O28 Ru8 Sr12 -","4","0.5","","Li, R.-K.; Greaves, C.","Double-layered ruthenate Sr3 Ru2 O7 F2 formed by fluorine insertion into Sr3 Ru2 O7","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2000","62","","3811","3815","","","","","","","","","","","","","","","","","","","","","","has coordinates","146812","2020-10-21","18:00:00",""
"1525763","14.597","","11.036","","5.663","","90","","90","","90","","912.267","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Np (S O4)2 (H2 O)4","","- H8 Np O12 S2 -","- Np O12 S2 -","- Np4 O48 S8 -","4","0.5","","Charushnikova, I.A.; Krot, N.N.; Starikova, Z.A.","Crystal and molecular structure of Np(IV) sulfate","Radiokhimiya","2000","42","","393","396","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525764","6.4334","","9.522","","11.111","","90","","92.56","","90","","679.968","","","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","Cs2 Np (S O4)3 (H2 O)2","","- Cs2 H4 Np O14 S3 -","- Cs2 Np O14 S3 -","- Cs4 Np2 O28 S6 -","2","1","","Charushnikova, I.A.; Krot, N.N.; Starikova, Z.A.","Synthesis, crystal structure and characteristics of double cesium neptunium(IV) sulfate","Radiokhimiya","2000","42","","40","44","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525769","11.758","","8.016","","8.858","","90","","90","","90","","834.885","","","","","","","","","","","","","4","P m m n :2","-P 2ab 2a","59","","(La (H2 O)9) I3","","- H18 I3 La O9 -","- I3 La O9 -","- I6 La2 O18 -","2","0.25","","Lim, K.C.; Skelton, B.W.; White, A.H.","Structural systematics of rare earth complexes. XXII. ('Maximally') hydrated rare earth iodides","Australian Journal of Chemistry","2000","53","","867","873","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525771","11.26","","7.933","","8.844","","90","","90","","90","","789.995","","","","","","","","","","","","","4","P m m n :2","-P 2ab 2a","59","","(Ho (H2 O)9) I3","","- H18 Ho I3 O9 -","- H18 Ho I3 O9 -","- H36 Ho2 I6 O18 -","2","0.25","","Lim, K.C.; Skelton, B.W.; White, A.H.","Structural systematics of rare earth complexes. XXII. ('Maximally')hydrated rare earth iodides","Australian Journal of Chemistry","2000","53","","867","873","","","","","","","","","","","","","","","","","","","","","","has coordinates","191025","2020-10-21","18:00:00",""
"1525772","11.53","","7.928","","8.907","","90","","90","","90","","814.187","","","","","","","","","","","","","4","P m m n :2","-P 2ab 2a","59","","(Sm (H2 O)9) I3","","- H18 I3 O9 Sm -","- H18 I3 O9 Sm -","- H36 I6 O18 Sm2 -","2","0.25","","Lim, K.C.; Skelton, B.W.; White, A.H.","Structural systematics of rare earth complexes. XXII. ('Maximally')hydrated rare earth iodides","Australian Journal of Chemistry","2000","53","","867","873","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525773","11.47","","7.902","","8.923","","90","","90","","90","","808.744","","","","","","","","","","","","","4","P m m n :2","-P 2ab 2a","59","","(Gd (H2 O)9) I3","","- Gd H18 I3 O9 -","- Gd H18 I3 O9 -","- Gd2 H36 I6 O18 -","2","0.25","","Lim, K.C.; Skelton, B.W.; White, A.H.","Structural systematics of rare earth complexes. XXII. ('Maximally')hydrated rare earth iodides","Australian Journal of Chemistry","2000","53","","867","873","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525774","7.781","","8.147","","7.722","","90","","110.78","","90","","457.669","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Cs (H S O4)","","- Cs H O4 S -","- Cs H O4 S -","- Cs4 H4 O16 S4 -","4","1","","Chisholm, C.R.I.; Haile, S.M.","X-ray structure refinement of Cs H S O4 in phase II","Materials Research Bulletin","2000","35","","999","1005","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525775","8.196","","12.87","","17.106","","90","","103.676","","90","","1753.23","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(Er (H2 O)8) I3 (H2 O)2","","- Er H20 I3 O10 -","- Er I3 O10 -","- Er4 I12 O40 -","4","1","","Lim, K.C.; White, A.H.; Skelton, B.W.","Structural systematics of rare earth complexes. XXII. ('Maximally')hydrated rare earth iodides","Australian Journal of Chemistry","2000","53","","867","873","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525776","3.83599","","3.83599","","11.5628","","90","","90","","90","","170.145","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","Ru Sr2 Gd Cu2 O8","","- Cu2 Gd O8 Ru Sr2 -","- Cu2 Gd O7.96 Ru Sr2 -","- Cu2 Gd O7.96 Ru Sr2 -","1","0.0625","","Chmaissem, O.; Jorgensen, J.D.; Dollar, P.; Shaked, H.; Tallon, J.L.","Crystal and magnetic structure of ferromagnetic superconducting Ru Sr2 Gd Cu2 O8","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2000","61","","6401","6407","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525777","8.162","","12.836","","17.059","","90","","103.785","","90","","1735.75","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(Lu (H2 O)8) I3 (H2 O)2","","- H20 I3 Lu O10 -","- I3 Lu O10 -","- I12 Lu4 O40 -","4","1","","Lim, K.C.; Skelton, B.W.; White, A.H.","Structural systematics of rare earth complexes. XXII. ('Maximally')hydrated rare earth iodides","Australian Journal of Chemistry","2000","53","","867","873","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525778","5.42491","","5.42491","","11.5628","","90","","90","","90","","340.289","","","","","","","","","","","","","5","P 4/m b m","-P 4 2ab","127","","Ru Sr2 Gd Cu2 O7.94","","- Cu2 Gd O7.94 Ru Sr2 -","- Cu2 Gd O7.94 Ru Sr2 -","- Cu4 Gd2 O15.88 Ru2 Sr4 -","2","0.125","","Chmaissem, O.; Jorgensen, J.D.; Shaked, H.; Tallon, J.L.; Dollar, P.","Crystal and magnetic structure of ferromagnetic superconducting Ru Sr2 Gd Cu2 O8","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2000","61","","6401","6407","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525779","7.516","","7.564","","9.468","","90","","99.212","","90","","531.323","","","","","","","","","","","","","4","P 1 2/n 1","-P 2yac","13","","(Sc (H2 O)7) Cl3","","- Cl3 H14 O7 Sc -","- Cl3 H14 O7 Sc -","- Cl6 H28 O14 Sc2 -","2","0.5","","Lim, K.C.; Skelton, B.W.; White, A.H.","Crystal structures of the 'maximally' hydrated scandium halides, Sc X3 . n(H2 O) (X = Cl, Br, I)","Australian Journal of Chemistry","2000","53","","875","878","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525781","7.714","","7.764","","9.762","","90","","98.876","","90","","577.659","","","","","","","","","","","","","4","P 1 2/n 1","-P 2yac","13","","(Sc (H2 O)7) Br3","","- Br3 H14 O7 Sc -","- Br3 O7 Sc -","- Br6 O14 Sc2 -","2","0.5","","Lim, K.C.; Skelton, B.W.; White, A.H.","Crystal structures of the 'maximally' hydrated scandium halides, ScX3 . n(H2 O) (X = Cl, Br, I)","Australian Journal of Chemistry","2000","53","","875","878","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525783","13.584","","8.216","","14.172","","90","","113.45","","90","","1451.05","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(Sc (H2 O)7) I3 (H2 O)","","- H16 I3 O8 Sc -","- H16 I3 O8 Sc -","- H64 I12 O32 Sc4 -","4","1","","Lim, K.C.; Skelton, B.W.; White, A.H.","Crystal structures of the 'maximally' hydrated scandium halides, ScX3 . n(H2 O) (X = Cl, Br, I)","Australian Journal of Chemistry","2000","53","","875","878","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525786","24.69","","24.69","","24.69","","90","","90","","90","","15050.9","","","","","","","","","","","","","6","F d -3 :2","-F 2uv 2vw 3","203","","Mn46.6 (Al92 Si100 O384) (C3 H6)31.13","","- C93.39 H186.78 Al92 Mn46.6 O384 Si100 -","- C93.408 H186.816 Al91.9968 Mn46.6 O384 Si100.003 -","- C93.408 H186.816 Al91.9968 Mn46.6 O384 Si100.003 -","1","0.0104167","","Choi, E.Y.; Kim, Y.; Seff, K.; Han, Y.W.","Structure of a cyclopropane sorption complex of dehydrated fully Mn(2+)-exchanged zeolite X","Microporous and Mesoporous Materials","2000","40","","247","255","","","","","","","","","","","","","","","","","","","","","","has coordinates","146839","2020-10-21","18:00:00",""
"1525788","5.6052","","5.6482","","7.9414","","90","","89.95","","90","","251.419","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","La (Mg0.6326 Nb0.3679) O3","","- La Mg0.6326 Nb0.3679 O3 -","- La Mg0.6326 Nb0.3679 O3 -","- La4 Mg2.5304 Nb1.4716 O12 -","4","1","","Choi, I.-K.; Cho, B.J.; Paik, J.H.; Lee, H.-J.; Ahn, B.G.; Nahm, S.; Park, H.-M.; Kim, J.S.; Byun Jae Dong","Crystal structure of La (Mg2/3 Nb1/3) O3 ceramics","Materials Research Bulletin","2000","35","","921","928","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525790","5.6052","","5.6482","","7.9414","","90","","89.95","","90","","251.419","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","La0.93 (Mg0.748 Nb0.352) O3","","- La0.93 Mg0.748 Nb0.352 O3 -","- La0.9298 Mg0.7477 Nb0.3521 O3 -","- La3.7192 Mg2.9908 Nb1.4084 O12 -","4","1","","Choi, I.-K.; Cho, B.J.; Paik, J.H.; Byun Jae Dong; Nahm, S.; Lee, H.-J.; Park, H.-M.; Kim, J.S.; Ahn, B.G.","Crystal structure of La (Mg2/3 Nb1/3) O3 ceramics","Materials Research Bulletin","2000","35","","921","928","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1525802","11.968","","11.968","","11.968","","90","","90","","90","","1714.21","","","","","","","","","","","","","4","P 41 3 2","P 4bd 2ab 3","213","","Na3 Ti (P8 O23)","","- Na3 O23 P8 Ti -","- Na3 O23 P8 Ti -","- Na12 O92 P32 Ti4 -","4","0.166667","","Chudinova, N.; Murashova, E.","Synthesis and structure of double phosphates of titanium and alkali metals","Proc. Estonian Acad. Sci. Chem.","2000","49","","29","35","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525803","5.52","","5.5252","","11.6676","","90","","90","","90","","355.851","","","","","","","","","","","","","4","C m m m","-C 2 2","65","","La (Ba1.3 La0.7) Cu3 O7.3","","- Ba1.3 Cu3 La1.7 O7.3 -","- Ba1.3 Cu3 La1.7 O7.3 -","- Ba2.6 Cu6 La3.4 O14.6 -","2","0.125","","Lin, B.N.; Lin, Y.-H.; Luo, H.M.; Lee, T.-J.; Ho, J.C.; Ku, H.C.","Crystallographic and physical properties of new orthorhombic Cu-1212 R (Ba2-x R'x) Cu3 O7+y system (R, R' = La, Pr, Nd; 0.65 < x < 1)","Physica C (Amsterdam)","2000","341","","407","410","","","","","","","","","","","","","","","","","","","","","","has coordinates","146859","2020-10-21","18:00:00",""
"1525804","5.1162","","7.9407","","15.714","","84.16","","83.92","","80.64","","624.029","","","","","","","","","","","","","4","P -1","-P 1","2","","Cs2 (Ti P4 O13)","","- Cs2 O13 P4 Ti -","- Cs2 O13 P4 Ti -","- Cs4 O26 P8 Ti2 -","2","1","","Chudinova, N.; Murashova, E.","Synthesis and structure of double phosphates of titanium and alkalimetals","Proc. Estonian Acad. Sci. Chem.","2000","49","","29","35","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525811","19.5","","19.5","","10.3","","90","","90","","120","","3391.85","","","","","","","","","","","","","2","P 6 m m","P 6 -2","183","","","","- Ta21 Te13 -","- Ta21 Te13 -","- Ta84 Te52 -","4","0.333333","","Conrad, M.; Krumeich, F.; Reich, C.; Harbrecht, B.","Hexagonal approximants of a dodecagonal tantalum telluride the crystal structure of Ta21 Te13","Materials Science and Engineering A","2000","294","","37","40","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1525822","9.1251","","9.3214","","9.661","","94.84","","108.652","","118.588","","655.242","","","","","","","","","","","","","6","P -1","-P 1","2","","Na4 (Cu ((P O2 N H)3)2) (H2 O)10","","- Cu H26 N6 Na4 O22 P6 -","- Cu H22 N6 Na4 O22 P6 -","- Cu H22 N6 Na4 O22 P6 -","1","0.5","","Correll, S.; Schnick, W.","Synthese, Kristallstruktur und Eigenschaften von Tetranatrium-bis (trimetaphosphimato) cuprat(II) decahydrat, Na4 (Cu ((P O2 N H)3)2) . 10(H2 O)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","2347","2352","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525823","14.645","","14.686","","14.111","","111.82","","93.17","","117.47","","2403.25","","","","","","","","","","","","","5","P -1","-P 1","2","","(H3 O)4 (V W12 O40 (Na (H2 O)4))2","","- H28 Na2 O92 V2 W24 -","- Na2 O92 V2 W24 -","- Na2 O92 V2 W24 -","1","0.5","","Liu, Z.-R.; Xing, Y.; Wang, E.-B.; Xu, L.; Hu, C.-W.; Peng, J.; Lin, Y.-H.; Jia, H.-Q.","A novel dimer-heteropolytungstate with a vanadium atom as the centre. Synthesis and structural characterization of (H3 O)4 (V W12O40 Na (H2 O)4)2","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","1909","1914","","","","","","","","","","","","","","","","","","","","","","has coordinates","146883","2020-10-21","18:00:00",""
"1525829","7.74476","","5.50398","","5.47351","","90","","90.091","","90","","233.319","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(La0.85 Ca0.15) (Mn O3)","","- Ca0.15 La0.85 Mn O3 -","- Ca0.15 La0.85 Mn O3 -","- Ca0.6 La3.4 Mn4 O12 -","4","1","","Lobanov, M.V.; D'yachenko, O.G.; Balagurov, A.M.; Pomjakushin, V.Yu.; Fischer, P.; Lebedev, O.I.; Abakumov, A.M.; Gutmann, M.; Antipov, E.V.; van Tendeloo, G.","Structural and magnetic properties of the colossal magnetoresistance perovskite La0.85 Ca0.15 Mn o3","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2000","61","","8941","8949","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525841","19.007","","14.115","","7.465","","90","","90","","90","","2002.74","","","","","","","","","","","","","5","I m m m","-I 2 2","71","","Ni1.92 (Al3.8 Si32.2 O72) (H2 O)18.46","","- Al3.8 H36.92 Ni1.92 O90.46 Si32.2 -","- Al3.798 Ni1.922 O90.46 Si32.202 -","- Al3.798 Ni1.922 O90.46 Si32.202 -","1","0.0625","","Dalconi, M.C.; Cruciani, G.; Alberti, A.; Ciambelli, P.; Rapacciuolo, M.T.","Ni(2+) ion sites in hydrated and dehydrated forms of Ni-exchanged zeolite ferrierite","Microporous and Mesoporous Materials","2000","39","","423","430","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525843","18.802","","14.068","","7.465","","90","","90","","90","","1974.54","","","","","","","","","","","","","5","I m m m","-I 2 2","71","","Ni1.82 (Al3.8 Si32.2 O72) (H2 O)0.68","","- Al3.8 H1.36 Ni1.82 O72.68 Si32.2 -","- Al3.798 Ni1.82 O72.68 Si32.202 -","- Al3.798 Ni1.82 O72.68 Si32.202 -","1","0.0625","","Dalconi, M.C.; Cruciani, G.; Alberti, A.; Rapacciuolo, M.T.; Ciambelli, P.","Ni(2+) ion sites in hydrated and dehydrated forms of Ni-exchanged zeolite ferrierite","Microporous and Mesoporous Materials","2000","39","","423","430","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525850","12.814","","6.408","","10.587","","90","","90","","90","","869.321","","","","","","","","","","","","","5","P n a 21","P 2c -2n","33","","K0.96 Ti0.96 Nb0.04 O (P O4)","","- K0.896 Nb0.04 O5 P Ti0.96 -","- K0.896 Nb0.04 O5 P Ti0.96 -","- K7.168 Nb0.32 O40 P8 Ti7.68 -","8","2","","Losevskaya, T.Yu.; Alekseeva, O.A.; Yanovskii, V.K.; Ivanov, S.A.; Sorokina, N.I.; Simonov, V.I.; Voronkova, V.I.; Stefanovich, S.Yu.; Eriksson, S.; Zver'kov, S.A.","Structure and properties of potassium titanyl phosphate crystals with niobium impurities","Kristallografiya","2000","45","","809","813","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525856","5.508","","5.508","","13.35","","90","","90","","120","","350.752","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","(La0.83 K0.08) (Mn O2.86)","","- K0.08 La0.83 Mn O2.86 -","- K0.08 La0.83 Mn O2.859 -","- K0.48 La4.98 Mn6 O17.154 -","6","0.166667","","Das, A.; Sahana, M.; Yusuf, S.M.; Madhav Rao, L.; Hegde, M.S.; Shivakumara, C.","Magnetic structure of sodium and potassium doped lanthanum manganites","Materials Research Bulletin","2000","35","","651","659","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525858","5.505","","5.505","","13.32","","90","","90","","120","","349.582","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","(La0.79 Na0.12) (Mn O2.81)","","- La0.79 Mn Na0.12 O2.81 -","- La0.79 Mn Na0.12 O2.811 -","- La4.74 Mn6 Na0.72 O16.866 -","6","0.166667","","Das, A.; Sahana, M.; Yusuf, S.M.; Madhav Rao, L.; Shivakumara, C.; Hegde, M.S.","Magnetic structure of sodium and potassium doped lanthanum manganites","Materials Research Bulletin","2000","35","","651","659","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525861","5.7766","","5.7837","","8.1718","","90","","90.039","","90","","273.021","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Sr2 Sb (Sb0.4 Ca0.6) O6","","- Ca0.6 O6 Sb1.4 Sr2 -","- Ca0.6 O6 Sb1.4 Sr2 -","- Ca1.2 O12 Sb2.8 Sr4 -","2","0.5","","Luhrs, C.C.; Beltran-Porter, D.; Sapina, F.; Fuertes, A.","Crystal chemistry and redox behaviour of antimony strontium calcium perovskites","International Journal of Inorganic Materials","2000","2","","483","492","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1525875","3.8634","","3.8634","","12.203","","90","","90","","90","","182.14","","","","","","","","","","","","","6","P 4/m m m","-P 4 2","123","","(Hg0.44 Ce0.31 Cu0.25) (Sr0.9 Pr0.1)2 (Pr0.52 Sr0.48) Cu2 O7","","- Ce0.31 Cu2.25 Hg0.44 O7 Pr0.72 Sr2.28 -","- Ce0.31 Cu2.25 Hg0.44 O7 Pr0.72 Sr2.28 -","- Ce0.31 Cu2.25 Hg0.44 O7 Pr0.72 Sr2.28 -","1","0.0625","","Luparev, V.V.; Kuz'micheva, G.M.","Crystal structure of (Hg, Ce, Cu) (Sr, Pr)2 (Pr, Sr) Cu2 O6+d and (Hg, vac) (Sr, Pr)2 (Pr, Sr)2 Cu3 O8+d phases","Zhurnal Strukturnoi Khimii (Issue-No. from 1981)","2000","41","","1219","1232","","","","","","","","","","","","","","","","","","","","","","has coordinates","146940","2020-10-21","18:00:00",""
"1525877","3.8464","","3.8464","","15.2615","","90","","90","","90","","225.791","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","Hg0.36 (Sr0.5 Pr0.5)2 (Pr0.63 Sr0.37)2 Cu3 O9.36","","- Cu3 Hg0.36 O9.36 Pr2.26 Sr1.74 -","- Cu3 Hg0.36 O9.36 Pr2.26 Sr1.74 -","- Cu3 Hg0.36 O9.36 Pr2.26 Sr1.74 -","1","0.0625","","Luparev, V.V.; Kuz'micheva, G.M.","Crystal structure of (Hg, Ce, Cu) (Sr, Pr)2 (Pr, Sr) Cu2 O6+d and (Hg, vac) (Sr, Pr)2 (Pr, Sr)2 Cu3 O8+d phases","Zhurnal Strukturnoi Khimii (Issue-No. from 1981)","2000","41","","1219","1232","","","","","","","","","","","","","","","","","","","","","","has coordinates","146942","2020-10-21","18:00:00",""
"1525879","3.8294","","3.8567","","15.2763","","90","","90","","90","","225.613","","","","","","","","","","","","","5","P m m m","-P 2 2","47","","Hg0.29 (Sr0.67 Pr0.33)2 (Pr0.61 Sr0.39)2 Cu3 O9.32","","- Cu3 Hg0.29 O9.32 Pr1.88 Sr2.12 -","- Cu3 Hg0.29 O9.32 Pr1.88 Sr2.12 -","- Cu3 Hg0.29 O9.32 Pr1.88 Sr2.12 -","1","0.125","","Luparev, V.V.; Kuz'micheva, G.M.","Crystal structure of (Hg, Ce, Cu) (Sr, Pr)2 (Pr, Sr) Cu2 O6+d and (Hg, vac) (Sr, Pr)2 (Pr, Sr)2 Cu3 O8+d phases","Zhurnal Strukturnoi Khimii (Issue-No. from 1981)","2000","41","","1219","1232","","","","","","","","","","","","","","","","","","","","","","has coordinates","146944","2020-10-21","18:00:00",""
"1525881","3.8294","","3.8567","","15.2763","","90","","90","","90","","225.613","","","","","","","","","","","","","5","P m m m","-P 2 2","47","","Hg0.29 (Sr0.61 Pr0.39)2 (Pr0.51 Sr0.49)2 Cu3 O9","","- Cu3 Hg0.29 O9 Pr1.8 Sr2.2 -","- Cu3 Hg0.29 O9 Pr1.8 Sr2.2 -","- Cu3 Hg0.29 O9 Pr1.8 Sr2.2 -","1","0.125","","Luparev, V.V.; Kuz'micheva, G.M.","Crystal structure of (Hg, Ce, Cu) (Sr, Pr)2 (Pr, Sr) Cu2 O6+d and (Hg, vac) (Sr, Pr)2 (Pr, Sr)2 Cu3 O8+d phases","Zhurnal Strukturnoi Khimii (Issue-No. from 1981)","2000","41","","1219","1232","","","","","","","","","","","","","","","","","","","","","","has coordinates","146946","2020-10-21","18:00:00",""
"1525892","17.764","","17.764","","17.764","","90","","90","","90","","5605.6","","","","","","","","","","","","","5","P 41 3 2","P 4bd 2ab 3","213","","(C (N H2)3)2 (S O4)","","- C2 H12 N6 O4 S -","- C2 H12 N6 O4 S -","- C40 H240 N120 O80 S20 -","20","0.833333","","Dera, P.; Katrusiak, A.; Szafranski, M.","Structures of diguanidinium sulfate and guanidinium hydrogen sulfate","Polish Journal of Chemistry","2000","74","","1637","1644","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525894","8.121","","5.0255","","14.659","","90","","91.107","","90","","598.153","","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(C (N H2)3) (H S O4)","","- C H7 N3 O4 S -","- C H7 N3 O4 S -","- C4 H28 N12 O16 S4 -","4","1","","Dera, P.; Katrusiak, A.; Szafranski, M.","Structures of diguanidinium sulfate and guanidinium hydrogen sulfate","Polish Journal of Chemistry","2000","74","","1637","1644","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525895","9.504","","11.459","","4.994","","90","","91.49","","90","","543.694","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Li In (Mo O4)2","","- In Li Mo2 O8 -","- In Li Mo2 O8 -","- In4 Li4 Mo8 O32 -","4","0.5","","Maczka, M.; Hanuza, J.; Pietraszko, A.","Vibrational and X-ray studies of the polymorphic forms of Li In (Mo O4)2","Journal of Solid State Chemistry","2000","154","","498","506","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525896","7.81935","","7.83789","","7.91329","","90","","90","","90","","484.983","","","","","","","","","","","","","3","C m m m","-C 2 2","65","","","","- La0.333 Nb O3 -","- La0.3335 Nb O3 -","- La2.668 Nb8 O24 -","8","0.5","","Dilanian, R.A.; Yamamoto, A.; Kamiyama, T.; Izumi, F.","Crystal structures and resistivities of La1/3 Lix Nb O3","Molecular Crystals and Liquid Crystals","2000","341","","225","230","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1525897","7.82325","","7.84208","","7.91954","","90","","90","","90","","485.868","","","","","","","","","","","","","4","C m m m","-C 2 2","65","","","","- La0.333 Li0.075 Nb O3 -","- La0.3335 Li0.075 Nb O3 -","- La2.668 Li0.6 Nb8 O24 -","8","0.5","","Dilanian, R.A.; Yamamoto, A.; Kamiyama, T.; Izumi, F.","Crystal structures and resistivities of La1/3 Lix Nb O3","Molecular Crystals and Liquid Crystals","2000","341","","225","230","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1525898","6.856","","24.797","","7.135","","90","","98.79","","90","","1198.76","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","K6 (U O2)5 (V O4)2 O5","","- K6 O23 U5 V2 -","- K6 O23 U5 V2 -","- K12 O46 U10 V4 -","2","0.5","","Dion, C.; Obbade, S.; Raekelboom, E.; Abraham, F.; Saadi, M.","Synthesis, crystal structure, and comparison of two new uranyl vanadate layered compounds: M6 (U O2)5 (V O4)2 O5 with M = Na, K","Journal of Solid State Chemistry","2000","155","","342","353","","","","","","","","","","","","","","","","","","","","","","has coordinates","146967","2020-10-21","18:00:00",""
"1525899","12.584","","24.36","","7.05","","90","","100.61","","90","","2124.2","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Na6 (U O2)5 (V O4)2 O5","","- Na6 O23 U5 V2 -","- Na6 O23 U5 V2 -","- Na24 O92 U20 V8 -","4","1","","Dion, C.; Obbade, S.; Raekelboom, E.; Saadi, M.; Abraham, F.","Synthesis, crystal structure, and comparison of two new uranyl vanadate layered compounds: M6 (U O2)5 (V O4)2 O5 with M = Na, K","Journal of Solid State Chemistry","2000","155","","342","353","","","","","","","","","","","","","","","","","","","","","","has coordinates","146969","2020-10-21","18:00:00",""
"1525900","9.7505","","9.7505","","9.3094","","90","","90","","120","","766.489","","","","","","","","","","","","","3","R -3 :H","-R 3","148","","Y6 O6 (W O6)","","- O12 W Y6 -","- O12 W Y6 -","- O36 W3 Y18 -","3","0.166667","","Diot, N.; Benard-Rocherulle, P.; Marchand, R.","X-ray powder diffraction data and Rietveld refinement for Ln6 W O12(Ln = Y, Ho)","Powder Diffraction","2000","15","","220","226","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525901","9.7583","","9.7583","","9.3142","","90","","90","","120","","768.112","","","","","","","","","","","","","3","R -3 :H","-R 3","148","","Ho6 O6 (W O6)","","- Ho6 O12 W -","- Ho6 O12 W -","- Ho18 O36 W3 -","3","0.166667","","Diot, N.; Benard-Rocherulle, P.; Marchand, R.","X-ray powder diffraction data and Rietveld refinement for Ln6 W O12(Ln = Y, Ho)","Powder Diffraction","2000","15","","220","226","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525903","13.982","","8.041","","9.21","","90","","98.833","","90","","1023.19","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","(N H4)2 (Mo3 O10)","","- H8 Mo3 N2 O10 -","- Mo3 N2 O10 -","- Mo12 N8 O40 -","4","0.5","","Dittmann, M.; Schweda, E.","In situ Untersuchungen der Reaktion von Ammoniummonomolybdat, (N H4)2 Mo O4, mit Ammoniak: die Struktur von (N H4)2 (Mo3 O10)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","569","573","","","","","","","","","","","","","","","","","","","","","","has coordinates","146976","2020-10-21","18:00:00",""
"1525907","4.32","","7.17","","7.5","","90","","90","","90","","232.308","","","","","","","","","","","","","3","I m m 2","I 2 -2","44","","U Pt Ge","","- Ge Pt U -","- Ge Pt U -","- Ge4 Pt4 U4 -","4","0.5","","Mannix, D.; Kawamata, S.; Coad, S.; Lander, G.H.; Brown, P.J.; Paixao, J.A.; Yamaguchi, Y.; Rebizant, J.; Langridge, S.","Neutron and synchrotron diffraction study of U Pt Ge","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2000","62","","3801","3809","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525918","5.5165","","5.519","","25.081","","90","","90","","90","","763.605","","","","","","","","","","","","","4","A 21 a m","A -2 2a","36","","Sr (Bi2 Ta2 O9)","","- Bi2 O9 Sr Ta2 -","- Bi2 O9 Sr Ta2 -","- Bi8 O36 Sr4 Ta8 -","4","0.5","","Marquart, R.; Kennedy, B.J.; Kubota, Y.; Nishibori, E.; Takata, M.","Structural studies of cation disorder in the ferroelectric oxide Sr Bi2 Ta2 O9","Ferroelectrics","2000","248","","27","32","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525924","20.10139","","19.90489","","13.3991","","90","","90","","90","","5361.19","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","(Ti2.48 Si93.52) O192","","- O192 Si93.52 Ti2.48 -","- O192 Si93.52 Ti2.48 -","- O192 Si93.52 Ti2.48 -","1","0.125","","Marra, G.L.; Artioli, G.; Fitch, A.N.; Milanesio, M.; Lamberti, C.","Orthorhombic to monoclinic phase transition in high-Ti-loaded TS-1:an attempt to locate Ti in the MFI framework by low temperature XRD","Microporous and Mesoporous Materials","2000","40","","85","94","","","","","","","","","","","","","","","","","","","","","","has coordinates","147004","2020-10-21","18:00:00",""
"1525925","5.533","","6.942","","9.44","","105.58","","97.03","","108.32","","322.975","","","","","","","","","","","","","4","P -1","-P 1","2","","Na2 Pb P2 O7","","- Na2 O7 P2 Pb -","- Na2 O7 P2 Pb -","- Na4 O14 P4 Pb2 -","2","1","","Dridi, N.; Boukhari, A.; Reau, J.M.; Holt, E.M.; Arbib, E.","Crystal structure and ionic conductivity of crystalline and glassy Na2 Pb P2 O7","Solid State Ionics","2000","127","","141","149","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525926","19.88849","","20.09509","","13.3928","","90","","90.264","","90","","5352.52","","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(Ti2.09 Si93.91) O192","","- O192 Si93.91 Ti2.09 -","- O192 Si93.888 Ti2.112 -","- O192 Si93.888 Ti2.112 -","1","0.25","","Marra, G.L.; Artioli, G.; Fitch, A.N.; Milanesio, M.; Lamberti, C.","Orthorhombic to monoclinic phase transition in high-Ti-loaded TS-1:an attempt to locate Ti in the MFI framework by low temperature XRD","Microporous and Mesoporous Materials","2000","40","","85","94","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1525932","22.99","","10.293","","9.323","","90","","90","","90","","2206.16","","","","","","","","","","","","","4","P n a 21","P 2c -2n","33","","(N H3)2 B12 H10 (H2 O)0.5","","- B12 H17 N2 O0.5 -","- B12 N2 O0.5 -","- B96 N16 O4 -","8","2","","Dudenkov, I.V.; Zhizhin, K.Yu.; Goeva, L.V.; Chernyavskii, A.S.; Katser, S.B.; Sergienko, V.S.; Solntsev, K.A.; Kuznetsov, N.T.","Synthesis and crystal structure of 1,7-(N H3)2 B12 H10 * 0.5(H2 O)","Zhurnal Neorganicheskoi Khimii","2000","45","","2016","2019","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525936","5.3051","","7.4734","","5.2793","","90","","90","","90","","209.309","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","(Sm0.1 Ca0.9) (Mn O3)","","- Ca0.9 Mn O3 Sm0.1 -","- Ca0.9 Mn O3 Sm0.1 -","- Ca3.6 Mn4 O12 Sm0.4 -","4","0.5","","Martin, C.; Andre, G.; Maignan, A.; Hervieu, M.; Raveau, B.; Savosta, M.M.; Jirak, Z.; Trounov, V.; Kurbakov, A.; Bouree, F.","Structural study of the electron-doped manganites Sm0.1 Ca0.9 Mn O3 and Pr0.1 Sr0.9 Mn O3","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2000","62","","6442","6449","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525938","3.8195","","3.8195","","3.8195","","90","","90","","90","","55.721","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","(Pr0.1 Sr0.9) (Mn O3)","","- Mn O3 Pr0.1 Sr0.9 -","- Mn O3 Pr0.1 Sr0.9 -","- Mn O3 Pr0.1 Sr0.9 -","1","0.0208333","","Martin, C.; Andre, G.; Hervieu, M.; Maignan, A.; Jirak, Z.; Raveau, B.; Kurbakov, A.; Savosta, M.M.; Bouree, F.; Trounov, V.","Structural study of the electron-doped manganites Sm0.1 Ca0.9 Mn O3and Pr0.1 Sr0.9 Mn O3","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2000","62","","6442","6449","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525940","5.3605","","5.3605","","7.7099","","90","","90","","90","","221.544","","","","","","","","","","","","","4","I 4/m c m","-I 4 2c","140","","(Pr0.1 Sr0.9) (Mn O3)","","- Mn O3 Pr0.1 Sr0.9 -","- Mn O3 Pr0.1 Sr0.9 -","- Mn4 O12 Pr0.4 Sr3.6 -","4","0.125","","Martin, C.; Maignan, A.; Hervieu, M.; Andre, G.; Jirak, Z.; Bouree, F.; Raveau, B.; Kurbakov, A.; Trounov, V.; Savosta, M.M.","Structural study of the electron-doped manganites Sm0.1 Ca0.9 Mn O3and Pr0.1 Sr0.9 Mn O3","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2000","62","","6442","6449","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525943","5.7555","","5.7555","","11.524","","90","","90","","90","","381.741","","","","","","","","","","","","","3","P -4 2 c","P -4 2c","112","","","","- Cu0.79 In2.04 Se3.6 -","- Cu0.79 In2.04 Se3.6 -","- Cu1.58 In4.08 Se7.2 -","2","0.25","","Martin de Vidales, J.L.; Charbonnier, H.; Rueda, F.; Diaz, R.; Merino, J.M.; Leon, M.","Structural properties of Cu In3 Se5 and influence of growth conditions","Japanese Journal of Applied Physics, Part 1","2000","39","","336","338","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1525945","5.7533","","5.7533","","11.519","","90","","90","","90","","381.284","","","","","","","","","","","","","3","P -4 2 c","P -4 2c","112","","","","- Cu0.78 In2.05 Se3.6 -","- Cu0.78 In2.05 Se3.6 -","- Cu1.56 In4.1 Se7.2 -","2","0.25","","Martin de Vidales, J.L.; Charbonnier, H.; Leon, M.; Diaz, R.; Merino, J.M.; Rueda, F.","Structural properties of Cu In3 Se5 and influence of growth conditions","Japanese Journal of Applied Physics, Part 1","2000","39","","336","338","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1525947","5.7513","","5.7513","","11.519","","90","","90","","90","","381.019","","","","","","","","","","","","","3","P -4 2 c","P -4 2c","112","","","","- Cu0.61 In2 Se3.6 -","- Cu0.61 In2 Se3.6 -","- Cu1.22 In4 Se7.2 -","2","0.25","","Martin de Vidales, J.L.; Charbonnier, H.; Diaz, R.; Leon, M.; Merino, J.M.; Rueda, F.","Structural properties of Cu In3 Se5 and influence of growth conditions","Japanese Journal of Applied Physics, Part 1","2000","39","","336","338","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1525948","5.7506","","5.7506","","11.519","","90","","90","","90","","380.926","","","","","","","","","","","","","3","P -4 2 c","P -4 2c","112","","","","- Cu0.65 In1.99 Se3.6 -","- Cu0.65 In1.99 Se3.6 -","- Cu1.3 In3.98 Se7.2 -","2","0.25","","Martin de Vidales, J.L.; Charbonnier, H.; Diaz, R.; Merino, J.M.; Leon, M.; Rueda, F.","Structural properties of Cu In3 Se5 and influence of growth conditions","Japanese Journal of Applied Physics, Part 1","2000","39","","336","338","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1525949","5.7519","","5.7519","","11.52","","90","","90","","90","","381.132","","","","","","","","","","","","","3","P -4 2 c","P -4 2c","112","","","","- Cu0.57 In1.977 Se3.6 -","- Cu0.57 In1.977 Se3.6 -","- Cu1.14 In3.954 Se7.2 -","2","0.25","","Martin de Vidales, J.L.; Charbonnier, H.; Rueda, F.; Merino, J.M.; Diaz, R.; Leon, M.","Structural properties of Cu In3 Se5 and influence of growth conditions","Japanese Journal of Applied Physics, Part 1","2000","39","","336","338","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1525951","5.7553","","5.7553","","11.525","","90","","90","","90","","381.748","","","","","","","","","","","","","3","P -4 2 c","P -4 2c","112","","","","- Cu0.78 In2.078 Se3.6 -","- Cu0.78 In2.078 Se3.6 -","- Cu1.56 In4.156 Se7.2 -","2","0.25","","Martin de Vidales, J.L.; Charbonnier, H.; Diaz, R.; Merino, J.M.; Leon, M.; Rueda, F.","Structural properties of Cu In3 Se5 and influence of growth conditions","Japanese Journal of Applied Physics, Part 1","2000","39","","336","338","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1525952","9.07","","9.07","","9.07","","90","","90","","90","","746.143","","","","","","","","","","","","","5","P -4 3 n","P -4n 2 3","218","","(Pb2 (O H) (H2 O)3) (Al3 Si3 O12)","","- Al3 H7 O16 Pb2 Si3 -","- Al3 O16 Pb2 Si3 -","- Al6 O32 Pb4 Si6 -","2","0.0833333","","Eiden-Assmann, S.; Engelhardt, G.; Behrens, P.; Schneider, A.M.; Wiebcke, M.; Felsche, J.","Lead hydro sodalite (Pb2 (O H) (H2 O)3)2 (Al3 Si3 O12)2 : synthesis and structure determination by combining X-ray Rietveld refinement, (1)H MAS NMR, FTIR and XANES spectroscopy","Chemistry - A European Journal","2000","6","","292","297","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525953","14.245","","14.245","","29.959","","90","","90","","120","","5264.81","","","","","","","","","","","","","15","R 3 m :H","R 3 -2""","160","","(Ca4.85 Mn0.85 La0.3) Zr3 (Si1.3 Nb0.7) (Fe1.983 Mn0.67 Ti0.192 Zr0.105 Hf0.045) (Sr1.80 Na12.96 K0.24) (Si24 O72) (O H)3.92 Cl1.1 (H2 O)1.1","","- Ca4.85 Cl1.1 Fe1.983 H6.12 Hf0.045 K0.24 La0.3 Mn1.52 Na12.96 Nb0.7 O77.02 Si25.3 Sr1.8 Ti0.192 Zr3.105 -","- Ca4.8498 Cl1.1 Fe1.983 Hf0.045 K0.24 La0.3 Mn1.5222 Na12.96 Nb0.7 O77.02 Si25.3 Sr1.8 Ti0.192 Zr3.105 -","- Ca14.5494 Cl3.3 Fe5.949 Hf0.135 K0.72 La0.9 Mn4.5666 Na38.88 Nb2.1 O231.06 Si75.9 Sr5.4 Ti0.576 Zr9.315 -","3","0.166667","","Ekimenkova, I.A.; Rastsvetaeva, R.K.; Khomyakov, A.P.","Refinement of the crystal structure of a Fe,Sr - analog of kentbrooksite","Kristallografiya","2000","45","","1010","1013","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525954","5.3101","","5.3101","","18.02759","","90","","90","","90","","508.327","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","(Bi0.395 Co0.105) Sr2.5 Co O4.89","","- Bi0.395 Co1.105 O4.89 Sr2.5 -","- Bi0.395 Co1.105 O4.892 Sr2.5 -","- Bi1.58 Co4.42 O19.568 Sr10 -","4","0.125","","Masset, A.C.; Toulemonde, O.; Pelloquin, D.; Suard, E.; Maignan, A.; Hervieu, M.; Studer, F.; Michel, C.","(Bi0.4 Sr0.45 Co0.15) Sr2 Co O5-d : a new 1201-type oxygen dependent series of cobaltites","International Journal of Inorganic Materials","2000","2","","687","699","","","","","","","","","","","","","","","","","","","","","","has coordinates","147039","2020-10-21","18:00:00",""
"1525956","7.3722","","7.5911","","18.2233","","90","","90","","90","","1019.83","","","","","","","","","","","","","4","P n n n :2","-P 2ab 2bc","48","","(Bi0.395 Co0.105) Sr2.5 Co O4.498","","- Bi0.395 Co1.105 O4.498 Sr2.5 -","- Bi0.395 Co1.105 O4.498 Sr2.5 -","- Bi3.16 Co8.84 O35.984 Sr20 -","8","1","","Masset, A.C.; Studer, F.; Toulemonde, O.; Suard, E.; Pelloquin, D.; Maignan, A.; Hervieu, M.; Michel, C.","(Bi0.4 Sr0.45 Co0.15) Sr2 Co O5-d : a new 1201-type oxygen dependent series of cobaltites","International Journal of Inorganic Materials","2000","2","","687","699","","","","","","","","","","","","","","","","","","","","","","has coordinates","147041","2020-10-21","18:00:00",""
"1525959","5.1192","","11.8822","","12.9827","","90","","90","","90","","789.703","","","","","","","","","","","","","4","P b c m","-P 2c 2b","57","","Tl Zn (P O3)3","","- O9 P3 Tl Zn -","- O9 P3 Tl Zn -","- O36 P12 Tl4 Zn4 -","4","0.5","","El Abiad, A.; Gravereau, P.; Es-Sakhi, B.; Mesnaoui, M.; Belharouak, I.; Maazaz, M.; Parent, C.; Wallez, G.; le Flem, G.","The structure and luminescent properties of Tl Zn (P O3)3","Journal of Solid State Chemistry","2000","154","","584","590","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525961","9.3249","","9.3249","","6.9213","","90","","90","","120","","521.203","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","(Ca3.36 Na0.08) (Ca5.04 Na0.72) (P O4)3.6 (C O3)2.4 (O H)2","","- C2.4 H2 Ca8.4 Na0.8 O23.6 P3.6 -","- C2.4 Ca8.4 Na0.798 O23.6 P3.6 -","- C2.4 Ca8.4 Na0.798 O23.6 P3.6 -","1","0.0833333","","El Feki, H.; Savariault, J.M.; Ben Salah, A.; Jemal, M.","Sodium and carbonate distribution in substituted calcium hydroxyapatite","Solid State Sciences","2000","2","","577","586","","","","","","","","","","","","","","","","","","","","","","has coordinates","147048","2020-10-21","18:00:00",""
"1525966","3.8281","","3.8871","","11.6646","","90","","90","","90","","173.572","","","","","","","","","","","","","5","P m m m","-P 2 2","47","","Y0.98 Ba2 Cu2.82 Li0.18 O6.77","","- Ba2 Cu2.82 Li0.18 O6.77 Y0.98 -","- Ba2 Cu2.82 Li0.18 O6.77 Y0.98 -","- Ba2 Cu2.82 Li0.18 O6.77 Y0.98 -","1","0.125","","Maury, F.; Bouree, F.; Nicolas-Francillon, M.; Ollitrault-Fichet, R.; Nanot, M.","Local structural changes in lithium-doped Y Ba2 Cu3 Oy","Physica C (Amsterdam)","2000","333","","121","132","","","","","","","","","","","","","","","","","","","","","","has coordinates","147053","2020-10-21","18:00:00",""
"1525968","3.8226","","3.886","","11.6737","","90","","90","","90","","173.408","","","","","","","","","","","","","5","P m m m","-P 2 2","47","","Y Ba2 Cu2.94 Li0.06 O6.91","","- Ba2 Cu2.94 Li0.06 O6.91 Y -","- Ba2 Cu2.94 Li0.06 O6.91 Y -","- Ba2 Cu2.94 Li0.06 O6.91 Y -","1","0.125","","Maury, F.; Nanot, M.; Bouree, F.; Ollitrault-Fichet, R.; Nicolas-Francillon, M.","Local structural changes in lithium-doped Y Ba2 Cu3 Oy","Physica C (Amsterdam)","2000","333","","121","132","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525969","9.7249","","9.7249","","7.19","","90","","90","","120","","588.884","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Na Pb4 (P O4)3","","- Na O12 P3 Pb4 -","- Na O12 P3 Pb4 -","- Na2 O24 P6 Pb8 -","2","0.166667","","El Koumiri, M.; Oishi, S.; Elouadi, B.; Sato, S.; El Ammari, L.","The crystal structure of the lacunar apatite Na Pb4 (P O4)3","Materials Research Bulletin","2000","35","","503","513","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525970","3.8595","","3.8595","","11.8137","","90","","90","","90","","175.974","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","Y Ba2 Cu2.88 Li0.12 O6.01","","- Ba2 Cu2.88 Li0.12 O6.01 Y -","- Ba2 Cu2.88 Li0.12 O6.008 Y -","- Ba2 Cu2.88 Li0.12 O6.008 Y -","1","0.0625","","Maury, F.; Nicolas-Francillon, M.; Bouree, F.; Ollitrault-Fichet, R.; Nanot, M.","Local structural changes in lithium-doped Y Ba2 Cu3 Oy","Physica C (Amsterdam)","2000","333","","121","132","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525971","5.9034","","5.9034","","5.9034","","90","","90","","90","","205.734","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","Pb0.91 Al0.09 F1.88","","- Al0.09 F1.88 Pb0.91 -","- Al0.09 F1.88 Pb0.91 -","- Al0.36 F7.52 Pb3.64 -","4","0.0208333","","El Omari, M.; Soubeyroux, J.L.; Reau, J.M.; Senegas, J.","Neutron diffraction study of the Pb1-x Alx F2+x solid solution","Solid State Ionics","2000","130","","133","141","","","","","","","","","","","","","","","","","","","","","","has coordinates","147058","2020-10-21","18:00:00",""
"1525974","5.051","","5.051","","8.04","","90","","90","","120","","177.64","","","","","","","","","","","","","3","P 6/m m m","-P 6 2","191","","Sc Fe6 Ge6","","- Fe6 Ge6 Sc -","- Fe6 Ge6 Sc -","- Fe6 Ge6 Sc -","1","0.0416667","","Mazet, T.; Isnard, O.; Malaman, B.","Neutron diffraction and (57)Fe Mossbauer study of (Hf Fe6 Ge6)-type R Fe6 Ge6 compounds (R = Sc, Ti, Zr, Hf, Nb)","Solid State Communications","2000","114","","91","96","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525975","13.151","","6.852","","10.361","","90","","90","","90","","933.636","","","","","","","","","","","","","5","P n a 21","P 2c -2n","33","","(Ru (N O) (N H3)3 Cl (H2 O)) Cl2","","- Cl3 H11 N4 O2 Ru -","- Cl3 H11 N4 O2 Ru -","- Cl12 H44 N16 O8 Ru4 -","4","1","","Emel'yanov, V.A.; Vasil'ev, A.D.; Baidina, I.A.; Gromilov, S.A.; Belyaev, A.V.","Synthesis and crystal structure of nitrosoruthenium triammino complex (Ru N O (N H3)3 Cl (H2 O)) Cl2","Zhurnal Strukturnoi Khimii (Issue-No. from 1981)","2000","41","","1242","1247","","","","","","","","","","","","","","","","","","","","","","has coordinates","186594","2020-10-21","18:00:00",""
"1525976","7.0103","","11.133","","12.843","","90","","99.076","","90","","989.791","","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Na (Ru (N O) Cl4 (H2 O)) (H2 O)2","","- Cl4 H6 N Na O4 Ru -","- Cl4 H6 N Na O4 Ru -","- Cl16 H24 N4 Na4 O16 Ru4 -","4","1","","Emel'yanov, V.A.; Belyaev, A.V.; Baidina, I.A.; Gromilov, S.A.; Virovets, A.V.","Synthesis and crystal structure of sodium trans- nitrosoaquatetrachlororuthenate(II)","Zhurnal Strukturnoi Khimii (Issue-No. from 1981)","2000","41","","567","571","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525977","5.012","","5.012","","7.991","","90","","90","","120","","173.842","","","","","","","","","","","","","3","P 6/m m m","-P 6 2","191","","Ti Fe6 Ge6","","- Fe6 Ge6 Ti -","- Fe6 Ge6 Ti -","- Fe6 Ge6 Ti -","1","0.0416667","","Mazet, T.; Malaman, B.; Isnard, O.","Neutron diffraction and (57)Fe Mossbauer study of (Hf Fe6 Ge6)-type R Fe6 Ge6 compounds (R = Sc, Ti, Zr, Hf, Nb)","Solid State Communications","2000","114","","91","96","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525979","5.041","","5.041","","8.027","","90","","90","","120","","176.651","","","","","","","","","","","","","3","P 6/m m m","-P 6 2","191","","Zr Fe6 Ge6","","- Fe6 Ge6 Zr -","- Fe6 Ge6 Zr -","- Fe6 Ge6 Zr -","1","0.0416667","","Mazet, T.; Isnard, O.; Malaman, B.","Neutron diffraction and (57)Fe Mossbauer study of (Hf Fe6 Ge6)-type R Fe6 Ge6 compounds (R = Sc, Ti, Zr, Hf, Nb)","Solid State Communications","2000","114","","91","96","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525981","5.01","","5.01","","8.013","","90","","90","","120","","174.181","","","","","","","","","","","","","3","P 6/m m m","-P 6 2","191","","Nb Fe6 Ge6","","- Fe6 Ge6 Nb -","- Fe6 Ge6 Nb -","- Fe6 Ge6 Nb -","1","0.0416667","","Mazet, T.; Isnard, O.; Malaman, B.","Neutron diffraction and (57)Fe Mossbauer study of (Hf Fe6 Ge6)-type R Fe6 Ge6 compounds (R = Sc, Ti, Zr, Hf, Nb)","Solid State Communications","2000","114","","91","96","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525986","3.8906","","3.8906","","23.875","","90","","90","","90","","361.39","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Sr3 Co2 O5 Cl2","","- Cl2 Co2 O5 Sr3 -","- Cl2 Co2 O5 Sr3 -","- Cl4 Co4 O10 Sr6 -","2","0.0625","","McGlothlin, N.; Ho, D.; Cava, R.J.","Sr3 Co2 O5 Cl2 and Sr2 Co O3 Cl: two layered cobalt oxychlorides","Materials Research Bulletin","2000","35","","1035","1043","","","","","","","","","","","","","","","","","","","","","","has coordinates","147074","2020-10-21","18:00:00",""
"1525987","3.5005","","3.573","","5.0015","","90","","91.677","","90","","62.528","","","","","","","","","","","","","3","I 1 2/m 1","-I 2y","12","","(Mn0.55 Ta0.45) O1.7","","- Mn0.55 O1.7 Ta0.45 -","- Mn0.55 O1.7 Ta0.45 -","- Mn1.1 O3.4 Ta0.9 -","2","0.25","","Esmaeilzadeh, S.; Lidin, S.; Nygren, M.; Grins, J.","Single crystal refinement of the incommensurately modulated Mn0.55 Ta0.45 O1.7, an oxygen deficient fluorite type compound","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","148","159","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1525988","3.875","","3.875","","14.188","","90","","90","","90","","213.042","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","Sr2 Co O3 Cl","","- Cl Co O3 Sr2 -","- Cl Co O3 Sr2 -","- Cl2 Co2 O6 Sr4 -","2","0.125","","McGlothlin, N.; Ho, D.; Cava, R.J.","Sr3 Co2 O5 Cl2 and Sr2 Co O3 Cl: two layered cobalt oxychlorides","Materials Research Bulletin","2000","35","","1035","1043","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525991","5.4684","","5.5029","","7.7497","","90","","90","","90","","233.204","","","","","","","","","","","","","5","P b n m","-P 2c 2ab","62","","(Ca0.62 La0.38) (Mg0.19 Ti0.81) O3","","- Ca0.62 La0.38 Mg0.19 O3 Ti0.81 -","- Ca0.62 La0.38 Mg0.19 O3 Ti0.81 -","- Ca2.48 La1.52 Mg0.76 O12 Ti3.24 -","4","0.5","","Meden, A.; Ceh, M.","Rietveld refinement of Ca0.54 La0.46 Mg0.23 Ti0.77 O3 - a promising new microwave ceramic","Materials Science Forum","2000","321","","988","993","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1525995","7.096","","12.4","","9.397","","90","","107.19","","90","","789.911","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(Bi2.04 Ca0.94) (V O4)2 O","","- Bi2.04 Ca0.94 O9 V2 -","- Bi2.04 Ca0.94 O9 V2 -","- Bi8.16 Ca3.76 O36 V8 -","4","1","","Evans, J.S.O.; Sleight, A.W.","Synthesis and structure of Bi2 Ca V2 O9","International Journal of Inorganic Materials","2000","2","","375","377","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1525998","5.7626","","5.7626","","11.536","","90","","90","","90","","383.082","","","","","","","","","","","","","3","P -4 2 c","P -4 2c","112","","","","- Cu In1.93 Se3.5 -","- Cu In1.93 Se3.5 -","- Cu2 In3.86 Se7 -","2","0.25","","Merino, J.M.; Mahanty, S.; Leon, M.; Martin de Vidales, J.L.; Diaz, R.; Rueda, F.","Structural characterization of Cu In2 Se3.5, Cu In3 Se5 and Cu In5 Se8 compounds","Thin Solid Films","2000","361","","70","73","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1525999","5.4161","","5.3737","","7.6226","","90","","90","","90","","221.852","","","","","","","","","","","","","3","P b n m","-P 2c 2ab","62","","Pr (Ni O3)","","- Ni O3 Pr -","- Ni O3 Pr -","- Ni4 O12 Pr4 -","4","0.5","","Falcon, H.; Martinez-Lope, M.J.; Alonso, J.A.; Fierro, J.L.G.","Large enhancement of the catalytic activity for C O oxidation on hole doped (Ln, Sr) Ni O3 (Ln = Pr, Sm, Eu) perovskites","Solid State Ionics","2000","131","","237","248","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526000","5.7555","","5.7555","","11.5303","","90","","90","","90","","381.95","","","","","","","","","","","","","3","P -4 2 c","P -4 2c","112","","","","- Cu0.79 In2.33 Se3.6 -","- Cu0.79 In2.33 Se3.6 -","- Cu1.58 In4.66 Se7.2 -","2","0.25","","Merino, J.M.; Rueda, F.; Mahanty, S.; Martin de Vidales, J.L.; Diaz, R.; Leon, M.","Structural characterization of Cu In2 Se3.5, Cu In3 Se5 and Cu In5 Se8 compounds","Thin Solid Films","2000","361","","70","73","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1526001","5.4171","","5.3668","","7.6181","","90","","90","","90","","221.477","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","(Pr0.95 Sr0.05) Ni O3","","- Ni O3 Pr0.95 Sr0.05 -","- Ni O3 Pr0.95 Sr0.05 -","- Ni4 O12 Pr3.8 Sr0.2 -","4","0.5","","Falcon, H.; Alonso, J.A.; Martinez-Lope, M.J.; Fierro, J.L.G.","Large enhancement of the catalytic activity for C O oxidation on hole doped (Ln, Sr) Ni O3 (Ln = Pr, Sm, Eu) perovskites","Solid State Ionics","2000","131","","237","248","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526003","3.8509","","3.8509","","27.964","","90","","90","","90","","414.69","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Sr4 (Mn Fe2 O9.51)","","- Fe2 Mn O9.51 Sr4 -","- Fe2.001 Mn0.999 O9.51 Sr4 -","- Fe4.002 Mn1.998 O19.02 Sr8 -","2","0.0625","","Fawcett, I.D.; Veith, G.M.; Croft, M.; Greenblatt, M.; Nowik, I.","Properties of the n = 3 Ruddlesden-Popper phases Sr4 Mn3-x Fex O10-d (x = 1, 1.5, 2)","Journal of Solid State Chemistry","2000","155","","96","104","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526005","9.293","","9.293","","7.236","","90","","90","","120","","541.179","","","","","","","","","","","","","4","R 3 2 :H","R 3 2""","155","","Y Al3 (B O3)4","","- Al3 B4 O12 Y -","- Al3 B4 O12 Y -","- Al9 B12 O36 Y3 -","3","0.166667","","Meszaros, G.; Svab, E.; Toth, M.; Beregi, E.; Watterich, A.","Rietveld refinement for yttrium aluminium borates from neutron and X-ray diffraction","Physik (Berlin)","2000","276","","310","311","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526006","9.342","","9.342","","7.325","","90","","90","","120","","553.628","","","","","","","","","","","","","5","R 3 2 :H","R 3 2""","155","","Y (Al1.5 Ga1.5) (B O3)4","","- Al1.5 B4 Ga1.5 O12 Y -","- Al1.5 B4 Ga1.5 O12 Y -","- Al4.5 B12 Ga4.5 O36 Y3 -","3","0.166667","","Meszaros, G.; Svab, E.; Toth, M.; Watterich, A.; Beregi, E.","Rietveld refinement for yttrium aluminium borates from neutron and X-ray diffraction","Physik (Berlin)","2000","276","","310","311","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526013","6.5732","","6.4445","","6.3693","","60.995","","61.257","","77.191","","206.872","","","","","","","","","","","","","6","P 1","P 1","1","","Ca Sr (B5 O9) Cl (H2 O)","","- B5 Ca Cl H2 O10 Sr -","- B5 Ca Cl H2 O10 Sr -","- B5 Ca Cl H2 O10 Sr -","1","1","","Ferro, O.; Pekov, I.V.; Pushcharovskii, D.Yu.; Lovskaya, E.V.; Teat, S.; Vinogradova, S.A.","Crystal structure of strontian hilgardite","Kristallografiya","2000","45","","452","457","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526014","10.4971","","11.0683","","16.211","","90","","90","","90","","1883.48","","","","","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","(Nd3 N) Cl6","","- Cl6 N Nd3 -","- Cl6 N Nd3 -","- Cl48 N8 Nd24 -","8","1","","Meyer, M.; Lissner, F.; Schleid, T.","Nd3 N Cl6 und Nd4 N S3 Cl3 : Zwei Neodymnitrid-Derivate mit discreten Einheiten Kantenverknuepfter ((N2 Nd6)(12+)) bzw. isolierter (N Nd4)(9+)-Tetraeder","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","1205","1210","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526016","9.2278","","9.2278","","6.8306","","90","","90","","120","","503.716","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","(Nd4 N) S3 Cl3","","- Cl3 N Nd4 S3 -","- Cl3 N Nd4 S3 -","- Cl6 N2 Nd8 S6 -","2","0.166667","","Meyer, M.; Schleid, T.; Lissner, F.","Nd3 N Cl6 und Nd4 N S3 Cl3 : Zwei Neodymnitrid-Derivate mit discreten Einheiten Kantenverknuepfter ((N2 Nd6)(12+)) bzw. isolierter (N Nd4)(9+)-Tetraeder","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","1205","1210","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526020","10.099","","10.099","","2.971","","90","","90","","90","","303.012","","","","","","","","","","","","","4","I 4/m","-I 4","87","","Na1.7 (Cr1.71 Ti6.29) O16","","- Cr1.71 Na1.7 O16 Ti6.29 -","- Cr1.712 Na1.7 O16 Ti6.288 -","- Cr1.712 Na1.7 O16 Ti6.288 -","1","0.0625","","Michiue, Y.; Watanabe, M.; Yoshikado, S.","High-temperature X-ray study for a single crystal of the hollandite-like one-dimensional ionic conductor, Nax Crx Ti8-x O16 (x = 1.7)","Solid State Ionics","2000","136","","939","943","","","","","","","","","","","","","","","","","","","","","","has coordinates","147116","2020-10-21","18:00:00",""
"1526022","6.124","","7.788","","8.517","","92.755","","95.735","","92.853","","403.098","","","","","","","","","","","","","4","P -1","-P 1","2","","Cu3 (Se O3)2 Cl2","","- Cl2 Cu3 O6 Se2 -","- Cl2 Cu3 O6 Se2 -","- Cl4 Cu6 O12 Se4 -","2","1","","Millet, P.; Bastide, B.; Johnsson, M.","Cu3 (Se O3)2 Cl2 : a new oxochloride of copper(II) and selenium(IV)","Solid State Communications","2000","113","","719","723","","","","","","","","","","","","","","","","","","","","","","has coordinates","147118","2020-10-21","18:00:00",""
"1526024","10.408","","10.408","","6.0921","","90","","90","","90","","659.936","","","","","","","","","","","","","5","P 42/m n m","-P 4n 2n","136","","Cs4 K2 Cu (Si O4)2","","- Cs4 Cu K2 O8 Si2 -","- Cs4 Cu K2 O8 Si2 -","- Cs8 Cu2 K4 O16 Si4 -","2","0.125","","Moeller, A.","Cs4 K2 Cu Si2 O8: Synthese, Kristallstruktur, UV-Vis-IR-Daten","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","2251","2252","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526031","4.1827","","4.1827","","8.9617","","90","","90","","90","","156.785","","","","","","","","","","","","","3","P 4/m m m","-P 4 2","123","","","","- Ba2 In2 O5 -","- Ba2 In2 O5 -","- Ba2 In2 O5 -","1","0.0625","","Fischer, W.; Reck, G.; Schober, T.","Phase transition of Ba~2~In~2~O~5~ in humid air studied by in-situ X-ray powder diffraction","Materials Science Forum","2000","","","363","367","10.4028/www.scientific.net/MSF.321-324.363","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1526033","5.79492","","5.79492","","22.68379","","90","","90","","120","","659.692","","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","Sr Cr8.23 Ga3.77 O19","","- Cr8.23 Ga3.77 O19 Sr -","- Cr8.23 Ga3.77 O19 Sr -","- Cr16.46 Ga7.54 O38 Sr2 -","2","0.0833333","","Mondelli, C.; Payen, C.; Taglieri, G.; Ouladdiaf, B.; Mutka, H.","Neutron and X-ray diffraction study of the Sr Cr8 Ga4 O19 Kagome compound synthesized by citrate route","Materials Science Forum","2000","321","","828","833","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526038","5.441","","5.441","","13.466","","90","","90","","120","","345.244","","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","(La0.1 Sr0.9) Mn O3","","- La0.1 Mn O3 Sr0.9 -","- La0.1 Mn O3 Sr0.9 -","- La0.6 Mn6 O18 Sr5.4 -","6","0.25","","Mori, T.; Kamegashira, N.","The layered structuure of La substituted Sr Mn O3","Journal of Alloys Compd.","2000","313","","1","4","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526040","5.842","","7.378","","5.28","","90","","90","","90","","227.58","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Dy (Mn O3)","","- Dy Mn O3 -","- Dy Mn O3 -","- Dy4 Mn4 O12 -","4","0.5","","Mori, T.; Aoki, K.; Shishido, T.; Kamegashira, N.; Fukuda, T.","Crystal structure of Dy Mn O3","Materials Letters","2000","42","","387","389","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526052","6.1106","","6.0527","","8.6373","","90","","90","","90","","319.456","","","","","","","","","","","","","4","I b m m","-I 2c 2c","74","","Ba (Bi0.8 In0.2) O3","","- Ba Bi0.8 In0.2 O3 -","- Ba Bi0.8 In0.2 O3 -","- Ba4 Bi3.2 In0.8 O12 -","4","0.25","","Fu, W.T.; Polderman, M.J.; Mulder, F.M.","Structural and transport properties of the Ba Bi1-x Inx O3 system","Materials Research Bulletin","2000","35","","1205","1211","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526053","10.4203","","10.4203","","37.3895","","90","","90","","120","","3515.93","","","","","","","","","","","","","4","R 3 c :H","R 3 -2""c","161","","Ca9.95 Li1.05 (P O4)7","","- Ca9.95 Li1.05 O28 P7 -","- Ca9.95 Li1.05 O28 P7 -","- Ca59.7 Li6.3 O168 P42 -","6","0.333333","","Morozov, V.A.; Belik, V.A.; Lazoryak, B.I.; Presnyakov, I.A.; Khasanov, S.S.; Kotov, R.N.","Crystal structure of calcium alkali metal phosphates Ca10 M (P O4)7 (M = Li, Na, K)","Kristallografiya","2000","45","","19","26","","","","","","","","","","","","","","","","","","","","","","has coordinates","147156","2020-10-21","18:00:00",""
"1526054","5.9779","","5.9779","","8.4752","","90","","90","","90","","302.864","","","","","","","","","","","","","4","I 4/m c m","-I 4 2c","140","","Ba (Bi0.5 In0.5) O3","","- Ba Bi0.5 In0.5 O3 -","- Ba Bi0.5 In0.5 O3 -","- Ba4 Bi2 In2 O12 -","4","0.125","","Fu, W.T.; Polderman, M.J.; Mulder, F.M.","Structural and transport properties of the Ba Bi1-x Inx O3 system","Materials Research Bulletin","2000","35","","1205","1211","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526055","10.4391","","10.4391","","37.30959","","90","","90","","120","","3521.09","","","","","","","","","","","","","4","R 3 c :H","R 3 -2""c","161","","Ca10 Na (P O4)7","","- Ca10 Na O28 P7 -","- Ca10 Na O28 P7 -","- Ca60 Na6 O168 P42 -","6","0.333333","","Morozov, V.A.; Kotov, R.N.; Belik, V.A.; Presnyakov, I.A.; Khasanov, S.S.; Lazoryak, B.I.","Crystal structure of calcium alkali metal phosphates Ca10 M (P O4)7 (M = Li, Na, K)","Kristallografiya","2000","45","","19","26","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526056","6.0424","","6.0424","","6.0424","","60.178","","60.178","","60.178","","156.625","","","","","","","","","","","","","4","R -3 :R","-P 3*","148","","Ba Bi0.5 Sb0.5 O3","","- Ba Bi0.5 O3 Sb0.5 -","- Ba Bi0.5 O3 Sb0.5 -","- Ba2 Bi O6 Sb -","2","0.333333","","Fu, W.T.","A neutron powder diffraction study on Ba Bi0.5 Sb0.5 O3","Solid State Communications","2000","116","","461","464","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526057","6.104","","8.289","","10.753","","97.7","","92.25","","90.28","","538.71","","","","","","","","","","","","","4","P -1","-P 1","2","","Tl Cu5 O (V O4)3","","- Cu5 O13 Tl V3 -","- Cu5 O13 Tl V3 -","- Cu10 O26 Tl2 V6 -","2","1","","Moser, P.; Jung, W.","Tl Cu5 O (V O4)3 mit K Cu5 O (V O4)3 - Struktur - ein Thallium - Kupfer(II) - Oxidvanadat als Oxidationsprodukt einer Tl/Cu/V - Legierung","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","1421","1425","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526062","8.85","","8.85","","21.8","","90","","90","","120","","1478.68","","","","","","","","","","","","","4","R -3 :H","-R 3","148","","Mn0.5 Zr2 (P O4)3","","- Mn0.5 O12 P3 Zr2 -","- Mn0.5 O12 P3 Zr2 -","- Mn3 O72 P18 Zr12 -","6","0.333333","","Mouline, A.; Alami, M.; Brochu, R.; Olazcuaga, R.; Parent, C.; le Flem, G.","The structure and luminescent properties of Mn0.5 Zr2 (P O4)3","Materials Research Bulletin","2000","35","","899","908","","","","","","","","","","","","","","","","","","","","","","has coordinates","147168","2020-10-21","18:00:00",""
"1526065","5.892","","5.892","","22.544","","90","","90","","120","","677.777","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","(N D4)3 D (S O4)2","","- D13 N3 O8 S2 -","- D12.9996 N3 O8.0004 S2 -","- D38.9988 N9 O24.0012 S6 -","3","0.0833333","","Fukami, T.; Chen, R.H.; Horiuchi, K.","Structural study of a high-temperature phase in (N D4)3 D (S O4)2","Solid State Ionics","2000","131","","275","280","","","","","","","","","","","","","","","","","","","","","","has coordinates","147171","2020-10-21","18:00:00",""
"1526068","3.917","","3.917","","9.939","","90","","90","","90","","152.493","","","","","","","","","","","","","3","P 4/n m m :2","-P 4a 2a","129","","Gd Cu As2","","- As2 Cu Gd -","- As2 Cu Gd -","- As4 Cu2 Gd2 -","2","0.125","","Mozharivsky, Yu.; Kaczorowski, D.; Franzen, H.F.","Symmetry-breaking transitions from Gd Cu As2 through Gd Cu As1.15 P0.85 to Gd Cu P2.20: crystal structure, application of Landau theory, bonding, magnetic and electrical properties","Journal of Solid State Chemistry","2000","155","","259","272","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526069","19.9191","","19.89119","","13.3388","","90","","90","","90","","5285.03","","","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","(Si96 O192) (C6 H6 N2 O2)4","","- C24 H24 N8 O200 Si96 -","- C24 H16 N8 O200 Si96 -","- C24 H16 N8 O200 Si96 -","1","0.125","","Fyfe, C.A.; Brouwer, D.H.","Solid-state NMR and X-ray diffraction structural investigations of the p-nitroaniline/ZSM-5 komplex","Microporous and Mesoporous Materials","2000","39","","291","305","","","","","","","","","","","","","","","","","","","","","","has coordinates","147175","2020-10-21","18:00:00",""
"1526070","5.3747","","5.383","","9.7375","","90","","90","","90","","281.725","","","","","","","","","","","","","3","P m m 2","P 2 -2","25","","Gd Cu P2.195","","- Cu Gd P2.195 -","- Cu Gd P2.195 -","- Cu4 Gd4 P8.78 -","4","1","","Mozharivsky, Yu.; Kaczorowski, D.; Franzen, H.F.","Symmetry-breaking transitions from Gd Cu As2 through Gd Cu As1.15 P0.85 to Gd Cu P2.20: crystal structure, application of Landau theory, bonding, magnetic and electrical properties","Journal of Solid State Chemistry","2000","155","","259","272","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526071","10.054","","10.054","","3.528","","90","","90","","120","","308.842","","","","","","","","","","","","","5","P -6 2 m","P -6 -2","189","","Pb3 Sr4 Ca Cu O10.62","","- Ca Cu O10.62 Pb3 Sr4 -","- Ca0.999 Cu O10.62 Pb3 Sr4.001 -","- Ca0.999 Cu O10.62 Pb3 Sr4.001 -","1","0.0833333","","Gaeberlein, P.O.G.","Solid solution compositions of Pb3 (Sr, Ca)5 Cu Oy and refinement with the Rietveld method","Materials Science Forum","2000","321","","846","851","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526072","22.255","","22.255","","10.386","","90","","90","","90","","5144.03","","","","","","","","","","","","","3","I -4 m 2","I -4 -2","119","","Cu47.18 Si91.22 P144","","- Cu47.18 P144 Si91.22 -","- Cu47.176 P144 Si91.224 -","- Cu47.176 P144 Si91.224 -","1","0.0625","","Mozharivsky, Yu.; Lang, O.; Franzen, H.F.","Modulated crystal structure and electronic properties of semiconductor Cu47 Si91 P144","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","2153","2160","","","","","","","","","","","","","","","","","","","","","","has coordinates","147178","2020-10-21","18:00:00",""
"1526075","7.452","","14.176","","7.209","","97.172","","118.48","","80.654","","659.522","","","","","","","","","","","","","3","P -1","-P 1","2","","Bi9.85 Pb6.15 O21","","- Bi9.85 O21 Pb6.15 -","- Bi9.856 O21 Pb6.144 -","- Bi9.856 O21 Pb6.144 -","1","0.5","","Gemmi, M.; Righi, L.; Calestani, G.; Bettinelli, M.; Migliori, A.; Speghini, A.; Santarosa, M.","Structure determination of phi-(Bi8 Pb5 O17) by electron and powder X-ray diffraction","Ultramicroscopy","2000","84","","133","142","","","","","","","","","","","","","","","","","","","","","","has coordinates","147181","2020-10-21","18:00:00",""
"1526076","6.8113","","6.8664","","12.5023","","82.529","","88.027","","88.959","","579.359","","","","","","","","","","","","","3","P -1","-P 1","2","","La2 (Si2 O7)","","- La2 O7 Si2 -","- La2 O7 Si2 -","- La8 O28 Si8 -","4","2","","Mueller-Bunz, H.; Schleid, T.","Ueber den H- und A-Typ von La2 (Si2 O7)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","2549","2556","","","","","","","","","","","","","","","","","","","","","","has coordinates","147182","2020-10-21","18:00:00",""
"1526078","6.8383","","6.8383","","24.736","","90","","90","","90","","1156.71","","","","","","","","","","","","","3","P 41","P 4w","76","","La2 (Si2 O7)","","- La2 O7 Si2 -","- La2 O7 Si2 -","- La16 O56 Si16 -","8","2","","Mueller-Bunz, H.; Schleid, T.","Ueber den H- und A-Typ von La2 (Si2 O7)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","2549","2556","","","","","","","","","","","","","","","","","","","","","","has coordinates","147184","2020-10-21","18:00:00",""
"1526079","7.3406","","11.1655","","10.4062","","90","","97.281","","90","","846.03","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Dy3 F (Si3 O10)","","- Dy3 F O10 Si3 -","- Dy3 F O10 Si3 -","- Dy12 F4 O40 Si12 -","4","1","","Mueller-Bunz, H.; Schleid, T.","Darstellung und Aufbau der Lanthanoidfluorid-catena-Trisilicate M3 F (Si3 O10) (M = Dy, Ho, Er) im Fluorthalenit-Typ (Y3 F (Si3 O10))","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","845","852","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526080","7.3091","","11.1168","","10.3783","","90","","97.238","","90","","836.557","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Ho3 F (Si3 O10)","","- F Ho3 O10 Si3 -","- F Ho3 O10 Si3 -","- F4 Ho12 O40 Si12 -","4","1","","Mueller-Bunz, H.; Schleid, T.","Darstellung und Aufbau der Lanthanoidfluorid-catena-Trisilicate M3 F (Si3 O10) (M = Dy, Ho, Er) im Fluorthalenit-Typ (Y3 F (Si3 O10))","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","845","852","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526082","7.2789","","11.0702","","10.3521","","90","","97.209","","90","","827.567","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Er3 F (Si3 O10)","","- Er3 F O10 Si3 -","- Er3 F O10 Si3 -","- Er12 F4 O40 Si12 -","4","1","","Mueller-Bunz, H.; Schleid, T.","Darstellung und Aufbau der Lanthanoidfluorid-catena-Trisilicate M3 F (Si3 O10) (M = Dy, Ho, Er) im Fluorthalenit-Typ (Y3 F (Si3 O10))","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","845","852","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526086","5.6049","","7.6654","","5.4616","","90","","90","","90","","234.651","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Pr0.9 Mn O3","","- Mn O3 Pr0.9 -","- Mn0.992 O3 Pr0.902 -","- Mn3.968 O12 Pr3.608 -","4","0.5","","Munoz, A.; Alonso, J.A.; Martinez-Lope, M.J.; Fernandez-Diaz, M.T.","Magnetic structure evolution of Pr1-x Mn O3 perovskite from neutron powder diffraction data","Solid State Communications","2000","113","","227","231","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526088","5.1768","","13.541","","8.771","","90","","103.61","","90","","597.574","","","","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","Na2 Mn (P5 O15)","","- Mn Na2 O15 P5 -","- Mn Na2 O15 P5 -","- Mn2 Na4 O30 P10 -","2","0.5","","Murashova, E.V.; Chudinova, N.N.","Sodium-manganese cyclopentaphosphate: synthesis and crystal structure","Kristallografiya","2000","45","","625","628","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526090","4.682","","9.003","","16.333","","90","","94.17","","90","","686.647","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Rb (V O) (P2 O7)","","- O8 P2 Rb V -","- O8 P2 Rb V -","- O32 P8 Rb4 V4 -","4","1","","Murashova, E.V.; Chudinova, N.N.","Synthesis and crystal structure of rubidium oxovanadium(V) diphosphate","Kristallografiya","2000","45","","987","989","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526091","3.7855","","3.7855","","11.386","","90","","90","","90","","163.161","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Y Sr2 Cu3 O6.84","","- Cu3 O6.84 Sr2 Y -","- Cu3 O6.84 Sr2 Y -","- Cu3 O6.84 Sr2 Y -","1","0.0625","","Gilioli, E.; Marezio, M.; Gauzzi, A.; Radaelli, P.G.; Licci, F.","Structure and superconductivity of Y Sr2 Cu3 O7-d","Physica C (Amsterdam)","2000","341","","605","606","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526092","5.136","","8.917","","9.237","","86.98","","75.04","","73.53","","391.83","","","","","","","","","","","","","5","P -1","-P 1","2","","Cs Cu In (P6 O18)","","- Cs Cu In O18 P6 -","- Cs Cu In O18 P6 -","- Cs Cu In O18 P6 -","1","0.5","","Murashova, E.V.; Chudinova, N.N.","Mixed-cation cyclohexaphosphates: synthesis and crystal structure of Cs Cu In P6 O18 - II","Neorganicheskie Materialy","2000","36","","1507","1511","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526093","9.2309","","7.5875","","6.9978","","111.978","","93.436","","107.291","","425.777","","","","","","","","","","","","","4","P -1","-P 1","2","","Pb Bi6 O4 (P O4)4","","- Bi6 O20 P4 Pb -","- Bi6 O20 P4 Pb -","- Bi6 O20 P4 Pb -","1","0.5","","Giraud, S.; Drache, M.; Conflant, P.; Wignacourt, J.P.; Steinfink, H.","On the existence of Bi6.67 O4 (X O4)4 and Pb Bi6 O4 (X O4)4 (X = P, V and As)","Journal of Solid State Chemistry","2000","154","","435","443","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526094","5.068","","8.864","","9.144","","87.99","","75.63","","73.89","","382.044","","","","","","","","","","","","","4","P -1","-P 1","2","","Cs Mn2 (P6 O18)","","- Cs Mn2 O18 P6 -","- Cs Mn2 O18 P6 -","- Cs Mn2 O18 P6 -","1","0.5","","Murashova, E.V.; Chudinova, N.N.","Mixed-cation cyclohexaphosphates: synthesis and crystal structure of Cs Cu In P6 O18 - II","Neorganicheskie Materialy","2000","36","","1507","1511","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526096","5.212","","13.581","","7.394","","90","","102.11","","90","","511.731","","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","Cs Mn (P O3)4","","- Cs Mn O12 P4 -","- Cs Mn O12 P4 -","- Cs2 Mn2 O24 P8 -","2","1","","Murashova, E.V.; Chudinova, N.N.","Synthesis and crystal structure of the double polyphosphate Cs Mn (P O3)4","Neorganicheskie Materialy","2000","36","","1512","1515","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526097","5.7815","","5.7815","","11.6159","","90","","90","","90","","388.27","","","","","","","","","","","","","3","I -4 2 d","I -4 2bw","122","","","","- Cu0.98 In0.98 Se2 -","- Cu0.98 In0.98 Se2 -","- Cu3.92 In3.92 Se8 -","4","0.25","","Gladkikh, L.I.; Rogacheva, E.I.; Tavrina, T.V.; Fomina, L.P.","X-ray diffraction study of nonstoichiometry in Cu In Se2+d","Neorganicheskie Materialy","2000","36","","1309","1312","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1526099","5.7818","","5.7818","","11.6179","","90","","90","","90","","388.377","","","","","","","","","","","","","3","I -4 2 d","I -4 2bw","122","","","","- Cu0.961 In0.961 Se2 -","- Cu0.961 In0.961 Se2 -","- Cu3.844 In3.844 Se8 -","4","0.25","","Gladkikh, L.I.; Tavrina, T.V.; Rogacheva, E.I.; Fomina, L.P.","X-ray diffraction study of nonstoichiometry in Cu In Se2+d","Neorganicheskie Materialy","2000","36","","1309","1312","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1526100","24.787","","13.126","","11.318","","90","","90","","122.36","","3110.5","","","","","","","","","","","","","5","B 1 1 2/m","-B 2","12","","Rb11 (Cu2 (H2 O)2) (Cu15 Cl24 (Cu Cl6))","","- Cl30 Cu18 H4 O2 Rb11 -","- Cl30 Cu18 O2 Rb11 -","- Cl60 Cu36 O4 Rb22 -","2","0.25","","Mykhalichko, B.M.; Gelzak-Kotsvin, K.; Mys'kiv, M.G.","Guest-host copper(I,II) complex (Rb11 (Cu(I)2 (H2 O)2)) (Cu(I)15 Cl24 (Cu(II) Cl6)). Effect of the nature of the (Cu(I)2 (H2 O)2)(2+) guest on crystal structure formation","Zhurnal Strukturnoi Khimii (Issue-No. from 1981)","2000","41","","559","566","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526107","4.8183","","6.2671","","7.762","","90","","108.26","","90","","222.585","","","","","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","(Cs0.4 Rb0.6) (H2 P O4)","","- Cs0.4 H2 O4 P Rb0.6 -","- Cs0.4 H2 O4 P Rb0.6 -","- Cs0.8 H4 O8 P2 Rb1.2 -","2","0.5","","Naili, H.; Mhiri, T.; Daoud, A.","Crystal structure characterisation and vibrational study of a mixed compound Cs0.4 Rb0.6 H2 P O4","Phase Transition","2000","71","","271","286","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526120","7.109","","4.1069","","13.938","","90","","90","","90","","406.933","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","(Ba0.93 Sr0.07) Mn S2","","- Ba0.93 Mn S2 Sr0.07 -","- Ba0.93 Mn S2 Sr0.07 -","- Ba3.72 Mn4 S8 Sr0.28 -","4","0.5","","Gonen, Z.S.; Fettinger, J.C.; Eichhorn, B.","Magnetic properties of Ba Mn S2 and Ba0.93 Sr0.07 Mn S2: short range magnetic ordering induced by isovalent substitution","Journal of Solid State Chemistry","2000","155","","305","311","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526123","9.36","","9.86","","23.53","","98.79","","98.15","","89.3","","2124.3","","","","","","","","","","","","","4","P -1","-P 1","2","","Y2 (V10 O28) (H2 O)24","","- H48 O52 V10 Y2 -","- H48 O52 V10 Y2 -","- H96 O104 V20 Y4 -","2","1","","Navaza, A.; Chevrier, G.; Baran, E. J.; Kiat, J. M.","Neutron diffraction structure of Y~2~V~10~O~28~ * 24(H~2~O) at 297 and 60 K","Journal of Chemical Crystallography","2000","30","8","545","555","10.1023/A:1011393807523","","","","","","","","","","","","","","","","","","","","","has coordinates","174909","2020-10-21","18:00:00",""
"1526125","3.8351","","3.8351","","9.7512","","90","","90","","120","","124.206","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Y2 (Al Si O5 N)","","- Al N O5 Si Y2 -","- Al1.002 N O5.002 Si1.002 Y2 -","- Al1.002 N O5.002 Si1.002 Y2 -","1","0.0833333","","Gonon, M.F.; Cambier, F.; Descamps, J.C.; Thompson, D.P.","Crystal structure determination of Y2 Si Al O5 N ""B-phase"" by Rietveld analysis","Materials Science Forum","2000","325","","325","334","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526127","24.64189","","24.64189","","24.64189","","90","","90","","90","","14963.1","","","","","","","","","","","","","6","F d -3 m :2","-F 4vw 2vw 3","227","","Nd12.16 Na16.96 Al5.5 (Al O2)45.4 (Si O2)146.6 (O H)8.03 (H2 O)36.9","","- Al50.9 H81.83 Na16.96 Nd12.16 O428.93 Si146.6 -","- Al50.912 Na16.96 Nd12.16 O428.928 Si146.592 -","- Al50.912 Na16.96 Nd12.16 O428.928 Si146.592 -","1","0.00520833","","Nery, J.G.; Giotto, M.V.; Cardoso, D.; Primerano Mascarenhas, Y.; Zanon Zotin, F.M.; Sousa-Aguiar, E.F.","Rietveld refinement and solid state NMR study of Nd-, Sm-, Gd-, and Dy-containing Y zeolites","Microporous and Mesoporous Materials","2000","41","","281","293","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526128","24.58659","","24.58659","","24.58659","","90","","90","","90","","14862.6","","","","","","","","","","","","","6","F d -3 m :2","-F 4vw 2vw 3","227","","Sm12.16 Na16.32 Al2.59 (Al O2)41.1 (Si O2)150.9 (O H)11.69 (H2 O)46.29","","- Al43.69 H104.27 Na16.32 O441.98 Si150.9 Sm12.16 -","- Al43.6992 Na16.32 O441.984 Si150.893 Sm12.16 -","- Al43.6992 Na16.32 O441.984 Si150.893 Sm12.16 -","1","0.00520833","","Nery, J.G.; Sousa-Aguiar, E.F.; Primerano Mascarenhas, Y.; Giotto, M.V.; Cardoso, D.; Zanon Zotin, F.M.","Rietveld refinement and solid state NMR study of Nd-, Sm-, Gd-, andDy-containing Y zeolites","Microporous and Mesoporous Materials","2000","41","","281","293","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526129","24.6055","","24.6055","","24.6055","","90","","90","","90","","14896.9","","","","","","","","","","","","","6","F d -3 m :2","-F 4vw 2vw 3","227","","Gd12.16 Na16.96 Al3.84 (Al O2)47.77 (Si O2)144.23 (O H)5.67 (H2 O)61.15","","- Al51.61 Gd12.16 H127.97 Na16.96 O450.82 Si144.23 -","- Al51.6096 Gd12.16 Na16.96 O450.816 Si144.23 -","- Al51.6096 Gd12.16 Na16.96 O450.816 Si144.23 -","1","0.00520833","","Nery, J.G.; Cardoso, D.; Giotto, M.V.; Primerano Mascarenhas, Y.; Zanon Zotin, F.M.; Sousa-Aguiar, E.F.","Rietveld refinement and solid state NMR study of Nd-, Sm-, Gd-, and Dy-containing Y zeolites","Microporous and Mesoporous Materials","2000","41","","281","293","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526130","24.54369","","24.54369","","24.54369","","90","","90","","90","","14784.9","","","","","","","","","","","","","6","F d -3 m :2","-F 4vw 2vw 3","227","","Dy8.96 Na24.96 Al10.56 (Al O2)41.93 (Si O2)150.07 (O H)9.9 (H2 O)51.54","","- Al52.49 Dy8.96 H112.98 Na24.96 O445.44 Si150.07 -","- Al52.4928 Dy8.96 Na24.96 O445.44 Si150.067 -","- Al52.4928 Dy8.96 Na24.96 O445.44 Si150.067 -","1","0.00520833","","Nery, J.G.; Cardoso, D.; Giotto, M.V.; Primerano Mascarenhas, Y.; Zanon Zotin, F.M.; Sousa-Aguiar, E.F.","Rietveld refinement and solid state NMR study of Nd-, Sm-, Gd-, and Dy-containing Y zeolites","Microporous and Mesoporous Materials","2000","41","","281","293","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526132","3.4831","","3.4831","","25.609","","90","","90","","120","","269.064","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","Er (Fe Mn) O4","","- Er Fe Mn O4 -","- Er Fe Mn O4 -","- Er3 Fe3 Mn3 O12 -","3","0.0833333","","Nespolo, M.; Isobe, M.; Iida, J.; Kimizuka, N.","Crystal structure and charge distribution of Er Fe Mn O4","Journal of Alloys Compd.","2000","313","","59","64","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526139","14.803","","12.582","","17.712","","90","","98.31","","90","","3264.25","","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(C10 H10 N)4 (H Ge Mo12 O40)","","- C40 H41 Ge Mo12 N4 O40 -","- C40 Ge Mo12 N4 O40 -","- C80 Ge2 Mo24 N8 O80 -","2","0.5","","Niu, J.-Y.; Wang, J.-P.; Zhou, Z.-Y.","Studies on the synthesis, structure and properties of a mixed-valence molybdogermanate salt","Wuji Huaxue Xuebao","2000","16","","647","652","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526140","9.9636","","9.9636","","7.2061","","90","","90","","120","","619.532","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Sr2 (Sr2.99 Eu0.01) (P O4)3 Br","","- Br Eu0.01 O12 P3 Sr4.99 -","- Br Eu0.009 O12 P3 Sr4.991 -","- Br2 Eu0.018 O24 P6 Sr9.982 -","2","0.166667","","Noetzold, D.; Wulff, H.","Structural and optical properties of the system Sr5 (P O4)3 (Br, F) : Eu(2+)","Physica Status Solidi, Sectio A: Applied Research","2000","177","","281","291","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526142","9.8885","","9.8885","","7.2344","","90","","90","","120","","612.624","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","Sr2 (Sr2.99 Eu0.01) (P O4)3 Br0.75 F0.25","","- Br0.75 Eu0.01 F0.25 O12 P3 Sr4.99 -","- Br0.75 Eu0.009 F0.25 O12 P3 Sr4.991 -","- Br1.5 Eu0.018 F0.5 O24 P6 Sr9.982 -","2","0.166667","","Noetzold, D.; Wulff, H.","Structural and optical properties of the system Sr5 (P O4)3 (Br, F): Eu(2+)","Physica Status Solidi, Sectio A: Applied Research","2000","177","","281","291","","","","","","","","","","","","","","","","","","","","","","has coordinates","147259","2020-10-21","18:00:00",""
"1526144","9.7623","","9.7623","","7.2699","","90","","90","","120","","600.017","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","Sr2 (Sr2.99 Eu0.01) (P O4)3 Br0.5 F0.5","","- Br0.5 Eu0.01 F0.5 O12 P3 Sr4.99 -","- Br0.5 Eu0.009 F0.5 O12 P3 Sr4.991 -","- Br Eu0.018 F O24 P6 Sr9.982 -","2","0.166667","","Noetzold, D.; Wulff, H.","Structural and optical properties of the system Sr5 (P O4)3 (Br, F): Eu(2+)","Physica Status Solidi, Sectio A: Applied Research","2000","177","","281","291","","","","","","","","","","","","","","","","","","","","","","has coordinates","147261","2020-10-21","18:00:00",""
"1526145","9.7186","","9.7186","","7.2853","","90","","90","","120","","595.917","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","Sr2 (Sr2.99 Eu0.01) (P O4)3 Br0.25 F0.75","","- Br0.25 Eu0.01 F0.75 O12 P3 Sr4.99 -","- Br0.25 Eu0.009 F0.75 O12 P3 Sr4.991 -","- Br0.5 Eu0.018 F1.5 O24 P6 Sr9.982 -","2","0.166667","","Noetzold, D.; Wulff, H.","Structural and optical properties of the system Sr5 (P O4)3 (Br, F): Eu(2+)","Physica Status Solidi, Sectio A: Applied Research","2000","177","","281","291","","","","","","","","","","","","","","","","","","","","","","has coordinates","147263","2020-10-21","18:00:00",""
"1526147","4.046","","4.046","","4.1394","","90","","90","","90","","67.762","","","","","","","","","","","","","4","P 4 m m","P 4 -2","99","","Pb ((Zr0.52 Ti0.48) O3)","","- O3 Pb Ti0.48 Zr0.52 -","- O3 Pb Ti0.48 Zr0.52 -","- O3 Pb Ti0.48 Zr0.52 -","1","0.125","","Noheda, B.; Gonzalo, J.A.; Cross, L.E.; Guo, R.; Cox, D.E.; Park, S.-E.; Shirane, G.","Tetragonal-to-monoclinic phase transition in a ferroelectric perovskite: the structure of Pb Zr0.52 Ti0.48 O3","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2000","61","","8687","8695","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526149","5.72204","","5.70957","","4.13651","","90","","90.498","","90","","135.136","","","","","","","","","","","","","4","C 1 m 1","C -2y","8","","Pb ((Zr0.52 Ti0.48) O3)","","- O3 Pb Ti0.48 Zr0.52 -","- O3 Pb Ti0.48 Zr0.52 -","- O6 Pb2 Ti0.96 Zr1.04 -","2","0.5","","Noheda, B.; Gonzalo, J.A.; Cross, L.E.; Shirane, G.; Park, S.-E.; Guo, R.; Cox, D.E.","Tetragonal-to-monoclinic phase transition in a ferroelectric perovskite: the structure of Pb Zr0.52 Ti0.48 O3","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2000","61","","8687","8695","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526151","12.746","","12.746","","9.14","","90","","90","","120","","1285.95","","","","","","","","","","","","","7","P -3","-P 3","147","","((Mn0.348 Al0.652) (P O4)) (N H (C3 H7)2)0.375 (H2 O)0.125","","- C2.25 H5.875 Al0.652 Mn0.348 N0.375 O4.125 P -","- C2.25 Al0.6525 Mn0.3475 N0.375 O4.125 P -","- C18 Al5.22 Mn2.78 N3 O33 P8 -","8","1.33333","","Novak Tusar, N.; Ristic, A.; Meden, A.; Kaucic, V.","Large-pore molecular sieve (Mn A P O)-50 : synthesis, single-crystal structure analysis and thermal stability","Microporous and Mesoporous Materials","2000","37","","303","311","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526168","5.5","","5.5","","5.5","","90","","90","","90","","166.375","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","(Ca0.88 Gd0.12) F2.12","","- Ca0.88 F2.12 Gd0.12 -","- Ca0.88 F2.1202 Gd0.12 -","- Ca3.52 F8.4808 Gd0.48 -","4","0.0208333","","Grigor'eva, N.B.; Maksimov, B.A.; Sobolev, B.P.","X-ray structural study of Ca0.88 Gd0.12 F2.12 with modified fluorite structure","Kristallografiya","2000","45","","788","790","","","","","","","","","","","","","","","","","","","","","","has coordinates","147297","2020-10-21","18:00:00",""
"1526176","5.48588","","7.76824","","5.52467","","90","","90","","90","","235.437","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","La (Cr O3)","","- Cr La O3 -","- Cr La O3 -","- Cr4 La4 O12 -","4","0.5","","Oikawa, K.; Kamiyama, T.; Hashimoto, T.; Shimojyo, Y.; Morii, Y.","Structural phase transition of orthorhombic La Cr O3 studied by neutron powder diffraction","Journal of Solid State Chemistry","2000","154","","524","529","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526178","5.53049","","5.53049","","13.3544","","90","","90","","120","","353.738","","","","","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","La (Cr O3)","","- Cr La O3 -","- Cr La O3 -","- Cr6 La6 O18 -","6","0.166667","","Oikawa, K.; Morii, Y.; Hashimoto, T.; Shimojyo, Y.; Kamiyama, T.","Structural phase transition of orthorhombic La Cr O3 studied by neutron powder diffraction","Journal of Solid State Chemistry","2000","154","","524","529","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526184","8.937","","11.226","","3.433","","90","","90","","90","","344.422","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Sc2 Al0.9 B6","","- Al0.9 B6 Sc2 -","- Al0.9 B6 Sc2 -","- Al3.6 B24 Sc8 -","4","0.5","","Okada, S.; Leithe-Jasper, A.; Tanaka, T.; Michiue, Y.; Gurin, V.N.","Crystal growth and structure analysis of a new scandium aluminum boride Sc2 Al B6","Journal of Solid State Chemistry","2000","154","","49","53","","","","","","","","","","","","","","","","","","","","","","has coordinates","147314","2020-10-21","18:00:00",""
"1526187","6.653","","11.537","","6.665","","90","","109.39","","90","","482.56","","","","","","","","","","","","","3","C 1 c 1","C -2yc","9","","Cu2 Sn S3","","- Cu2 S3 Sn -","- Cu2 S3 Sn -","- Cu8 S12 Sn4 -","4","1","","Onoda, M.; Chen, X.-A.; Sato, A.; Wada, H.","Crystal structure and twinning of monoclinic Cu2 Sn S3","Materials Research Bulletin","2000","35","","1563","1570","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526189","10.949","","10.949","","10.949","","90","","90","","90","","1312.57","","","","","","","","","","","","","2","I m -3","-I 2 2 3","204","","Eu6 C60","","- C60 Eu6 -","- C60 Eu6 -","- C120 Eu12 -","2","0.0416667","","Ootoshi, H.; Fujiwara, A.; Ishii, K.; Matsuoka, Y.; Watanuki, T.; Suematsu, H.","Crystal structure of europium C60 compounds","Molecular Crystals and Liquid Crystals","2000","340","","565","570","","","","","","","","","","","","","","","","","","","","","","has coordinates","147320","2020-10-21","18:00:00",""
"1526194","5.7353","","3.5448","","6.6861","","90","","90","","90","","135.932","","","","","","","","","","","","","2","P n m a","-P 2ac 2n","62","","","","- Li2 S -","- Li2 S -","- Li8 S4 -","4","0.5","","Grzechnik, A.; Syassen, K.; Vegas, A.; Hanfland, M.; Loa, I.; Jansen, M.","Reversible antifluorite to anticotunnite phase transition in Li2 S at high pressures","Journal of Solid State Chemistry","2000","154","","603","611","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1526196","6.352","","5.6042","","5.621","","90","","119.62","","90","","173.948","","","","","","","","","","","","","2","C 1 2/c 1","-C 2yc","15","","","","- Ni P2 -","- Ni P2 -","- Ni4 P8 -","4","0.5","","Orishchin, S.V.; Babizhet'sky, V.S.; Kuz'ma, Yu.B.","Reinvestigation of the Ni P2 structure","Kristallografiya","2000","45","","974","975","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1526198","6.613","","6.7","","6.8","","98.7","","102.7","","119.1","","244.753","","","","","","","","","","","","","3","P -1","-P 1","2","","Ni4 Ge0.33 P1.17","","- Ge0.33 Ni4 P1.17 -","- Ge0.33 Ni4 P1.17 -","- Ge1.32 Ni16 P4.68 -","4","2","","Orishchin, S.V.; Babizhet'sky, V.S.; Kuz'ma, Yu.B.","Crystal structure of Ni4 Ge0.33 P1.17","Neorganicheskie Materialy","2000","36","","950","954","","","","","","","","","","","","","","","","","","","","","","has coordinates","147329","2020-10-21","18:00:00",""
"1526202","5.52","","5.52","","5.52","","90","","90","","90","","168.197","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","(Na0.395 Ho0.605) F2.21","","- F2.21 Ho0.605 Na0.395 -","- F2.2106 Ho0.605 Na0.395 -","- F8.8424 Ho2.42 Na1.58 -","4","0.0208333","","Otroshchenko, L.P.; Fykin, L.E.; Bystrova, A.A.; Sobolov, B.P.","Defect structure of Na0.5-x R0.5+x F2+2x (R= Ho, Yb) solid solutions (fluorite type)","Kristallografiya","2000","45","","1006","1009","","","","","","","","","","","","","","","","","","","","","","has coordinates","147334","2020-10-21","18:00:00",""
"1526203","8.3656","","8.3656","","8.3656","","90","","90","","90","","585.452","","","","","","","","","","","","","5","F m -3 m","-F 4 2 3","225","","(Y0.6 Cu0.4) (Y0.2 Mo0.8) Ba2 O6","","- Ba2 Cu0.4 Mo0.8 O6 Y0.8 -","- Ba2 Cu0.4 Mo0.8 O6 Y0.8 -","- Ba8 Cu1.6 Mo3.2 O24 Y3.2 -","4","0.0208333","","Gu, L.-N.; Zhang, J.-W.; Li, R.-K.; Chen, Z.-Y.","The synthesis and structure of a new phase in Y - Ba- Cu - Mo - O system","Diwen Wuli Xuebao","2000","22","","77","80","","","","","","","","","","","","","","","","","","","","","","has coordinates","147335","2020-10-21","18:00:00",""
"1526204","5.452","","5.452","","5.452","","90","","90","","90","","162.057","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","(Na0.446 Yb0.554) F2.108","","- F2.108 Na0.446 Yb0.554 -","- F2.1072 Na0.446 Yb0.554 -","- F8.4288 Na1.784 Yb2.216 -","4","0.0208333","","Otroshchenko, L.P.; Fykin, L.E.; Bystrova, A.A.; Sobolov, B.P.","Defect structure of Na0.5-x R0.5+x F2+2x (R= Ho, Yb) solid solutions (fluorite type)","Kristallografiya","2000","45","","1006","1009","","","","","","","","","","","","","","","","","","","","","","has coordinates","147336","2020-10-21","18:00:00",""
"1526207","8.4054","","8.4054","","8.4054","","90","","90","","90","","593.848","","","","","","","","","","","","","4","F d -3 m :1","F 4d 2 3 -1d","227","","(Zn0.326 Mn0.674) (Mn1.35 Ni0.65) O4","","- Mn2.024 Ni0.65 O4 Zn0.326 -","- Mn2.024 Ni0.65 O4 Zn0.326 -","- Mn16.192 Ni5.2 O32 Zn2.608 -","8","0.0416667","","Guillemet-Fritsch, S.; Chanel, C.; Baudour, J.L.; Rousset, A.; Bouree, F.","X-ray and neutron diffraction studies on nickel zinc manganite Mn2.35-x Ni0.65 Znx O4 powders","Solid State Ionics","2000","132","","63","69","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1526208","3.9325","","3.9325","","25.5069","","90","","90","","90","","394.453","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","(Bi1.63 Ba0.37) (Ba0.71 Bi0.29) (Ta2 O9)","","- Ba1.08 Bi1.92 O9 Ta2 -","- Ba1.077 Bi1.923 O9 Ta2 -","- Ba2.154 Bi3.846 O18 Ta4 -","2","0.0625","","Paiva-Santos, C.O.; Mazon, T.; Zaghete, M.A.; Campos, A.L.; Varela, J.A.; Foschini, C.R.","Crystal structure of Ba Bi2 Ta2 O9","Powder Diffraction","2000","15","","134","138","","","","","","","","","","","","","","","","","","","","","","has coordinates","147342","2020-10-21","18:00:00",""
"1526209","8.362","","8.362","","8.362","","90","","90","","90","","584.696","","","","","","","","","","","","","4","F d -3 m :1","F 4d 2 3 -1d","227","","(Zn0.759 Mn0.241) (Mn1.35 Ni0.65) O4","","- Mn1.591 Ni0.65 O4 Zn0.759 -","- Mn1.591 Ni0.65 O4 Zn0.759 -","- Mn12.728 Ni5.2 O32 Zn6.072 -","8","0.0416667","","Guillemet-Fritsch, S.; Baudour, J.L.; Bouree, F.; Chanel, C.; Rousset, A.","X-ray and neutron diffraction studies on nickel zinc manganite Mn2.35-x Ni0.65 Znx O4 powders","Solid State Ionics","2000","132","","63","69","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1526211","8.3358","","8.3358","","8.3358","","90","","90","","90","","579.218","","","","","","","","","","","","","4","F d -3 m :1","F 4d 2 3 -1d","227","","(Zn0.988 Mn0.012) (Mn1.326 Zn0.024 Ni0.65) O4","","- Mn1.338 Ni0.65 O4 Zn1.012 -","- Mn1.338 Ni0.65 O4 Zn1.012 -","- Mn10.704 Ni5.2 O32 Zn8.096 -","8","0.0416667","","Guillemet-Fritsch, S.; Baudour, J.L.; Rousset, A.; Bouree, F.; Chanel, C.","X-ray and neutron diffraction studies on nickel zinc manganite Mn2.35-x Ni0.65 Znx O4 powders","Solid State Ionics","2000","132","","63","69","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1526213","8.06","","14.496","","6.695","","90","","90","","90","","782.229","","","","","","","","","","","","","3","P n n m","-P 2 2n","58","","Nb3 O2 Cl5","","- Cl5 Nb3 O2 -","- Cl5 Nb3 O2 -","- Cl20 Nb12 O8 -","4","0.5","","Gulo, F.; Perrin, C.","The crystal structure of Nb3 O2 Cl5, an original Nb3 cluster oxyhalide","Materials Research Bulletin","2000","35","","253","262","","","","","","","","","","","","","","","","","","","","","","has coordinates","147347","2020-10-21","18:00:00",""
"1526214","4.882","","4.882","","9.398","","90","","90","","120","","193.982","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Ba Al (B O3) F2","","- Al B Ba F2 O3 -","- Al B Ba F2 O3 -","- Al2 B2 Ba2 F4 O6 -","2","0.166667","","Park, H.-S.; Barbier, J.","Crystal structures of the new borate fluorides Ba M B O3 F2 (M = Ga, Al)","Journal of Solid State Chemistry","2000","155","","354","358","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526217","24.45","","10.335","","12.21","","90","","118.6","","90","","2708.89","","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","Cs10 (Li11 H3) (Li8 Si40 O96) (H2 O)12","","- Cs9.94 Li8 O96 Si40 -","- Cs9.94 Li8 O96 Si40 -","- Cs9.94 Li8 O96 Si40 -","1","0.5","","Park, S.-H.; Daniels, P.; Gies, H.","RUB-23: a new microporous lithosilicate containing spiro-5 building units","Microporous and Mesoporous Materials","2000","37","","129","143","","","","","","","","","","","","","","","","","","","","","","has coordinates","147353","2020-10-21","18:00:00",""
"1526223","11.905","","5.817","","9.542","","90","","90","","90","","660.797","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Pb3 O2 Cl2","","- Cl2 O2 Pb3 -","- Cl2 O2 Pb3 -","- Cl8 O8 Pb12 -","4","0.5","","Pasero, M.; Vacchiano, D.","Crystal structure of mendipite, Pb3 O2 Cl2","Neues Jahrbuch fuer Mineralogie. Monatshefte (Band=Jahr) (1950-)","2000","2000","","563","569","","","","","","","","","","","","","","","","","","","","","","has coordinates","147360","2020-10-21","18:00:00",""
"1526227","8.285","","4.32","","5.41","","90","","119.94","","90","","167.79","","","","","","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- Ge O2 -","- Ge O2 -","- Ge6 O12 -","6","1.5","","Haines, J.; Leger, J.M.; Chateau, C.","Transition to a crystalline high-pressure phase in alpha-(Ge O2) at room temperature","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2000","61","","8701","8706","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1526232","4.009","","4.009","","3.957","","90","","90","","120","","55.077","","","","","","","","","","","","","3","P 6/m m m","-P 6 2","191","","U (Cu0.49 Si1.51)","","- Cu0.49 Si1.51 U -","- Cu0.49 Si1.51 U -","- Cu0.49 Si1.51 U -","1","0.0416667","","Pechev, S.; Etourneau, J.; Roisnel, T.; Chevalier, B.; Darriet, B.","Magnetic structure of the U Cux Si2-x system","Solid State Sciences","2000","2","","773","780","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526233","4.007","","4.007","","3.971","","90","","90","","120","","55.217","","","","","","","","","","","","","3","P 6/m m m","-P 6 2","191","","U (Cu0.65 Si1.35)","","- Cu0.65 Si1.35 U -","- Cu0.65 Si1.35 U -","- Cu0.65 Si1.35 U -","1","0.0416667","","Pechev, S.; Etourneau, J.; Roisnel, T.; Darriet, B.; Chevalier, B.","Magnetic structure of the U Cux Si2-x system","Solid State Sciences","2000","2","","773","780","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526234","4.019","","4.019","","3.947","","90","","90","","120","","55.212","","","","","","","","","","","","","3","P 6/m m m","-P 6 2","191","","U (Cu0.9 Si1.1)","","- Cu0.9 Si1.1 U -","- Cu0.9 Si1.1 U -","- Cu0.9 Si1.1 U -","1","0.0416667","","Pechev, S.; Roisnel, T.; Etourneau, J.; Chevalier, B.; Darriet, B.","Magnetic structure of the U Cux Si2-x system","Solid State Sciences","2000","2","","773","780","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526235","4.065","","4.065","","7.727","","90","","90","","120","","110.576","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","U (Cu0.96 Si1.04)","","- Cu0.96 Si1.04 U -","- Cu0.96 Si1.04 U -","- Cu1.92 Si2.08 U2 -","2","0.0833333","","Pechev, S.; Roisnel, T.; Chevalier, B.; Darriet, B.; Etourneau, J.","Magnetic structure of the U Cux Si2-x system","Solid State Sciences","2000","2","","773","780","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526238","5.5311","","5.4943","","7.7814","","90","","90","","90","","236.473","","","","","","","","","","","","","3","P b n m","-P 2c 2ab","62","","","","- La0.928 Mn O3 -","- La0.928 Mn O3 -","- La3.712 Mn4 O12 -","4","0.5","","Petrov, A.N.; Voronin, V.I.; Zuev, A.Yu.; Tikhonova, I.L.","Crystal and defect structure of the mixed oxides La Mn1-z Cuz O3+y (0 < z < 4)","Solid State Ionics","2000","129","","179","188","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1526239","5.5342","","5.5029","","7.7915","","90","","90","","90","","237.284","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","La0.986 (Mn0.9 Cu0.1) O3","","- Cu0.1 La0.986 Mn0.9 O3 -","- Cu0.1 La0.986 Mn0.9 O3 -","- Cu0.4 La3.944 Mn3.6 O12 -","4","0.5","","Petrov, A.N.; Zuev, A.Yu.; Tikhonova, I.L.; Voronin, V.I.","Crystal and defect structure of the mixed oxides La Mn1-z Cuz O3+y (0 < z < 4)","Solid State Ionics","2000","129","","179","188","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1526240","5.5387","","5.5086","","7.8024","","90","","90","","90","","238.055","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","La0.926 (Mn0.9 Cu0.1) O2.98","","- Cu0.1 La0.926 Mn0.9 O2.98 -","- Cu0.1 La0.926 Mn0.9 O2.98 -","- Cu0.4 La3.704 Mn3.6 O11.92 -","4","0.5","","Petrov, A.N.; Tikhonova, I.L.; Zuev, A.Yu.; Voronin, V.I.","Crystal and defect structure of the mixed oxides La Mn1-z Cuz O3+y (0 < z < 4)","Solid State Ionics","2000","129","","179","188","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1526241","5.531","","5.5017","","7.7871","","90","","90","","90","","236.961","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","La (Mn0.7 Cu0.3) O3","","- Cu0.3 La Mn0.7 O3 -","- Cu0.3 La Mn0.7 O3 -","- Cu1.2 La4 Mn2.8 O12 -","4","0.5","","Petrov, A.N.; Zuev, A.Yu.; Tikhonova, I.L.; Voronin, V.I.","Crystal and defect structure of the mixed oxides La Mn1-z Cuz O3+y (0 < z < 4)","Solid State Ionics","2000","129","","179","188","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526243","5.5257","","5.4904","","7.7744","","90","","90","","90","","235.862","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","La0.996 (Mn0.6 Cu0.4) O3","","- Cu0.4 La0.996 Mn0.6 O3 -","- Cu0.4 La0.996 Mn0.6 O3 -","- Cu1.6 La3.984 Mn2.4 O12 -","4","0.5","","Petrov, A.N.; Zuev, A.Yu.; Tikhonova, I.L.; Voronin, V.I.","Crystal and defect structure of the mixed oxides La Mn1-z Cuz O3+y (0 < z < 4)","Solid State Ionics","2000","129","","179","188","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1526245","8.088","","8.088","","8.74","","90","","90","","120","","495.136","","","","","","","","","","","","","4","P -3 c 1","-P 3 2""c","165","","Rh (Si2 P3 O13)","","- O13 P3 Rh Si2 -","- O13 P3 Rh Si2 -","- O26 P6 Rh2 Si4 -","2","0.166667","","Hanawa, M.; Imoto, H.; Kobayashi, T.","Silicophosphates of rhodium and indium","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","216","222","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526246","8.5149","","8.5149","","7.7481","","90","","90","","120","","486.502","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","In4 (Si2 P6 O25)","","- In4 O25 P6 Si2 -","- In4 O24.9996 P6 Si2 -","- In4 O24.9996 P6 Si2 -","1","0.0833333","","Hanawa, M.; Kobayashi, T.; Imoto, H.","Silicophosphates of rhodium and indium","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","216","222","","","","","","","","","","","","","","","","","","","","","","has coordinates","147388","2020-10-21","18:00:00",""
"1526247","3.8683","","3.9191","","11.7509","","90","","90","","90","","178.147","","","","","","","","","","","","","4","P m m m","-P 2 2","47","","Nd Ba2 Cu3 O6.92","","- Ba2 Cu3 Nd O6.92 -","- Ba2 Cu3 Nd O6.92 -","- Ba2 Cu3 Nd O6.92 -","1","0.125","","Petrykin, V.V.; Goodilin, E.A.; Heste, J.; Trofimenko, E.A.; Kakihana, M.; Oleynikov, N.N.; Tret'yakov, Yu.D.","Structural disorder and superconductivity suppression in Nd Ba2 Cu3 Oz (z = 7)","Physica C (Amsterdam)","2000","340","","16","32","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526249","3.8966","","3.9084","","11.7186","","90","","90","","90","","178.468","","","","","","","","","","","","","4","P m m m","-P 2 2","47","","Nd Ba2 Cu3 O6.9","","- Ba2 Cu3 Nd O6.9 -","- Ba2 Cu3 Nd O6.9 -","- Ba2 Cu3 Nd O6.9 -","1","0.125","","Petrykin, V.V.; Heste, J.; Goodilin, E.A.; Trofimenko, E.A.; Oleynikov, N.N.; Kakihana, M.; Tret'yakov, Yu.D.","Structural disorder and superconductivity suppression in Nd Ba2 Cu3Oz (z = 7)","Physica C (Amsterdam)","2000","340","","16","32","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526251","3.9018","","3.9021","","11.7079","","90","","90","","90","","178.255","","","","","","","","","","","","","4","P m m m","-P 2 2","47","","Nd (Ba1.95 Nd0.05) Cu3 O6.95","","- Ba1.95 Cu3 Nd1.05 O6.95 -","- Ba1.95 Cu3 Nd1.05 O6.95 -","- Ba1.95 Cu3 Nd1.05 O6.95 -","1","0.125","","Petrykin, V.V.; Oleynikov, N.N.; Goodilin, E.A.; Trofimenko, E.A.; Heste, J.; Kakihana, M.; Tret'yakov, Yu.D.","Structural disorder and superconductivity suppression in Nd Ba2 Cu3 Oz (z = 7)","Physica C (Amsterdam)","2000","340","","16","32","","","","","","","","","","","","","","","","","","","","","","has coordinates","147393","2020-10-21","18:00:00",""
"1526253","9.4326","","9.4326","","56.27","","90","","90","","120","","4335.81","","","","","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","Rb2 (Mo9 S11) (Mo6 S8)","","- Mo15 Rb2 S19 -","- Mo15 Rb2 S19 -","- Mo90 Rb12 S114 -","6","0.166667","","Picard, S.; Potel, M.; Saillard, J.Y.; Noel, H.; Gougeon, P.","Rb2n (Mo9 S11) (Mo6n S6n+2) (n =1 to 4): a novel family of superconducting molybdenum cluster compounds","Journal of Solid State Chemistry","2000","155","","417","426","","","","","","","","","","","","","","","","","","","","","","has coordinates","147395","2020-10-21","18:00:00",""
"1526255","9.3352","","9.3352","","83.64","","90","","90","","120","","6312.36","","","","","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","Rb4 (Mo9 S11) (Mo12 S14)","","- Mo21 Rb4 S25 -","- Mo21 Rb4 S25 -","- Mo126 Rb24 S150 -","6","0.166667","","Picard, S.; Saillard, J.Y.; Potel, M.; Gougeon, P.; Noel, H.","Rb2n (Mo9 S11) (Mo6n S6n+2) (n =1 to 4): a novel family of superconducting molybdenum cluster compounds","Journal of Solid State Chemistry","2000","155","","417","426","","","","","","","","","","","","","","","","","","","","","","has coordinates","147397","2020-10-21","18:00:00",""
"1526257","9.2801","","9.2801","","110.5","","90","","90","","120","","8241.35","","","","","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","Rb6 (Mo9 S11) (Mo18 S20)","","- Mo27 Rb6 S31 -","- Mo27 Rb6 S31 -","- Mo162 Rb36 S186 -","6","0.166667","","Picard, S.; Noel, H.; Gougeon, P.; Saillard, J.Y.; Potel, M.","Rb2n (Mo9 S11) (Mo6n S6n+2) (n =1 to 4): a novel family of superconducting molybdenum cluster compounds","Journal of Solid State Chemistry","2000","155","","417","426","","","","","","","","","","","","","","","","","","","","","","has coordinates","147399","2020-10-21","18:00:00",""
"1526259","9.2372","","9.2372","","137.28","","90","","90","","120","","10144.2","","","","","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","Rb8 (Mo9 S11) (Mo24 S26)","","- Mo33 Rb8 S37 -","- Mo33 Rb8 S37 -","- Mo198 Rb48 S222 -","6","0.166667","","Picard, S.; Saillard, J.Y.; Potel, M.; Noel, H.; Gougeon, P.","Rb2n (Mo9 S11) (Mo6n S6n+2) (n =1 to 4): a novel family of superconducting molybdenum cluster compounds","Journal of Solid State Chemistry","2000","155","","417","426","","","","","","","","","","","","","","","","","","","","","","has coordinates","147401","2020-10-21","18:00:00",""
"1526260","5.0786","","5.0786","","13.985","","90","","90","","120","","312.378","","","","","","","","","","","","","3","R -3 :H","-R 3","148","","(Fe Ti O3)0.8 (Fe2 O3)0.2","","- Fe1.2 O3 Ti0.8 -","- Fe1.2 O3 Ti0.8 -","- Fe7.2 O18 Ti4.8 -","6","0.333333","","Harrison, R.J.; Redfern, S.A.T.; Smith, R.I.","In-situ study of the R3- to R3-c phase transition in the ilmenite -hematite solid solution using time-of-flight neutron powder diffraction","American Mineralogist","2000","85","","194","205","","","","","","","","","","","","","","","","","","","","","","has coordinates","147402","2020-10-21","18:00:00",""
"1526266","3.8532","","3.8532","","11.0608","","90","","90","","90","","164.221","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","Al Sr2 Er Cu2 O7","","- Al Cu2 Er O7 Sr2 -","- Al Cu2 Er O7 Sr2 -","- Al Cu2 Er O7 Sr2 -","1","0.0625","","Podlesnyak, A.; Mirmelstein, A.; Furrer, A.; Bobrovskii, V.; Voronin, V.; Mitberg, E.; Fischer, P.; Khlybov, E.; Lapin, S.; Fauth, F.","Peculiarities of crystal structure and crystal-field excitations in ""1212"" Al Sr2 R Cu2 O7 (R = Y, Er)","Physica C (Amsterdam)","2000","334","","55","63","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526269","5.0828","","5.0828","","14.033","","90","","90","","120","","313.969","","","","","","","","","","","","","3","R -3 :H","-R 3","148","","(Fe Ti O3)0.9 (Fe2 O3)0.1","","- Fe1.1 O3 Ti0.9 -","- Fe1.1 O3 Ti0.9 -","- Fe6.6 O18 Ti5.4 -","6","0.333333","","Harrison, R.J.; Redfern, S.A.T.; Smith, R.I.","In-situ study of the R3- to R3-c phase transition in the ilmenite -hematite solid solution using time-of-flight neutron powder diffraction","American Mineralogist","2000","85","","194","205","","","","","","","","","","","","","","","","","","","","","","has coordinates","147411","2020-10-21","18:00:00",""
"1526274","5.15116","","5.15116","","14.2522","","90","","90","","120","","327.509","","","","","","","","","","","","","3","R -3 :H","-R 3","148","","Fe Ti O3","","- Fe O3 Ti -","- Fe O3 Ti -","- Fe6 O18 Ti6 -","6","0.333333","","Harrison, R.J.; Redfern, S.A.T.; Smith, R.I.","In-situ study of the R3- to R3-c phase transition in the ilmenite -hematite solid solution using time-of-flight neutron powder diffraction","American Mineralogist","2000","85","","194","205","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526275","7.497","","8.6086","","5.6963","","90","","90","","90","","367.632","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Nd (Mn2 O5)","","- Mn2 Nd O5 -","- Mn2 Nd O5 -","- Mn8 Nd4 O20 -","4","0.5","","Popov, G.; Greenblatt, M.; McCarroll, W.H.","Synthesis of Ln Mn2 O5 (Ln = Nd, Pr) crystals using fused salt electrolysis","Materials Research Bulletin","2000","35","","1661","1667","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526276","7.5384","","8.6319","","5.7022","","90","","90","","90","","371.046","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Pr (Mn2 O5)","","- Mn2 O5 Pr -","- Mn2 O5 Pr -","- Mn8 O20 Pr4 -","4","0.5","","Popov, G.; McCarroll, W.H.; Greenblatt, M.","Synthesis of Ln Mn2 O5 (Ln = Nd, Pr) crystals using fused salt electrolysis","Materials Research Bulletin","2000","35","","1661","1667","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526277","11.3099","","11.3099","","7.9216","","90","","90","","90","","1013.28","","","","","","","","","","","","","5","P -4","P -4","81","","Cs3 Zn4 O (As O4)3 (H2 O)4","","- As3 Cs3 H8 O17 Zn4 -","- As3 Cs3 O17 Zn4 -","- As6 Cs6 O34 Zn8 -","2","0.5","","Harrison, W.T.A.; Phillips, M.L.F.; Bu Xianhui","Synthesis and single-crystal structure of Cs3 Zn4 O (As O4)3 * 4(H2 O), an open-framework zinc arsenate","Microporous and Mesoporous Materials","2000","39","","359","365","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526284","2.8719","","2.8719","","14.232","","90","","90","","120","","101.657","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","(Li0.88 Mg0.02) (Ni0.92 Mg0.08) O2","","- Li0.88 Mg0.1 Ni0.92 O2 -","- Li0.88 Mg0.1 Ni0.92 O2 -","- Li2.64 Mg0.3 Ni2.76 O6 -","3","0.0833333","","Pouillerie, C.; Croguennec, L.; Delmas, C.","The Lix Ni1-y Mgy O2 (y = 0.05, 0.10) system: structural modifications observed upon cycling","Solid State Ionics","2000","132","","15","29","","","","","","","","","","","","","","","","","","","","","","has coordinates","147427","2020-10-21","18:00:00",""
"1526286","2.8816","","2.8816","","14.236","","90","","90","","120","","102.373","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","(Li0.75 Mg0.1 Ni0.03) Ni0.89 O2","","- Li0.75 Mg0.1 Ni0.92 O2 -","- Li0.75 Mg0.1 Ni0.92 O2 -","- Li2.25 Mg0.3 Ni2.76 O6 -","3","0.0833333","","Pouillerie, C.; Croguennec, L.; Delmas, C.","The Lix Ni1-y Mgy O2 (y = 0.05, 0.10) system: structural modifications observed upon cycling","Solid State Ionics","2000","132","","15","29","","","","","","","","","","","","","","","","","","","","","","has coordinates","147429","2020-10-21","18:00:00",""
"1526289","3.86","","3.86","","3.187","","90","","90","","90","","47.485","","","","","","","","","","","","","2","P 4/m m m","-P 4 2","123","","","","- Pr Sb -","- Pr Sb -","- Pr Sb -","1","0.0625","","Hayashi, J.; Shirotani, I.; Tanaka, Y.; Shimomura, O.; Adachi, T.; Kikegawa, T.","Phase transitions of Ln Sb (Ln = lanthanide) with (Na Cl)-type structure at high pressures","Solid State Communications","2000","114","","561","565","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1526291","3.806","","3.806","","3.123","","90","","90","","90","","45.239","","","","","","","","","","","","","2","P 4/m m m","-P 4 2","123","","","","- Nd Sb -","- Nd Sb -","- Nd Sb -","1","0.0625","","Hayashi, J.; Shirotani, I.; Adachi, T.; Tanaka, Y.; Kikegawa, T.; Shimomura, O.","Phase transitions of Ln Sb (Ln = lanthanide) with (Na Cl)-type structure at high pressures","Solid State Communications","2000","114","","561","565","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1526299","16.29059","","15.0494","","5.17904","","90","","90","","90","","1269.71","","","","","","","","","","","","","6","P n a 21","P 2c -2n","33","","Na2 K (Al3 Si3 O12) (D2 O)0.59","","- Al3 D1.18 K Na2 O12.59 Si3 -","- Al3 D1.18 K Na2 O12.59 Si3 -","- Al12 D4.72 K4 Na8 O50.36 Si12 -","4","1","","Healey, A.M.; Weller, M.T.; Johnson, G.M.","The synthesis and characterisation of JBW-type zeolites. Part A: sodium/potassium aluminosilicate, Na2 K (Al3 Si3 O12) * 0.5(H2 O)","Microporous and Mesoporous Materials","2000","37","","153","163","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526301","15.6241","","8.2586","","5.2442","","90","","90","","90","","676.676","","","","","","","","","","","","","6","P m n 21","P 2ac -2","31","","Na2 Rb (Al3 Ge3 O12) (H2 O)","","- Al3 Ge3 H2 Na2 O13 Rb -","- Al3 Ge3 Na2 O13 Rb -","- Al6 Ge6 Na4 O26 Rb2 -","2","0.5","","Healey, A.M.; Henry, P.F.; Weller, M.T.; Johnson, G.M.; Webster, M.; Genge, A.J.","The synthesis and characterisation of JBW-type zeolites. Part B: Sodium/rubidium aluminogermanate, Na2 Rb (Al3 Ge3 O12) * (H2 O)","Microporous and Mesoporous Materials","2000","37","","165","174","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526305","2.8796","","2.8796","","14.2554","","90","","90","","120","","102.37","","","","","","","","","","","","","5","R -3 m :H","-R 3 2""","166","","Li0.966 (Ni0.7 Fe0.15 Co0.15)1.03 O2","","- Co0.1545 Fe0.1545 Li0.966 Ni0.721 O2 -","- Co0.155 Fe0.155 Li0.966 Ni0.724 O2 -","- Co0.465 Fe0.465 Li2.898 Ni2.172 O6 -","3","0.0833333","","Prado, G.; Delmas, C.; Fournes, L.","Mixed cobalt and iron substituted lithium nickelate: a structural and electrochemical study","Solid State Ionics","2000","138","","19","30","","","","","","","","","","","","","","","","","","","","","","has coordinates","147452","2020-10-21","18:00:00",""
"1526306","2.8863","","2.8863","","14.2456","","90","","90","","120","","102.777","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","Li0.958 (Ni0.9 Fe0.1)1.042 O2","","- Fe0.1042 Li0.958 Ni0.9378 O2 -","- Fe0.104 Li0.958 Ni0.938 O2 -","- Fe0.312 Li2.874 Ni2.814 O6 -","3","0.0833333","","Prado, G.; Delmas, C.; Fournes, L.","Mixed cobalt and iron substituted lithium nickelate: a structural and electrochemical study","Solid State Ionics","2000","138","","19","30","","","","","","","","","","","","","","","","","","","","","","has coordinates","147454","2020-10-21","18:00:00",""
"1526309","5.505","","11.699","","14.276","","90","","90","","90","","919.417","","","","","","","","","","","","","4","P c 21 n","P -2n -2ac","33","","Bi Cd (V O4) O","","- Bi Cd O5 V -","- Bi Cd O5 V -","- Bi8 Cd8 O40 V8 -","8","2","","Radosavljevic, I.; Sleight, A.W.; Howard, J.A.K.","Synthesis and structure of two new bismuth cadmium vanadates, Bi Cd V O5 and Bi Cd2 V O6, and structures of Bi Ca2 As O6 and Bi Mg2 P O6","International Journal of Inorganic Materials","2000","2","","543","550","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526310","3.815","","26.3189","","6.511","","90","","90","","90","","653.747","","","","","","","","","","","","","3","A m m 2","A 2 -2","38","","Zr5 Pd9 P7","","- P7 Pd9 Zr5 -","- P7 Pd9 Zr5 -","- P14 Pd18 Zr10 -","2","0.25","","Heerdmann, A.; Mewis, A.; Johrendt, D.","Palladiumpnictide des Zirconiums und Hafniums mit einem Metall: Nichtmetall-Verhaeltnis von 2:1","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","1393","1399","","","","","","","","","","","","","","","","","","","","","","has coordinates","147459","2020-10-21","18:00:00",""
"1526311","8.88479","","11.97231","","5.54532","","90","","90","","90","","589.864","","","","","","","","","","","","","4","C m c 21","C 2c -2","36","","Bi Ca2 (As O4) O2","","- As Bi Ca2 O6 -","- As Bi Ca2 O6 -","- As4 Bi4 Ca8 O24 -","4","0.5","","Radosavljevic, I.; Howard, J.A.K.; Sleight, A.W.","Synthesis and structure of two new bismuth cadmium vanadates, Bi CdV O5 and Bi Cd2 V O6, and structures of Bi Ca2 As O6 and Bi Mg2 PO6","International Journal of Inorganic Materials","2000","2","","543","550","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526312","3.776","","26.382","","6.5","","90","","90","","90","","647.52","","","","","","","","","","","","","3","A m m 2","A 2 -2","38","","Hf5 Pd9 P7","","- Hf5 P7 Pd9 -","- Hf5 P7 Pd9 -","- Hf10 P14 Pd18 -","2","0.25","","Heerdmann, A.; Johrendt, D.; Mewis, A.","Palladiumpnictide des Zirconiums und Hafniums mit einem Metall:Nichtmetall-Verhaeltnis von 2:1","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","1393","1399","","","","","","","","","","","","","","","","","","","","","","has coordinates","147461","2020-10-21","18:00:00",""
"1526313","5.2743","","7.8088","","11.8948","","90","","90","","90","","489.899","","","","","","","","","","","","","4","P m c n","-P 2n 2a","62","","Bi Mg2 (P O4) O2","","- Bi Mg2 O6 P -","- Bi Mg2 O6 P -","- Bi4 Mg8 O24 P4 -","4","0.5","","Radosavljevic, I.; Howard, J.A.K.; Sleight, A.W.","Synthesis and structure of two new bismuth cadmium vanadates, Bi CdV O5 and Bi Cd2 V O6, and structures of Bi Ca2 As O6 and Bi Mg2 PO6","International Journal of Inorganic Materials","2000","2","","543","550","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526314","3.887","","19.288","","6.69","","90","","90","","90","","501.566","","","","","","","","","","","","","3","P m m n :2","-P 2ab 2a","59","","Zr Pd As","","- As Pd Zr -","- As Pd Zr -","- As10 Pd10 Zr10 -","10","1.25","","Heerdmann, A.; Johrendt, D.; Mewis, A.","Palladiumpnictide des Zirconiums und Hafniums mit einem Metall:Nichtmetall-Verhaeltnis von 2:1","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","1393","1399","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526315","6.814","","4.289","","7.87","","90","","90","","90","","230.003","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Zr Pd Sb","","- Pd Sb Zr -","- Pd Sb Zr -","- Pd4 Sb4 Zr4 -","4","0.5","","Heerdmann, A.; Johrendt, D.; Mewis, A.","Palladiumpnictide des Zirconiums und Hafniums mit einem Metall:Nichtmetall-Verhaeltnis von 2:1","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","1393","1399","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526317","10.27188","","10.27188","","10.27188","","90","","90","","90","","1083.8","","","","","","","","","","","","","2","P m -3 n","-P 4n 2 3","223","","","","- Rb6.148 Si46.27 -","- Rb6.148 Si46.274 -","- Rb6.148 Si46.274 -","1","0.0208333","","Ramachandran, G.K.; McMillan, P.F.; Dong, J.; Sankey, O.F.","K7.62(1) Si46 and Rb6.15(2) Si46: two structure I clathrates with fully occupied framework sites","Journal of Solid State Chemistry","2000","154","","626","634","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1526318","10.66771","","10.66771","","10.66771","","90","","90","","90","","1213.99","","","","","","","","","","","","","2","P m -3 n","-P 4n 2 3","223","","K7.52 Ge44.05","","- Ge44.05 K7.52 -","- Ge44.05 K7.522 -","- Ge44.05 K7.522 -","1","0.0208333","","Ramachandran, G.K.; McMillan, P.F.; Sankey, O.F.; Dong, J.","K7.62(1) Si46 and Rb6.15(2) Si46: two structure I clathrates with fully occupied framework sites","Journal of Solid State Chemistry","2000","154","","626","634","","","","","","","","","","","","","","","","","","","","","","has coordinates","147469","2020-10-21","18:00:00",""
"1526323","5.987","","5.987","","11.979","","90","","90","","90","","429.377","","","","","","","","","","","","","4","I -4 2 d","I -4 2bw","122","","","","- Cu In Se Te -","- Cu In Se Te -","- Cu4 In4 Se4 Te4 -","4","0.25","","Rashmi; Suri, D.K.","X-ray powder diffraction study of Cu In Se Te","Powder Diffraction","2000","15","","65","68","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1526324","14.222","","14.222","","30.165","","90","","90","","120","","5283.91","","","","","","","","","","","","","15","R 3 m :H","R 3 -2""","160","","Zr3 (Ca2.7 Mn Fe Na0.846 Ce0.33 Sr0.12) (Si0.96 Al0.52 Ti0.3 Nb0.2) (Zr1.2 Fe0.302 Na16.707 K0.3 Sr0.333) (Si24 O72) O1.17 (O H)3.31 Cl0.53 (H2 O)0.98","","- Al0.52 Ca2.7 Ce0.33 Cl0.53 Fe1.302 H5.27 K0.3 Mn Na17.553 Nb0.2 O77.46 Si24.96 Sr0.453 Ti0.3 Zr4.2 -","- Al0.52 Ca2.7 Ce0.33 Cl0.53 Fe1.302 K0.3 Mn1.002 Na17.553 Nb0.2 O77.46 Si24.96 Sr0.453 Ti0.3 Zr4.2 -","- Al1.56 Ca8.1 Ce0.99 Cl1.59 Fe3.906 K0.9 Mn3.006 Na52.659 Nb0.6 O232.38 Si74.88 Sr1.359 Ti0.9 Zr12.6 -","3","0.166667","","Rastsvetaeva, R.K.; Khomyakov, A.P.","Crystal structure of a hyperzirconium analog of eudialyte","Kristallografiya","2000","45","","251","253","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526325","5.436","","5.436","","12.068","","90","","90","","90","","356.611","","","","","","","","","","","","","4","I 41/a :1","I 4bw -1bw","88","","Pb (Mo0.9 W0.1) O4","","- Mo0.9 O4 Pb W0.1 -","- Mo0.9 O4 Pb W0.1 -","- Mo3.6 O16 Pb4 W0.4 -","4","0.25","","Hibbs, D.E.; Jury, C.M.; Leverett, P.; Plimer, I.R.; Williams, P.A.","An explanation for the origin of hemihedrism in wulfenite: the single crystal structures of I41/a and I4- tungstenian wulfenites","Mineralogical Magazine (1969-)","2000","64","","1057","1062","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526326","14.205","","14.205","","30.265","","90","","90","","120","","5288.76","","","","","","","","","","","","","15","R 3 :H","R 3","146","","Zr3 (Mn2.1 Ca1.77 Ce0.63 Na1.35 Sr0.15) (Fe1.5 Zr0.63 Na0.57 Nb0.132 Ti0.168 Si1.9 Al0.1) (Na14.07 Sr0.45 K0.18) (Si3 O9)2 (Si9 O27)2 (O1.37 (O H)2.71) Cl0.3 (H2 O)1.52","","- Al0.1 Ca1.77 Ce0.63 Cl0.3 Fe1.5 H5.75 K0.18 Mn2.1 Na15.99 Nb0.132 O77.6 Si25.9 Sr0.6 Ti0.168 Zr3.63 -","- Al0.1 Ca1.77 Ce0.63 Cl0.3 Fe1.5 K0.18 Mn2.1 Na15.99 Nb0.132 O77.6 Si25.9 Sr0.6 Ti0.168 Zr3.63 -","- Al0.3 Ca5.31 Ce1.89 Cl0.9 Fe4.5 K0.54 Mn6.3 Na47.97 Nb0.396 O232.8 Si77.7 Sr1.8 Ti0.504 Zr10.89 -","3","0.333333","","Rastsvetaeva, R.K.; Khomyakov, A.P.","Crystal structure of a new Mn, Na-ordered analog of eudialyte with R3 symmetry","Kristallografiya","2000","45","","649","652","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526327","5.441","","5.441","","12.068","","90","","90","","90","","357.267","","","","","","","","","","","","","4","I -4","I -4","82","","Pb (Mo0.64 W0.36) O4","","- Mo0.64 O4 Pb W0.36 -","- Mo0.64 O4 Pb W0.36 -","- Mo2.56 O16 Pb4 W1.44 -","4","0.5","","Hibbs, D.E.; Jury, C.M.; Williams, P.A.; Leverett, P.; Plimer, I.R.","An explanation for the origin of hemihedrism in wulfenite: the single crystal structures of I41/a and I4- tungstenian wulfenites","Mineralogical Magazine (1969-)","2000","64","","1057","1062","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526329","5.5328","","5.5334","","7.9109","","90","","89.889","","90","","242.193","","","","","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","(Na0.5 La0.5) (Mg0.5 W0.5) O3","","- La0.5 Mg0.5 Na0.5 O3 W0.5 -","- La0.5 Mg0.5 Na0.5 O3 W0.5 -","- La2 Mg2 Na2 O12 W2 -","4","1","","Hiramatsu, N.; Mishima, T.; Sagala, D.A.","Structural study of complex perovskite (Na, La) (Mg, W) O3","Ceramic Transactions, 13 (Supercond.Ceram.Supercond.)","2000","104","","79","85","","","","","","","","","","","","","","","","","","","","","","has coordinates","147484","2020-10-21","18:00:00",""
"1526331","16.057","","15.711","","27.939","","90","","96.3","","90","","7005.65","","","","","","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- Cs3 Sb7 -","- Cs3 Sb7 -","- Cs48 Sb112 -","16","4","","Hirschle, C.; Roehr, C.","Darstellung und Kristallstruktur der bekannten Zintl-Phasen Cs3 Sb7 und Cs4 Sb2","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","1992","1998","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1526332","9.997","","9.997","","9.997","","90","","90","","90","","999.1","","","","","","","","","","","","","7","F m -3 m","-F 4 2 3","225","","K Cu (Co (C N)6) (H2 O)9","","- C6 H18 Co Cu K N6 O9 -","- C6 Co Cu K N6 O9 -","- C12 Co2 Cu2 K2 N12 O18 -","2","0.0104167","","Ratuszna, A.; Malecki, G.","Crystal structure of cubic K Me (M (C N)6)2 and monoclinic Mn3 (Fe (C N)6)2 with Me = Co, Ni, Cu; M = Co, Fe","Materials Science Forum","2000","321","","947","953","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526333","15.985","","6.319","","10.995","","90","","90","","90","","1110.6","","","","","","","","","","","","","2","P n m a","-P 2ac 2n","62","","","","- Cs4 Sb2 -","- Cs4 Sb2 -","- Cs16 Sb8 -","4","0.5","","Hirschle, C.; Roehr, C.","Darstellung und Kristallstruktur der bekannten Zintl-Phasen Cs3 Sb7und Cs4 Sb2","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","1992","1998","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1526334","10.227","","10.227","","10.227","","90","","90","","90","","1069.66","","","","","","","","","","","","","6","F m -3 m","-F 4 2 3","225","","K Co (Co (C N)6) (H2 O)11.28","","- C6 H22.56 Co2 K N6 O11.28 -","- C6 Co2 K N6 O11.28 -","- C12 Co4 K2 N12 O22.56 -","2","0.0104167","","Ratuszna, A.; Malecki, G.","Crystal structure of cubic K Me (M (C N)6)2 and monoclinic Mn3 (Fe (C N)6)2 with Me = Co, Ni, Cu; M = Co, Fe","Materials Science Forum","2000","321","","947","953","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526335","10.093","","10.093","","10.093","","90","","90","","90","","1028.16","","","","","","","","","","","","","7","F m -3 m","-F 4 2 3","225","","K Ni (Co (C N)6) (H2 O)9.6","","- C6 H19.2 Co K N6 Ni O9.6 -","- C6 Co K N6 Ni O9.6 -","- C12 Co2 K2 N12 Ni2 O19.2 -","2","0.0104167","","Ratuszna, A.; Malecki, G.","Crystal structure of cubic K Me (M (C N)6)2 and monoclinic Mn3 (Fe (C N)6)2 with Me = Co, Ni, Cu; M = Co, Fe","Materials Science Forum","2000","321","","947","953","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526336","10.121","","10.117","","10.136","","90","","92.92","","90","","1036.52","","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Mn3 (Fe (C N)6)2 (H2 O)2","","- C12 H4 Fe2 Mn3 N12 O2 -","- C12 Fe2 Mn3 N12 O2 -","- C24 Fe4 Mn6 N24 O4 -","2","0.5","","Ratuszna, A.; Malecki, G.","Crystal structure of cubic K Me (M (C N)6)2 and monoclinic Mn3 (Fe (C N)6)2 with Me = Co, Ni, Cu; M = Co, Fe","Materials Science Forum","2000","321","","947","953","","","","","","","","","","","","","","","","","","","","","","has coordinates","147493","2020-10-21","18:00:00",""
"1526338","2.991","","2.991","","23.396","","90","","90","","120","","181.261","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","Ti4 Al N3","","- Al N3 Ti4 -","- Al N3 Ti4 -","- Al2 N6 Ti8 -","2","0.0833333","","Rawn, C.J.; Barsoum, M.W.; El-Raghy, T.; Procipio, A.; Hubbard, C.R.; Hoffmann, C.M.","Structure of Ti4 Al N3 - a layered Mn+1 A Xn nitride","Materials Research Bulletin","2000","35","","1785","1796","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526339","3.0654","","3.0654","","17.635","","90","","90","","120","","143.509","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","Ti3 Si C2","","- C2 Si Ti3 -","- C2 Si Ti3 -","- C4 Si2 Ti6 -","2","0.0833333","","Rawn, C.J.; Payzant, E.A.; Hubbard, C.R.; Barsoum, M.W.; El-Raghy, T.","Structure of Ti3 Si C2","Materials Science Forum","2000","321","","889","892","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526341","9.5611","","18.04579","","5.3056","","90","","102.569","","90","","893.477","","","","","","","","","","","","","7","C 1 2/m 1","-C 2y","12","","(Na0.13 Ca0.41 Mg0.45 Mn1.01) (Mg4.87 Mn0.13) Si8 O22 (O H)2","","- Ca0.41 H2 Mg5.32 Mn1.14 Na0.13 O24 Si8 -","- Ca0.41 H2 Mg5.32 Mn1.14 Na0.13 O24 Si8 -","- Ca0.82 H4 Mg10.64 Mn2.28 Na0.26 O48 Si16 -","2","0.25","","Reece, J.J.; Redfern, S.A.T.; Welch, M.D.; Henderson, C.M.B.","Mn-Mg disordering in cummingtonite: a high-temperature neutron powder diffraction study","Mineralogical Magazine (1969-)","2000","64","","255","266","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526342","9.5824","","18.07669","","5.3104","","90","","102.493","","90","","898.077","","","","","","","","","","","","","7","C 1 2/m 1","-C 2y","12","","(Na0.13 Ca0.41 Mg0.452 Mn1.008) (Mg4.866 Mn0.134) Si8 O22 (O H)2","","- Ca0.41 H2 Mg5.318 Mn1.142 Na0.13 O24 Si8 -","- Ca0.41 H2 Mg5.318 Mn1.142 Na0.13 O24 Si8 -","- Ca0.82 H4 Mg10.636 Mn2.284 Na0.26 O48 Si16 -","2","0.25","","Reece, J.J.; Welch, M.D.; Redfern, S.A.T.; Henderson, C.M.B.","Mn-Mg disordering in cummingtonite: a high-temperature neutron powder diffraction study","Mineralogical Magazine (1969-)","2000","64","","255","266","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526347","9.513","","9.0486","","17.49","","90","","114.7","","90","","1367.78","","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(Ga12 P12 O48 (O H)4) (C6 H18 N2)2 (H2 O)4","","- C12 H48 Ga12 N4 O56 P12 -","- C12 Ga12 N4 O56 P12 -","- C12 Ga12 N4 O56 P12 -","1","0.25","","Reinert, P.; Marler, B.; Patarin, J.","Synthesis and characterization of the new microporous gallophosphate Mu-8","Microporous and Mesoporous Materials","2000","39","","509","517","","","","","","","","","","","","","","","","","","","","","","has coordinates","147511","2020-10-21","18:00:00",""
"1526349","5.4324","","5.4324","","5.4324","","90","","90","","90","","160.315","","","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","Nd D2.61","","- D2.61 Nd -","- D2.6104 Nd -","- D10.4416 Nd4 -","4","0.0208333","","Renaudin, G.; Fischer, P.; Yvon, K.","Neodymium trihydride, Nd H3, with tysonite type structure","Journal of Alloys Compd.","2000","313","","10","14","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526351","6.6581","","6.6581","","6.8778","","90","","90","","120","","264.047","","","","","","","","","","","","","2","P -3 c 1","-P 3 2""c","165","","Nd D3","","- D3 Nd -","- D3 Nd -","- D18 Nd6 -","6","0.5","","Renaudin, G.; Fischer, P.; Yvon, K.","Neodymium trihydride, Nd H3, with tysonite type structure","Journal of Alloys Compd.","2000","313","","10","14","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526365","3.96309","","3.96309","","3.96309","","90","","90","","90","","62.245","","","","","","","","","","","","","5","P m -3 m","-P 4 2 3","221","","(Ba0.5 La0.5) (Mn0.5 Ru0.5) O3","","- Ba0.5 La0.5 Mn0.5 O3 Ru0.5 -","- Ba0.5 La0.5 Mn0.5 O3 Ru0.5 -","- Ba0.5 La0.5 Mn0.5 O3 Ru0.5 -","1","0.0208333","","Horikubi, T.; Kamegashira, N.","Crystal structure and magnetic properties of A0.5 La0.5 Mn0.5 Ru0.5 O3 (A = Ca, Sr, Ba)","Materials Chemistry and Physics","2000","65","","316","319","","","","","","","","","","","","","","","","","","","","","","has coordinates","147532","2020-10-21","18:00:00",""
"1526367","5.5316","","7.753","","5.4775","","90","","90","","90","","234.911","","","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","(Ca0.5 La0.5) (Mn0.5 Ru0.5) O3","","- Ca0.5 La0.5 Mn0.5 O3 Ru0.5 -","- Ca0.5 La0.5 Mn0.5 O3 Ru0.5 -","- Ca2 La2 Mn2 O12 Ru2 -","4","0.5","","Horikubi, T.; Kamegashira, N.","Crystal structure and magnetic properties of A0.5 La0.5 Mn0.5 Ru0.5O3 (A = Ca, Sr, Ba)","Materials Chemistry and Physics","2000","65","","316","319","","","","","","","","","","","","","","","","","","","","","","has coordinates","147534","2020-10-21","18:00:00",""
"1526380","2.9517","","2.9517","","7.217","","90","","90","","120","","54.454","","","","","","","","","","","","","2","R -3 m :H","-R 3 2""","166","","","","- Ni O -","- Ni O -","- Ni3 O3 -","3","0.0833333","","Rodic, D.; Rundlof, H.; Spasojevic, V.; Kusigerski, V.; Tellgren, R.","Magnetic ordering in polycrystalline Nix Zn1-x O solid solutions","Physica Status Solidi, Sectio B: Basic Research","2000","218","","527","536","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1526381","5.667","","15.666","","17.534","","90","","90","","90","","1556.66","","","","","","","","","","","","","4","I m m a","-I 2b 2","74","","La5 Cu6 O4 S7","","- Cu6 La5 O4 S7 -","- Cu6 La5 O4 S7 -","- Cu24 La20 O16 S28 -","4","0.25","","Huang, F.Q.; Brazis, P.; Kannewurf, C.R.; Ibers, J.A.","Synthesis, structure, electrical conductivity, and band structure of the rare-earth copper oxychalcogenide La5 Cu6 O4 S7","Journal of Solid State Chemistry","2000","155","","366","371","","","","","","","","","","","","","","","","","","","","","","has coordinates","147552","2020-10-21","18:00:00",""
"1526382","2.9533","","2.9533","","7.2281","","90","","90","","120","","54.597","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","(Ni0.9 Zn0.1) O","","- Ni0.9 O Zn0.1 -","- Ni0.9 O Zn0.1 -","- Ni2.7 O3 Zn0.3 -","3","0.0833333","","Rodic, D.; Spasojevic, V.; Kusigerski, V.; Tellgren, R.; Rundlof, H.","Magnetic ordering in polycrystalline Nix Zn1-x O solid solutions","Physica Status Solidi, Sectio B: Basic Research","2000","218","","527","536","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526386","2.9672","","2.9672","","7.271","","90","","90","","120","","55.439","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","(Ni0.7 Zn0.3) O","","- Ni0.7 O Zn0.3 -","- Ni0.7 O Zn0.3 -","- Ni2.1 O3 Zn0.9 -","3","0.0833333","","Rodic, D.; Rundlof, H.; Spasojevic, V.; Kusigerski, V.; Tellgren, R.","Magnetic ordering in polycrystalline Nix Zn1-x O solid solutions","Physica Status Solidi, Sectio B: Basic Research","2000","218","","527","536","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526395","8.379","","8.379","","8.379","","90","","90","","90","","588.27","","","","","","","","","","","","","4","P 21 3","P 2ac 2ab 3","198","","Hg3 (As O4) Cl","","- As Cl Hg3 O4 -","- As Cl Hg3 O4 -","- As4 Cl4 Hg12 O16 -","4","0.333333","","Romanenko, G.V.; Borisov, S.V.","Microtwinning in the crystal structure of kuznetsovite Hg3 As O4 Cl","Zhurnal Strukturnoi Khimii (Issue-No. from 1981)","2000","41","","1078","1079","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526399","5.4229","","7.6559","","5.4306","","90","","90","","90","","225.463","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","(La0.53 Ca0.47) (Mn O3)","","- Ca0.47 La0.53 Mn O3 -","- Ca0.47 La0.53 Mn O3 -","- Ca1.88 La2.12 Mn4 O12 -","4","0.5","","Huang, Q.; Lynn, J.W.; Ghosh, K.; Erwin, R.W.; Dender, D.C.; Smolyaninova, V.N.; Santoro, A.; Greene, R.L.","Temperature and field dependence of the phase separation, structure and magnetic ordering in La1-x Cax Mn O3 (x = 0.47, 0.50 and 0.53)","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2000","61","","8895","8905","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526400","5.305","","6.551","","35.823","","90","","90","","90.62","","1244.89","","","","","","","","","","","","","3","P 1 1 21","P 2c","4","","P4 W20 O68","","- O68 P4 W20 -","- O68 P4 W20 -","- O68 P4 W20 -","1","0.5","","Roussel, P.; Labbe, P.; Leligny, H.; Groult, D.; Foury-Leylekian, P.; Pouget, J.P.","P4 W20 O68: a complex charge-density-wave modulated structure with an antiferroelectric-like lattice distortion","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2000","62","","176","187","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1526402","5.6328","","5.6328","","7.9877","","90","","90","","90","","253.437","","","","","","","","","","","","","5","I 4/m","-I 4","87","","Ba La Ru Cu O6","","- Ba Cu La O6 Ru -","- Ba Cu La O6 Ru -","- Ba2 Cu2 La2 O12 Ru2 -","2","0.125","","Rozier, P.; Jansson, K.; Nygren, M.","Investigation of structural and catalytic properties of Ba La4 Cu5-y Ruy O13-d with 0.0 < y <3.0 and of La Ba Cu Ru O6","Materials Research Bulletin","2000","35","","1391","1400","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526403","15.309","","3.61","","7.335","","90","","101.84","","90","","396.748","","","","","","","","","","","","","3","C 1 m 1","C -2y","8","","Cu2.324 V4 O11","","- Cu2.324 O11 V4 -","- Cu2.324 O11 V4 -","- Cu4.648 O22 V8 -","2","0.5","","Rozier, P.; Satto, C.; Galy, J.","The vanadium oxide bronze Cu2.33-x V4 O11. Solid state chemistry, XRD","Solid State Sciences","2000","2","","595","605","","","","","","","","","","","","","","","","","","","","","","has coordinates","147582","2020-10-21","18:00:00",""
"1526406","11.3685","","11.3685","","11.3685","","90","","90","","90","","1469.3","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","Ti3 Ni Al2 N","","- Al2 N Ni Ti3 -","- Al2 N Ni Ti3 -","- Al32 N16 Ni16 Ti48 -","16","0.0833333","","Huneau, B.; Bauer, J.; Ding Jinjun; Rogl, P.; Ding, X.Y.; Bohn, M.","Experimental investigation in the quaternary systems Ti - Ni - Al and Ti - Ni - Al - O","Journal of Solid State Chemistry","2000","155","","71","77","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526407","3.86601","","3.86601","","12.6497","","90","","90","","90","","189.063","","","","","","","","","","","","","5","P 4/n m m :2","-P 4a 2a","129","","(La0.8 Ba0.2) (La0.2 Gd0.8) Cu O4","","- Ba0.2 Cu Gd0.8 La O4 -","- Ba0.2 Cu Gd0.8 La O4 -","- Ba0.4 Cu2 Gd1.6 La2 O8 -","2","0.125","","Rukang, L.; Graves, C.","Preparation and structure of the Ba-stabilised T(*) type cuprate La Ba0.2 Gd0.8 Cu O4 and its fluorinated phase","Physica C (Amsterdam)","2000","339","","148","154","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526408","11.3797","","11.3797","","11.3797","","90","","90","","90","","1473.64","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","Ti3 Ni Al2 O","","- Al2 Ni O Ti3 -","- Al2 Ni O Ti3 -","- Al32 Ni16 O16 Ti48 -","16","0.0833333","","Huneau, B.; Rogl, P.; Ding Jinjun; Bauer, J.; Bohn, M.; Ding, X.Y.","Experimental investigation in the quaternary systems Ti - Ni - Al and Ti - Ni - Al - O","Journal of Solid State Chemistry","2000","155","","71","77","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526409","3.92096","","3.92096","","12.6841","","90","","90","","90","","195.004","","","","","","","","","","","","","6","P 4/n m m :2","-P 4a 2a","129","","(La0.8 Ba0.2) (La0.2 Gd0.8) Cu O4 F0.38","","- Ba0.2 Cu F0.38 Gd0.8 La O4 -","- Ba0.2 Cu F0.38 Gd0.8 La O4 -","- Ba0.4 Cu2 F0.76 Gd1.6 La2 O8 -","2","0.125","","Rukang, L.; Graves, C.","Preparation and structure of the Ba-stabilised T(*) type cuprate LaBa0.2 Gd0.8 Cu O4 and its fluorinated phase","Physica C (Amsterdam)","2000","339","","148","154","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526410","3.8753","","3.8638","","7.7901","","90","","90","","90","","116.644","","","","","","","","","","","","","4","P m m m","-P 2 2","47","","La0.64 Li0.08 Ti O3","","- La0.64 Li0.08 O3 Ti -","- La0.64 O3 Ti -","- La1.28 O6 Ti2 -","2","0.25","","Ibarra, J.; Sanz, J.; Leon, C.; Varez, A.; Santamaria, J.; Torres-Martinez, L.M.","Influence of composition on the structure and conductivity of the fast ionic conductors La2/3-x Li3x Ti O3 (0.03 < x < 0.167)","Solid State Ionics","2000","134","","219","228","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526411","3.8756","","3.8649","","7.7852","","90","","90","","90","","116.613","","","","","","","","","","","","","4","P m m m","-P 2 2","47","","La0.62 Li0.14 Ti O3","","- La0.62 Li0.14 O3 Ti -","- La0.62 O3 Ti -","- La1.24 O6 Ti2 -","2","0.25","","Ibarra, J.; Varez, A.; Leon, C.; Santamaria, J.; Torres-Martinez, L.M.; Sanz, J.","Influence of composition on the structure and conductivity of the fast ionic conductors La2/3-x Li3x Ti O3 (0.03 < x < 0.167)","Solid State Ionics","2000","134","","219","228","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526413","3.8716","","3.8675","","7.7734","","90","","90","","90","","116.394","","","","","","","","","","","","","4","P m m m","-P 2 2","47","","La0.6 Li0.2 Ti O3","","- La0.6 Li0.2 O3 Ti -","- La0.6 O3 Ti -","- La1.2 O6 Ti2 -","2","0.25","","Ibarra, J.; Varez, A.; Santamaria, J.; Leon, C.; Torres-Martinez, L.M.; Sanz, J.","Influence of composition on the structure and conductivity of the fast ionic conductors La2/3-x Li3x Ti O3 (0.03 < x < 0.167)","Solid State Ionics","2000","134","","219","228","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526415","3.8671","","3.8654","","7.7727","","90","","90","","90","","116.185","","","","","","","","","","","","","4","P m m m","-P 2 2","47","","La0.595 Li0.215 Ti O3","","- La0.595 Li0.215 O3 Ti -","- La0.595 O3 Ti -","- La1.19 O6 Ti2 -","2","0.25","","Ibarra, J.; Varez, A.; Sanz, J.; Santamaria, J.; Leon, C.; Torres-Martinez, L.M.","Influence of composition on the structure and conductivity of the fast ionic conductors La2/3-x Li3x Ti O3 (0.03 < x < 0.167)","Solid State Ionics","2000","134","","219","228","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526417","3.8727","","3.8727","","7.751","","90","","90","","90","","116.248","","","","","","","","","","","","","3","P 4/m m m","-P 4 2","123","","La0.565 Li0.305 Ti O3","","- La0.565 O3 Ti -","- La0.565 O3 Ti -","- La1.13 O6 Ti2 -","2","0.125","","Ibarra, J.; Torres-Martinez, L.M.; Leon, C.; Varez, A.; Santamaria, J.; Sanz, J.","Influence of composition on the structure and conductivity of the fast ionic conductors La2/3-x Li3x Ti O3 (0.03 < x < 0.167)","Solid State Ionics","2000","134","","219","228","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526419","3.87","","3.87","","7.7452","","90","","90","","90","","115.999","","","","","","","","","","","","","3","P 4/m m m","-P 4 2","123","","La0.5 Li0.5 Ti O3","","- La0.5 O3 Ti -","- La0.5 O3 Ti -","- La O6 Ti2 -","2","0.125","","Ibarra, J.; Varez, A.; Leon, C.; Sanz, J.; Santamaria, J.; Torres-Martinez, L.M.","Influence of composition on the structure and conductivity of the fast ionic conductors La2/3-x Li3x Ti O3 (0.03 < x < 0.167)","Solid State Ionics","2000","134","","219","228","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526420","3.8703","","3.8703","","3.8703","","90","","90","","90","","57.974","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","La0.50 Li0.50 Ti O3","","- La0.5 Li0.5 O3 Ti -","- La0.5 Li0.5 O3 Ti -","- La0.5 Li0.5 O3 Ti -","1","0.0208333","","Ibarra, J.; Varez, A.; Leon, C.; Torres-Martinez, L.M.; Santamaria, J.; Sanz, J.","Influence of composition on the structure and conductivity of the fast ionic conductors La2/3-x Li3x Ti O3 (0.03 < x < 0.167)","Solid State Ionics","2000","134","","219","228","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526421","5.9","","5.9","","14.433","","90","","90","","120","","435.102","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","Rb (Zn F3)","","- F3 Rb Zn -","- F3 Rb Zn -","- F18 Rb6 Zn6 -","6","0.25","","Rybczynski, J.; Ratuszna, A.; Waskowska, A.; Daniel, P.; Gesland, J.Y.","Investigation of the crystal structure of the hexagonal Rb Zn F3 perovskite by powder and single crystal X-ray diffraction methods","Materials Science Forum","2000","321","","942","946","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526424","6.776","","17.466","","7.722","","90","","94.47","","90","","911.116","","","","","","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","(Ba0.51 Sr1.49) (Al4 Si12 O32) (H2 O)9.554","","- Al4 Ba0.51 H19.108 O41.554 Si12 Sr1.49 -","- Al3.996 Ba0.51 O41.554 Si12.004 Sr1.49 -","- Al3.996 Ba0.51 O41.554 Si12.004 Sr1.49 -","1","0.25","","Sacerdoti, M.; Quartieri, S.; Vezzalini, G.","Dehydration mechanism in brewsterite: single-crystal X-ray diffraction study","Microporous and Mesoporous Materials","2000","41","","107","118","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526425","3.87173","","3.87173","","28.60475","","90","","90","","90","","428.794","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","(Nd0.675 Ce0.325)2 (Ba0.664 Nd0.336)2 Cu3 O8.75","","- Ba1.328 Ce0.65 Cu3 Nd2.022 O8.75 -","- Ba1.328 Ce0.65 Cu3 Nd2.022 O8.752 -","- Ba2.656 Ce1.3 Cu6 Nd4.044 O17.504 -","2","0.0625","","Idemoto, Y.; Richardson, J.W.jr.; Hayakawa, Y.; Koura, N.; Loong, C.-K.","Oxygen-content dependence of crystal structure and Tc of (Nd0.675 Ce0.325)2 (Ba0.664 Nd0.336)2 Cu3.00 Oy","Physica C (Amsterdam)","2000","329","","29","36","","","","","","","","","","","","","","","","","","","","","","has coordinates","147606","2020-10-21","18:00:00",""
"1526426","6.78","","17.455","","7.705","","90","","94.59","","90","","908.923","","","","","","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","(Ba0.51 Sr1.49) (Al4 Si12 O32) (H2 O)8.73","","- Al4 Ba0.51 H17.46 O40.73 Si12 Sr1.49 -","- Al3.996 Ba0.51 O40.73 Si12.004 Sr1.49 -","- Al3.996 Ba0.51 O40.73 Si12.004 Sr1.49 -","1","0.25","","Sacerdoti, M.; Vezzalini, G.; Quartieri, S.","Dehydration mechanism in brewsterite: single-crystal X-ray diffraction study","Microporous and Mesoporous Materials","2000","41","","107","118","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526428","6.804","","17.285","","7.645","","90","","94.6","","90","","896.21","","","","","","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","(Ba0.51 Sr1.49) (Al4 Si12 O32) (H2 O)3.12","","- Al4 Ba0.51 H6.24 O35.12 Si12 Sr1.49 -","- Al3.996 Ba0.51 O35.12 Si12.004 Sr1.49 -","- Al3.996 Ba0.51 O35.12 Si12.004 Sr1.49 -","1","0.25","","Sacerdoti, M.; Quartieri, S.; Vezzalini, G.","Dehydration mechanism in brewsterite: single-crystal X-ray diffraction study","Microporous and Mesoporous Materials","2000","41","","107","118","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526429","6.785","","16.988","","7.645","","90","","94.6","","90","","878.352","","","","","","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","(Ba0.51 Sr1.49) (Al4 Si12 O32) (H2 O)2.13","","- Al4 Ba0.51 H4.26 O34.13 Si12 Sr1.49 -","- Al3.996 Ba0.51 O34.128 Si12.004 Sr1.49 -","- Al3.996 Ba0.51 O34.128 Si12.004 Sr1.49 -","1","0.25","","Sacerdoti, M.; Quartieri, S.; Vezzalini, G.","Dehydration mechanism in brewsterite: single-crystal X-ray diffraction study","Microporous and Mesoporous Materials","2000","41","","107","118","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526430","6.627","","16.4","","7.484","","90","","94.04","","90","","811.361","","","","","","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","(Ba0.51 Sr1.49) (Al4 Si12 O32) (H2 O)2.88","","- Al4 Ba0.51 H5.76 O34.88 Si12 Sr1.49 -","- Al3.996 Ba0.508 O34.88 Si12.004 Sr1.492 -","- Al3.996 Ba0.508 O34.88 Si12.004 Sr1.492 -","1","0.25","","Sacerdoti, M.; Vezzalini, G.; Quartieri, S.","Dehydration mechanism in brewsterite: single-crystal X-ray diffraction study","Microporous and Mesoporous Materials","2000","41","","107","118","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526434","13.8028","","8.1392","","4.7494","","90","","95.586","","90","","531.032","","","","","","","","","","","","","2","C 1 2/m 1","-C 2y","12","","S F6","","- F6 S -","- F6 S -","- F36 S6 -","6","0.75","","Isakina, A.P.; Prokhvatilov, A.I.; Rodriguez-Carvajal, J.","Structure and thermal expansion of the low-temperature phase of S F6","Fizika Nizkikh Temperatur","2000","26","","404","414","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526439","8.3017","","8.3017","","8.3017","","90","","90","","90","","572.138","","","","","","","","","","","","","5","F d -3 m :2","-F 4vw 2vw 3","227","","(Fe0.51 Mg0.49) (Cr0.73 Al0.27)2 O4","","- Al0.54 Cr1.46 Fe0.51 Mg0.49 O4 -","- Al0.54 Cr1.46 Fe0.51 Mg0.49 O4 -","- Al4.32 Cr11.68 Fe4.08 Mg3.92 O32 -","8","0.0416667","","Salviulo, G.; della Giusta, A.; Carbonin, S.","Powder and single-crystal X-ray structural refinements on a natural chromite: dependence of site occupancies on experimental strategies","Materials Science Forum","2000","321","","46","52","","","","","","","","","","","","","","","","","","","","","","has coordinates","147624","2020-10-21","18:00:00",""
"1526446","9.837","","9.837","","9.837","","90","","90","","90","","951.893","","","","","","","","","","","","","5","P 21 3","P 2ac 2ab 3","198","","Na2 Fe Ti (P O4)3","","- Fe Na2 O12 P3 Ti -","- Fe Na2 O12 P3 Ti -","- Fe4 Na8 O48 P12 Ti4 -","4","0.333333","","Isasi, J.; Daidouh, A.","Synthesis, structure and conductivity study of new monovalent phosphates with the langbeinite structure","Solid State Ionics","2000","133","","303","313","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526448","9.775","","9.775","","9.775","","90","","90","","90","","934.007","","","","","","","","","","","","","5","P 21 3","P 2ac 2ab 3","198","","Na2 Cr Ti (P O4)3","","- Cr Na2 O12 P3 Ti -","- Cr Na2 O12 P3 Ti -","- Cr4 Na8 O48 P12 Ti4 -","4","0.333333","","Isasi, J.; Daidouh, A.","Synthesis, structure and conductivity study of new monovalent phosphates with the langbeinite structure","Solid State Ionics","2000","133","","303","313","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526453","5.55532","","5.55532","","3.94625","","90","","90","","90","","121.788","","","","","","","","","","","","","4","P 4/m b m","-P 4 2ab","127","","(Na0.8 Sr0.2) (Ta O3)","","- Na0.8 O3 Sr0.2 Ta -","- Na0.8 O3 Sr0.2 Ta -","- Na1.6 O6 Sr0.4 Ta2 -","2","0.125","","Istomin, S.Ya.; Svensson, G.; Hannerz, H.; Koehler, J.","An X-ray powder and electron diffraction study of reduced tantalates with the perovskite structure, Na1-x Srx Ta O3, 0<x<4","Journal of Solid State Chemistry","2000","154","","427","434","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526454","5.5129","","7.8328","","5.53619","","90","","90","","90","","239.061","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","(Na0.9 Sr0.1) (Ta O3)","","- Na0.9 O3 Sr0.1 Ta -","- Na0.9 O3 Sr0.1 Ta -","- Na3.6 O12 Sr0.4 Ta4 -","4","0.5","","Istomin, S.Ya.; Hannerz, H.; Svensson, G.; Koehler, J.","An X-ray powder and electron diffraction study of reduced tantalates with the perovskite structure, Na1-x Srx Ta O3, 0<x<4","Journal of Solid State Chemistry","2000","154","","427","434","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526455","4.7634","","3.4665","","7.7925","","90","","90","","90","","128.672","","","","","","","","","","","","","4","P m m n :2","-P 2ab 2a","59","","Cr S (Br0.67 Cl0.33)","","- Br0.67 Cl0.33 Cr S -","- Br0.67 Cl0.33 Cr S -","- Br1.34 Cl0.66 Cr2 S2 -","2","0.25","","Sassmannshausen, M.; Lutz, H.D.","Preparation and crystal structure of quaternary chromium sulfide halide Cr S Br0.67 Cl0.33","Materials Research Bulletin","2000","35","","2431","2436","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526460","5.5571","","5.5571","","7.9131","","90","","90","","90","","244.367","","","","","","","","","","","","","4","I 4/m","-I 4","87","","Sr2 Ni (W O6)","","- Ni O6 Sr2 W -","- Ni O6 Sr2 W -","- Ni2 O12 Sr4 W2 -","2","0.125","","Iwanaga, D.; Inaguma, Y.; Itoh, M.","Structure and magnetic properties of Sr2 Ni A O6","Materials Research Bulletin","2000","35","","449","457","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526461","3.829","","3.829","","11.47","","90","","90","","90","","168.164","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","(As0.33 Cu0.67) Sr2 Y Cu2 O6.88","","- As0.33 Cu2.67 O6.88 Sr2 Y -","- As0.328 Cu2.668 O6.88 Sr2 Y -","- As0.328 Cu2.668 O6.88 Sr2 Y -","1","0.0625","","Sato, E.; Ishii, O.; Akao, T.; Ohsuna, T.; Hiraga, K.; Kambe, S.","Synthesis of (M0.33 Cu0.67) Sr2 Y Cu2 Oy: a novel layered cuprate with a block layer of (As0.33 Cu0.67) O0.88","Physica C (Amsterdam)","2000","336","","33","42","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526462","7.9174","","7.8765","","7.916","","90","","90.378","","90","","493.642","","","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","Sr2 Ni (Te O6)","","- Ni O6 Sr2 Te -","- Ni O6 Sr2 Te -","- Ni4 O24 Sr8 Te4 -","4","0.5","","Iwanaga, D.; Inaguma, Y.; Itoh, M.","Structure and magnetic properties of Sr2 Ni A O6","Materials Research Bulletin","2000","35","","449","457","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526463","12.1005","","8.6539","","8.6546","","90","","90","","90","","906.28","","","","","","","","","","","","","5","P b c n","-P 2n 2ab","60","","Li2.78 (V0.9 Zr0.1)2 (P O4)3","","- Li2.78 O12 P3 V1.8 Zr0.2 -","- Li2.78 O12 P3 V1.8 Zr0.2 -","- Li11.12 O48 P12 V7.2 Zr0.8 -","4","0.5","","Sato, M.; Ohkawa, H.; Yoshida, K.; Saito, M.; Uematsu, K.; Toda, K.","Enhancement of discharge capacity of Li3 V2 (P O4)3 by stabilizing the orthorhombic phase at room temperature","Solid State Ionics","2000","135","","137","142","","","","","","","","","","","","","","","","","","","","","","has coordinates","147654","2020-10-21","18:00:00",""
"1526465","3.82484","","15.5439","","2.9737","","90","","90","","90","","176.795","","","","","","","","","","","","","5","C m c m","-C 2c 2","63","","K0.8 Ti1.733 Li0.267 O4 (H2 O)0.112","","- H0.224 K0.8 Li0.267 O4.112 Ti1.733 -","- K0.8 Li0.266 O4.112 Ti1.734 -","- K1.6 Li0.532 O8.224 Ti3.468 -","2","0.125","","Izumi, F.; Ikeda, T.; Sasaki, T.; Kumazawa, S.","Disordered distribution of K(+) ions interlayered in Kx Ti2-x/3 Lix/3 O4 (x = 0.8)","Molecular Crystals and Liquid Crystals","2000","341","","253","258","","","","","","","","","","","","","","","","","","","","","","has coordinates","147657","2020-10-21","18:00:00",""
"1526467","5.951","","5.951","","14.191","","90","","90","","120","","435.235","","","","","","","","","","","","","4","R -3 :H","-R 3","148","","Na2 (Sn (O H)6)","","- H6 Na2 O6 Sn -","- H6 Na2 O6 Sn -","- H18 Na6 O18 Sn3 -","3","0.166667","","Jacobs, H.; Stahl, R.","Neubestimmung der Kristallstrukturen der Hexahydroxometallate Na2 Sn (O H)6, K2 Sn (O H)6 und K2 Pb (O H)6","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","1863","1866","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526468","3.9185","","3.9185","","29.519","","90","","90","","90","","453.254","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","K2.18 Ca1.1 Na1.12 Ta2.93 O9.54","","- Ca1.1 K2.18 Na1.12 O9.54 Ta2.93 -","- Ca1.1 K2.18 Na1.12 O9.54 Ta2.93 -","- Ca2.2 K4.36 Na2.24 O19.08 Ta5.86 -","2","0.0625","","Schaak, R.E.; Mallouk, T.E.","Synthesis, proton exchange, and topochemical dehydration of new Ruddlesden-Popper tantalates and titanotantalates","Journal of Solid State Chemistry","2000","155","","46","54","","","","","","","","","","","","","","","","","","","","","","has coordinates","147660","2020-10-21","18:00:00",""
"1526469","6.541","","6.541","","12.813","","90","","90","","120","","474.755","","","","","","","","","","","","","4","R -3 :H","-R 3","148","","K2 (Sn (O H)6)","","- H6 K2 O6 Sn -","- H6 K2 O6 Sn -","- H18 K6 O18 Sn3 -","3","0.166667","","Jacobs, H.; Stahl, R.","Neubestimmung der Kristallstrukturen der Hexahydroxometallate Na2 Sn (O H)6, K2 Sn (O H)6 und K2 Pb (O H)6","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","1863","1866","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526470","3.8903","","3.8903","","16.709","","90","","90","","90","","252.881","","","","","","","","","","","","","6","P 4/m m m","-P 4 2","123","","K1.88 Ca2.08 Ta2 Ti0.93 O10 (H2 O)1.44","","- Ca2.08 H2.88 K1.88 O11.44 Ta2 Ti0.93 -","- Ca2.08 K1.88 O11.44 Ta2.005 Ti0.99 -","- Ca2.08 K1.88 O11.44 Ta2.005 Ti0.99 -","1","0.0625","","Schaak, R.E.; Mallouk, T.E.","Synthesis, proton exchange, and topochemical dehydration of new Ruddlesden-Popper tantalates and titanotantalates","Journal of Solid State Chemistry","2000","155","","46","54","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526471","3.9028","","3.9028","","16.896","","90","","90","","90","","257.357","","","","","","","","","","","","","7","P 4/m m m","-P 4 2","123","","K2.06 Sr0.8 La0.93 Ti2.06 Ta1.03 O10 (H2 O)0.18","","- H0.36 K2.06 La0.93 O10.18 Sr0.8 Ta1.03 Ti2.06 -","- K2.06 La0.932 O10.18 Sr0.8 Ta1.029 Ti2.06 -","- K2.06 La0.932 O10.18 Sr0.8 Ta1.029 Ti2.06 -","1","0.0625","","Schaak, R.E.; Mallouk, T.E.","Synthesis, proton exchange, and topochemical dehydration of new Ruddlesden-Popper tantalates and titanotantalates","Journal of Solid State Chemistry","2000","155","","46","54","","","","","","","","","","","","","","","","","","","","","","has coordinates","147664","2020-10-21","18:00:00",""
"1526476","7.7949","","7.7949","","7.7949","","90","","90","","90","","473.622","","","","","","","","","","","","","3","I m -3","-I 2 2 3","204","","Gd Fe4 P12","","- Fe4 Gd P12 -","- Fe4 Gd0.997 P12 -","- Fe8 Gd1.994 P24 -","2","0.0416667","","Jeitschko, W.; Foecker, A.J.; Kotzyba, G.; Dewalsky, M.V.; Moeller, M.H.; Kuennen, B.; Paschke, D.; Evers, C.B.H.; Lang, A.; Rodewald, U.C.","Crystal structure and properties of some filled and unfilled skutterudites: Gd Fe4 P12, Sm Fe4 P12, Nd Fe4 As12, Eu0.54 Co4 Sb12, Fe0.5 Ni0.5 P3, Co P3 and Ni P3","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","1112","1120","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526478","9.0941","","9.0941","","9.0941","","90","","90","","90","","752.106","","","","","","","","","","","","","3","I m -3","-I 2 2 3","204","","Eu0.54 Co4 Sb12","","- Co4 Eu0.54 Sb12 -","- Co4 Eu0.54 Sb12 -","- Co8 Eu1.08 Sb24 -","2","0.0416667","","Jeitschko, W.; Foecker, A.J.; Kotzyba, G.; Paschke, D.; Dewalsky, M.V.; Evers, C.B.H.; Kuennen, B.; Lang, A.; Rodewald, U.C.; Moeller, M.H.","Crystal structure and properties of some filled and unfilled skutterudites: Gd Fe4 P12, Sm Fe4 P12, Nd Fe4 As12, Eu0.54 Co4 Sb12, Fe0.5 Ni0.5 P3, Co P3 and Ni P3","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","1112","1120","","","","","","","","","","","","","","","","","","","","","","has coordinates","147671","2020-10-21","18:00:00",""
"1526480","7.7529","","7.7529","","7.7529","","90","","90","","90","","466.007","","","","","","","","","","","","","3","I m -3","-I 2 2 3","204","","","","- Fe0.5 Ni0.5 P3 -","- Fe0.49 Ni0.51 P3 -","- Fe3.92 Ni4.08 P24 -","8","0.166667","","Jeitschko, W.; Foecker, A.J.; Paschke, D.; Dewalsky, M.V.; Moeller, M.H.; Evers, C.B.H.; Kuennen, B.; Rodewald, U.C.; Kotzyba, G.; Lang, A.","Crystal structure and properties of some filled and unfilled skutterudites: Gd Fe4 P12, Sm Fe4 P12, Nd Fe4 As12, Eu0.54 Co4 Sb12, Fe0.5 Ni0.5 P3, Co P3 and Ni P3","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","1112","1120","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1526482","7.7112","","7.7112","","7.7112","","90","","90","","90","","458.528","","","","","","","","","","","","","2","I m -3","-I 2 2 3","204","","","","- Co P3 -","- Co P3 -","- Co8 P24 -","8","0.166667","","Jeitschko, W.; Rodewald, U.C.; Foecker, A.J.; Evers, C.B.H.; Paschke, D.; Dewalsky, M.V.; Moeller, M.H.; Kuennen, B.; Lang, A.; Kotzyba, G.","Crystal structure and properties of some filled and unfilled skutterudites: Gd Fe4 P12, Sm Fe4 P12, Nd Fe4 As12, Eu0.54 Co4 Sb12, Fe0.5 Ni0.5 P3, Co P3 and Ni P3","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","1112","1120","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1526483","3.8461","","3.8461","","18.842","","90","","90","","90","","278.72","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","(Yb F2) (Yb F S)2","","- F4 S2 Yb3 -","- F4 S2 Yb3 -","- F8 S4 Yb6 -","2","0.0625","","Schleid, T.","Yb3 F4 S2: ein gemischtvalentes Ytterbiumfluoridsulfid gemaess (Yb F2) * 2(Yb F S)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","2429","2431","","","","","","","","","","","","","","","","","","","","","","has coordinates","147676","2020-10-21","18:00:00",""
"1526484","7.8157","","7.8157","","7.8157","","90","","90","","90","","477.423","","","","","","","","","","","","","2","I m -3","-I 2 2 3","204","","","","- Ni P3 -","- Ni P3 -","- Ni8 P24 -","8","0.166667","","Jeitschko, W.; Foecker, A.J.; Dewalsky, M.V.; Paschke, D.; Evers, C.B.H.; Moeller, M.H.; Kuennen, B.; Lang, A.; Rodewald, U.C.; Kotzyba, G.","Crystal structure and properties of some filled and unfilled skutterudites: Gd Fe4 P12, Sm Fe4 P12, Nd Fe4 As12, Eu0.54 Co4 Sb12, Fe0.5 Ni0.5 P3, Co P3 and Ni P3","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","1112","1120","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1526485","12.365","","7.482","","5.638","","90","","90","","107.73","","496.824","","","","","","","","","","","","","3","B 1 1 2/m","-B 2","12","","Ho5 Re2 O12","","- Ho5 O12 Re2 -","- Ho5 O12 Re2 -","- Ho10 O24 Re4 -","2","0.25","","Jeitschko, W.; Heumannskaemper, D.H.; Schriewer-Poettgen, M.S.; Rodewald, U.C.","Preparation and crystal structure of rare earth rhenates: the series Ln5 Re2 O12 with Ln = Y, Gd-Lu, and the praseodymium rhenates Pr3 Re O8, Pr3 Re2 O10 and Pr4 Re2 O11","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","80","88","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1526486","3.9184","","3.9184","","9.002","","90","","90","","90","","138.215","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 Pr O4 Cl","","- Bi2 Cl O4 Pr -","- Bi2 Cl O4 Pr -","- Bi2 Cl O4 Pr -","1","0.0625","","Schmidt, M.; Oppermann, H.; Henn, R.W.; Hennig, C.; Gmelin, E.; Binnewies, M.; Soeger, N.","Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2 SE O4 X (X=Cl,Br,I)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526487","14.96","","7.476","","6.116","","90","","90","","110.46","","640.869","","","","","","","","","","","","","3","P 1 1 21/a","-P 2ac","14","","Pr3 (Re O8)","","- O8 Pr3 Re -","- O8 Pr3 Re -","- O32 Pr12 Re4 -","4","1","","Jeitschko, W.; Heumannskaemper, D.H.; Rodewald, U.C.; Schriewer-Poettgen, M.S.","Preparation and crystal structure of rare earth rhenates: the series Ln5 Re2 O12 with Ln = Y, Gd-Lu, and the praseodymium rhenates Pr3 Re O8, Pr3 Re2 O10 and Pr4 Re2 O11","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","80","88","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526488","3.9079","","3.9079","","8.988","","90","","90","","90","","137.262","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 Nd O4 Cl","","- Bi2 Cl Nd O4 -","- Bi2 Cl Nd O4 -","- Bi2 Cl Nd O4 -","1","0.0625","","Schmidt, M.; Hennig, C.; Oppermann, H.; Soeger, N.; Gmelin, E.; Henn, R.W.; Binnewies, M.","Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2 SE O4 X (X=Cl,Br,I)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526490","3.8872","","3.8872","","8.95","","90","","90","","90","","135.237","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 Sm O4 Cl","","- Bi2 Cl O4 Sm -","- Bi2 Cl O4 Sm -","- Bi2 Cl O4 Sm -","1","0.0625","","Schmidt, M.; Oppermann, H.; Gmelin, E.; Hennig, C.; Henn, R.W.; Soeger, N.; Binnewies, M.","Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2 SE O4 X (X=Cl,Br,I)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526491","3.8808","","3.8808","","8.933","","90","","90","","90","","134.536","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 Eu O4 Cl","","- Bi2 Cl Eu O4 -","- Bi2 Cl Eu O4 -","- Bi2 Cl Eu O4 -","1","0.0625","","Schmidt, M.; Hennig, C.; Oppermann, H.; Henn, R.W.; Soeger, N.; Gmelin, E.; Binnewies, M.","Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2 SE O4 X (X=Cl,Br,I)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526493","3.8758","","3.8758","","8.922","","90","","90","","90","","134.025","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 Gd O4 Cl","","- Bi2 Cl Gd O4 -","- Bi2 Cl Gd O4 -","- Bi2 Cl Gd O4 -","1","0.0625","","Schmidt, M.; Oppermann, H.; Hennig, C.; Henn, R.W.; Soeger, N.; Binnewies, M.; Gmelin, E.","Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2 SE O4 X (X=Cl,Br,I)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526495","3.8633","","3.8633","","8.914","","90","","90","","90","","133.042","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 Tb O4 Cl","","- Bi2 Cl O4 Tb -","- Bi2 Cl O4 Tb -","- Bi2 Cl O4 Tb -","1","0.0625","","Schmidt, M.; Oppermann, H.; Soeger, N.; Henn, R.W.; Hennig, C.; Gmelin, E.; Binnewies, M.","Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2 SE O4 X (X=Cl,Br,I)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526497","3.8554","","3.8554","","8.893","","90","","90","","90","","132.187","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 Dy O4 Cl","","- Bi2 Cl Dy O4 -","- Bi2 Cl Dy O4 -","- Bi2 Cl Dy O4 -","1","0.0625","","Schmidt, M.; Oppermann, H.; Gmelin, E.; Henn, R.W.; Hennig, C.; Soeger, N.; Binnewies, M.","Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2 SE O4 X (X=Cl,Br,I)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526499","3.8493","","3.8493","","8.885","","90","","90","","90","","131.65","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 Y O4 Cl","","- Bi2 Cl O4 Y -","- Bi2 Cl O4 Y -","- Bi2 Cl O4 Y -","1","0.0625","","Schmidt, M.; Henn, R.W.; Oppermann, H.; Binnewies, M.; Hennig, C.; Gmelin, E.; Soeger, N.","Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2 SE O4 X (X=Cl,Br,I)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526501","3.8493","","3.8493","","8.885","","90","","90","","90","","131.65","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 Ho O4 Cl","","- Bi2 Cl Ho O4 -","- Bi2 Cl Ho O4 -","- Bi2 Cl Ho O4 -","1","0.0625","","Schmidt, M.; Hennig, C.; Oppermann, H.; Henn, R.W.; Gmelin, E.; Binnewies, M.; Soeger, N.","Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2 SE O4 X (X=Cl,Br,I)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526503","3.8413","","3.8413","","8.877","","90","","90","","90","","130.985","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 Er O4 Cl","","- Bi2 Cl Er O4 -","- Bi2 Cl Er O4 -","- Bi2 Cl Er O4 -","1","0.0625","","Schmidt, M.; Oppermann, H.; Henn, R.W.; Hennig, C.; Binnewies, M.; Gmelin, E.; Soeger, N.","Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2 SE O4 X (X=Cl,Br,I)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526504","3.8332","","3.8332","","8.868","","90","","90","","90","","130.301","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 Tm O4 Cl","","- Bi2 Cl O4 Tm -","- Bi2 Cl O4 Tm -","- Bi2 Cl O4 Tm -","1","0.0625","","Schmidt, M.; Oppermann, H.; Hennig, C.; Henn, R.W.; Binnewies, M.; Gmelin, E.; Soeger, N.","Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2 SE O4 X (X=Cl,Br,I)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526505","3.7526","","11.6016","","9.1898","","90","","90","","90","","400.089","","","","","","","","","","","","","6","P m m m","-P 2 2","47","","Tl0.75 Sr1.703 Ba0.297 Cu O3.812 (N O3)0.25","","- Ba0.297 Cu N0.25 O4.562 Sr1.703 Tl0.75 -","- Ba0.296933 Cu N0.25 O4.562 Sr1.70307 Tl0.75 -","- Ba0.8908 Cu3 N0.75 O13.686 Sr5.1092 Tl2.25 -","3","0.375","","Jones, M.O.; Hervieu, M.; Gameson, I.; Edwards, P.P.; Michel, C.; Raveau, B.","A combined X-ray and neutron-powder diffraction study of a superstructure derived from Tl0.75 Sr1.8 Ba0.2 Cu Oy","Journal of Solid State Chemistry","2000","155","","22","28","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526506","3.8271","","3.8271","","8.856","","90","","90","","90","","129.711","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 Yb O4 Cl","","- Bi2 Cl O4 Yb -","- Bi2 Cl O4 Yb -","- Bi2 Cl O4 Yb -","1","0.0625","","Schmidt, M.; Binnewies, M.; Oppermann, H.; Hennig, C.; Henn, R.W.; Gmelin, E.; Soeger, N.","Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2 SE O4 X (X=Cl,Br,I)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526508","3.8232","","3.8232","","8.856","","90","","90","","90","","129.447","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 Lu O4 Cl","","- Bi2 Cl Lu O4 -","- Bi2 Cl Lu O4 -","- Bi2 Cl Lu O4 -","1","0.0625","","Schmidt, M.; Oppermann, H.; Binnewies, M.; Hennig, C.; Henn, R.W.; Gmelin, E.; Soeger, N.","Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2 SE O4 X (X=Cl,Br,I)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526509","3.9375","","3.9375","","9.231","","90","","90","","90","","143.117","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 Pr O4 Br","","- Bi2 Br O4 Pr -","- Bi2 Br O4 Pr -","- Bi2 Br O4 Pr -","1","0.0625","","Schmidt, M.; Oppermann, H.; Hennig, C.; Henn, R.W.; Binnewies, M.; Gmelin, E.; Soeger, N.","Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2 SE O4 X (X=Cl,Br,I)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526510","10.0325","","17.976","","5.2698","","90","","104.7","","90","","919.27","","","","","","","","","","","","","9","C 1 2/m 1","-C 2y","12","","(K0.92 Na0.08) (Na1.36 Ca0.36 Sr0.28) Mg3 (Mg1.84 Fe0.16) Si8 O22 (O H)2","","- Ca0.36 Fe0.16 H2 K0.92 Mg4.84 Na1.44 O24 Si8 Sr0.28 -","- Ca0.36 Fe0.16 K0.92 Mg4.84 Na1.44 O24 Si8 Sr0.28 -","- Ca0.72 Fe0.32 K1.84 Mg9.68 Na2.88 O48 Si16 Sr0.56 -","2","0.25","","Kabalov, Yu.; Sokolova, E.; Schneider, J.; Gorbatova, V.; Konev, A.","A unique Sr-rich K-richterite from Siberia: Rietveld structure refinement","Materials Science Forum","2000","321","","994","998","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526511","3.9275","","3.9275","","9.219","","90","","90","","90","","142.205","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 Nd O4 Br","","- Bi2 Br Nd O4 -","- Bi2 Br Nd O4 -","- Bi2 Br Nd O4 -","1","0.0625","","Schmidt, M.; Oppermann, H.; Hennig, C.; Henn, R.W.; Gmelin, E.; Binnewies, M.; Soeger, N.","Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2 SE O4 X (X=Cl,Br,I)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526512","3.9084","","3.9084","","9.194","","90","","90","","90","","140.444","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 Sm O4 Br","","- Bi2 Br O4 Sm -","- Bi2 Br O4 Sm -","- Bi2 Br O4 Sm -","1","0.0625","","Schmidt, M.; Oppermann, H.; Hennig, C.; Binnewies, M.; Henn, R.W.; Soeger, N.; Gmelin, E.","Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2 SE O4 X (X=Cl,Br,I)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526513","18.64029","","18.64029","","8.6801","","90","","90","","120","","2611.93","","","","","","","","","","","","","3","P 63","P 6c","173","","Ba (Ga2 O4)","","- Ba Ga2 O4 -","- Ba Ga2 O4 -","- Ba24 Ga48 O96 -","24","4","","Kahlenberg, V.; Parise, J.B.; Fischer, R.X.","The stuffed framework structure of Ba Ga2 O4","Journal of Solid State Chemistry","2000","154","","612","618","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526514","3.9012","","3.9012","","9.179","","90","","90","","90","","139.699","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 Eu O4 Br","","- Bi2 Br Eu O4 -","- Bi2 Br Eu O4 -","- Bi2 Br Eu O4 -","1","0.0625","","Schmidt, M.; Gmelin, E.; Oppermann, H.; Hennig, C.; Henn, R.W.; Binnewies, M.; Soeger, N.","Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2 SE O4 X (X=Cl,Br,I)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526516","3.8958","","3.8958","","9.172","","90","","90","","90","","139.206","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 Gd O4 Br","","- Bi2 Br Gd O4 -","- Bi2 Br Gd O4 -","- Bi2 Br Gd O4 -","1","0.0625","","Schmidt, M.; Oppermann, H.; Hennig, C.; Binnewies, M.; Gmelin, E.; Henn, R.W.; Soeger, N.","Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2 SE O4 X (X=Cl,Br,I)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526518","3.8826","","3.8826","","9.163","","90","","90","","90","","138.128","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 Tb O4 Br","","- Bi2 Br O4 Tb -","- Bi2 Br O4 Tb -","- Bi2 Br O4 Tb -","1","0.0625","","Schmidt, M.; Oppermann, H.; Hennig, C.; Henn, R.W.; Gmelin, E.; Binnewies, M.; Soeger, N.","Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2 SE O4 X (X=Cl,Br,I)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526520","3.8749","","3.8749","","9.15","","90","","90","","90","","137.386","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 Dy O4 Br","","- Bi2 Br Dy O4 -","- Bi2 Br Dy O4 -","- Bi2 Br Dy O4 -","1","0.0625","","Schmidt, M.; Oppermann, H.; Hennig, C.; Henn, R.W.; Soeger, N.; Gmelin, E.; Binnewies, M.","Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2 SE O4 X (X=Cl,Br,I)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526521","9.14","","9.14","","9.14","","90","","90","","90","","763.552","","","","","","","","","","","","","4","P a -3","-P 2ac 2ab 3","205","","Zr (W0.977 Mo1.023) O8","","- Mo1.023 O8 W0.977 Zr -","- Mo1.024 O7.998 W0.976 Zr -","- Mo4.096 O31.992 W3.904 Zr4 -","4","0.166667","","Kameswari, U.; Sleight, A.W.; Evans, J.S.O.","Rapid synthesis of Zr W2 O8 and related phases, and structure refinement of Zr W Mo O8","International Journal of Inorganic Materials","2000","2","","333","337","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526522","3.868","","3.868","","9.144","","90","","90","","90","","136.807","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 Y O4 Br","","- Bi2 Br O4 Y -","- Bi2 Br O4 Y -","- Bi2 Br O4 Y -","1","0.0625","","Schmidt, M.; Henn, R.W.; Oppermann, H.; Hennig, C.; Binnewies, M.; Soeger, N.; Gmelin, E.","Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2 SE O4 X (X=Cl,Br,I)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526523","3.8671","","3.8671","","9.146","","90","","90","","90","","136.774","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 Ho O4 Br","","- Bi2 Br Ho O4 -","- Bi2 Br Ho O4 -","- Bi2 Br Ho O4 -","1","0.0625","","Schmidt, M.; Oppermann, H.; Hennig, C.; Gmelin, E.; Henn, R.W.; Binnewies, M.; Soeger, N.","Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2 SE O4 X (X=Cl,Br,I)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526525","3.8598","","3.8598","","9.142","","90","","90","","90","","136.198","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 Er O4 Br","","- Bi2 Br Er O4 -","- Bi2 Br Er O4 -","- Bi2 Br Er O4 -","1","0.0625","","Schmidt, M.; Oppermann, H.; Hennig, C.; Gmelin, E.; Henn, R.W.; Soeger, N.; Binnewies, M.","Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2 SE O4 X (X=Cl,Br,I)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526527","3.8526","","3.8526","","9.137","","90","","90","","90","","135.616","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 Tm O4 Br","","- Bi2 Br O4 Tm -","- Bi2 Br O4 Tm -","- Bi2 Br O4 Tm -","1","0.0625","","Schmidt, M.; Oppermann, H.; Hennig, C.; Gmelin, E.; Binnewies, M.; Soeger, N.; Henn, R.W.","Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2 SE O4 X (X=Cl,Br,I)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526529","3.8489","","3.8489","","9.13","","90","","90","","90","","135.252","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 Yb O4 Br","","- Bi2 Br O4 Yb -","- Bi2 Br O4 Yb -","- Bi2 Br O4 Yb -","1","0.0625","","Schmidt, M.; Oppermann, H.; Soeger, N.; Henn, R.W.; Gmelin, E.; Hennig, C.; Binnewies, M.","Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2 SE O4 X (X=Cl,Br,I)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526530","3.8124","","3.8124","","29.043","","90","","90","","90","","422.122","","","","","","","","","","","","","7","I 4/m m m","-I 4 2","139","","(Hg0.75 W0.25) Sr2 (Ho0.75 Ce0.25)2 Cu2 O9","","- Ce0.5 Cu2 Hg0.75 Ho1.5 O9 Sr2 W0.25 -","- Ce0.5 Cu2 Hg0.75 Ho1.5 O9 Sr2 W0.25 -","- Ce Cu4 Hg1.5 Ho3 O18 Sr4 W0.5 -","2","0.0625","","Kandyel, E.; Yamamoto, A.; Wen, J.G.; Tajima, S.","Synthesis and study of Hg-based 1222-type superconducting cuprates (Hg, M) Sr2 (Ln, Ce)2 Cu2 Oz","Journal of Solid State Chemistry","2000","154","","488","497","","","","","","","","","","","","","","","","","","","","","","has coordinates","147728","2020-10-21","18:00:00",""
"1526531","3.8408","","3.8408","","9.12","","90","","90","","90","","134.536","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 Lu O4 Br","","- Bi2 Br Lu O4 -","- Bi2 Br Lu O4 -","- Bi2 Br Lu O4 -","1","0.0625","","Schmidt, M.; Soeger, N.; Hennig, C.; Oppermann, H.; Gmelin, E.; Henn, R.W.; Binnewies, M.","Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2 SE O4 X (X=Cl,Br,I)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526532","3.8058","","3.8058","","29.008","","90","","90","","90","","420.155","","","","","","","","","","","","","7","I 4/m m m","-I 4 2","139","","(Hg0.75 W0.25) Sr2 (Er0.75 Ce0.25)2 Cu2 O9","","- Ce0.5 Cu2 Er1.5 Hg0.75 O9 Sr2 W0.25 -","- Ce0.5 Cu2 Er1.5 Hg0.75 O9 Sr2 W0.25 -","- Ce Cu4 Er3 Hg1.5 O18 Sr4 W0.5 -","2","0.0625","","Kandyel, E.; Yamamoto, A.; Wen, J.G.; Tajima, S.","Synthesis and study of Hg-based 1222-type superconducting cuprates (Hg, M) Sr2 (Ln, Ce)2 Cu2 Oz","Journal of Solid State Chemistry","2000","154","","488","497","","","","","","","","","","","","","","","","","","","","","","has coordinates","147730","2020-10-21","18:00:00",""
"1526533","4.001","","4.001","","9.656","","90","","90","","90","","154.573","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 La O4 I","","- Bi2 I La O4 -","- Bi2 I La O4 -","- Bi2 I La O4 -","1","0.0625","","Schmidt, M.; Oppermann, H.; Soeger, N.; Henn, R.W.; Hennig, C.; Gmelin, E.; Binnewies, M.","Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2 SE O4 X (X=Cl,Br,I)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526534","3.8462","","3.8462","","29.182","","90","","90","","90","","431.697","","","","","","","","","","","","","7","I 4/m m m","-I 4 2","139","","(Hg0.75 W0.25) Sr2 (Sm0.75 Ce0.25)2 Cu2 O9","","- Ce0.5 Cu2 Hg0.75 O9 Sm1.5 Sr2 W0.25 -","- Ce0.5 Cu2 Hg0.75 O9 Sm1.5 Sr2 W0.25 -","- Ce Cu4 Hg1.5 O18 Sm3 Sr4 W0.5 -","2","0.0625","","Kandyel, E.; Yamamoto, A.; Wen, J.G.; Tajima, S.","Synthesis and study of Hg-based 1222-type superconducting cuprates (Hg, M) Sr2 (Ln, Ce)2 Cu2 Oz","Journal of Solid State Chemistry","2000","154","","488","497","","","","","","","","","","","","","","","","","","","","","","has coordinates","147732","2020-10-21","18:00:00",""
"1526535","3.969","","3.969","","9.619","","90","","90","","90","","151.528","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 Pr O4 I","","- Bi2 I O4 Pr -","- Bi2 I O4 Pr -","- Bi2 I O4 Pr -","1","0.0625","","Schmidt, M.; Oppermann, H.; Hennig, C.; Henn, R.W.; Gmelin, E.; Soeger, N.; Binnewies, M.","Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2 SE O4 X (X=Cl,Br,I)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526536","3.8386","","3.8386","","29.167","","90","","90","","90","","429.771","","","","","","","","","","","","","7","I 4/m m m","-I 4 2","139","","(Hg0.75 W0.25) Sr2 (Eu0.75 Ce0.25)2 Cu2 O9","","- Ce0.5 Cu2 Eu1.5 Hg0.75 O9 Sr2 W0.25 -","- Ce0.5 Cu2 Eu1.5 Hg0.75 O9 Sr2 W0.25 -","- Ce Cu4 Eu3 Hg1.5 O18 Sr4 W0.5 -","2","0.0625","","Kandyel, E.; Yamamoto, A.; Tajima, S.; Wen, J.G.","Synthesis and study of Hg-based 1222-type superconducting cuprates (Hg, M) Sr2 (Ln, Ce)2 Cu2 Oz","Journal of Solid State Chemistry","2000","154","","488","497","","","","","","","","","","","","","","","","","","","","","","has coordinates","147734","2020-10-21","18:00:00",""
"1526537","3.9596","","3.9596","","9.611","","90","","90","","90","","150.685","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 Nd O4 I","","- Bi2 I Nd O4 -","- Bi2 I Nd O4 -","- Bi2 I Nd O4 -","1","0.0625","","Schmidt, M.; Oppermann, H.; Henn, R.W.; Hennig, C.; Soeger, N.; Gmelin, E.; Binnewies, M.","Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2 SE O4 X (X=Cl,Br,I)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526538","3.8327","","3.8327","","29.15","","90","","90","","90","","428.202","","","","","","","","","","","","","7","I 4/m m m","-I 4 2","139","","(Hg0.75 W0.25) Sr2 (Gd0.75 Ce0.25)2 Cu2 O9","","- Ce0.5 Cu2 Gd1.5 Hg0.75 O9 Sr2 W0.25 -","- Ce0.5 Cu2 Gd1.5 Hg0.75 O9 Sr2 W0.25 -","- Ce Cu4 Gd3 Hg1.5 O18 Sr4 W0.5 -","2","0.0625","","Kandyel, E.; Yamamoto, A.; Wen, J.G.; Tajima, S.","Synthesis and study of Hg-based 1222-type superconducting cuprates (Hg, M) Sr2 (Ln, Ce)2 Cu2 Oz","Journal of Solid State Chemistry","2000","154","","488","497","","","","","","","","","","","","","","","","","","","","","","has coordinates","147736","2020-10-21","18:00:00",""
"1526539","3.9383","","3.9383","","9.596","","90","","90","","90","","148.836","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 Sm O4 I","","- Bi2 I O4 Sm -","- Bi2 I O4 Sm -","- Bi2 I O4 Sm -","1","0.0625","","Schmidt, M.; Oppermann, H.; Hennig, C.; Henn, R.W.; Binnewies, M.; Soeger, N.; Gmelin, E.","Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2 SE O4 X (X=Cl,Br,I)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526540","3.8161","","3.8161","","29.087","","90","","90","","90","","423.583","","","","","","","","","","","","","7","I 4/m m m","-I 4 2","139","","(Hg0.75 W0.25) Sr2 (Dy0.75 Ce0.25)2 Cu2 O9","","- Ce0.5 Cu2 Dy1.5 Hg0.75 O9 Sr2 W0.25 -","- Ce0.5 Cu2 Dy1.5 Hg0.75 O9 Sr2 W0.25 -","- Ce Cu4 Dy3 Hg1.5 O18 Sr4 W0.5 -","2","0.0625","","Kandyel, E.; Wen, J.G.; Yamamoto, A.; Tajima, S.","Synthesis and study of Hg-based 1222-type superconducting cuprates (Hg, M) Sr2 (Ln, Ce)2 Cu2 Oz","Journal of Solid State Chemistry","2000","154","","488","497","","","","","","","","","","","","","","","","","","","","","","has coordinates","147738","2020-10-21","18:00:00",""
"1526541","3.9321","","3.9321","","9.582","","90","","90","","90","","148.151","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 Eu O4 I","","- Bi2 Eu I O4 -","- Bi2 Eu I O4 -","- Bi2 Eu I O4 -","1","0.0625","","Schmidt, M.; Hennig, C.; Oppermann, H.; Soeger, N.; Henn, R.W.; Gmelin, E.; Binnewies, M.","Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2 SE O4 X (X=Cl,Br,I)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526543","3.9257","","3.9257","","9.578","","90","","90","","90","","147.608","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 Gd O4 I","","- Bi2 Gd I O4 -","- Bi2 Gd I O4 -","- Bi2 Gd I O4 -","1","0.0625","","Schmidt, M.; Soeger, N.; Oppermann, H.; Henn, R.W.; Hennig, C.; Gmelin, E.; Binnewies, M.","Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2 SE O4 X (X=Cl,Br,I)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526544","14.0658","","7.75102","","6.14973","","90","","90","","90","","670.47","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Li4 Ge S4","","- Ge Li4 S4 -","- Ge Li4 S4 -","- Ge4 Li16 S16 -","4","0.5","","Kanno, R.; Hata, T.; Kawamoto, Y.; Irie, M.","Synthesis of a new lithium ionic conductor, thio-LISICON lithium germanium sulfide system","Solid State Ionics","2000","130","","97","104","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526545","3.9134","","3.9134","","9.573","","90","","90","","90","","146.608","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 Tb O4 I","","- Bi2 I O4 Tb -","- Bi2 I O4 Tb -","- Bi2 I O4 Tb -","1","0.0625","","Schmidt, M.; Oppermann, H.; Hennig, C.; Henn, R.W.; Binnewies, M.; Gmelin, E.; Soeger, N.","Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2 SE O4 X (X=Cl,Br,I)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526546","10.076","","10.076","","6.9623","","90","","90","","120","","612.153","","","","","","","","","","","","","4","R 3 :H","R 3","146","","K Ni (P O3)3","","- K Ni O9 P3 -","- K Ni O9 P3 -","- K3 Ni3 O27 P9 -","3","0.333333","","Kapshuk, A.A.; Nagornyi, P.G.; Petrenko, O.V.","Synthesis, IR spectra and structures of double metaphosphates M Ni (P O3)3 (M= Na or K)","Kristallografiya","2000","45","","238","241","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526547","3.9059","","3.9059","","9.562","","90","","90","","90","","145.878","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 Dy O4 I","","- Bi2 Dy I O4 -","- Bi2 Dy I O4 -","- Bi2 Dy I O4 -","1","0.0625","","Schmidt, M.; Oppermann, H.; Binnewies, M.; Hennig, C.; Henn, R.W.; Soeger, N.; Gmelin, E.","Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2 SE O4 X (X=Cl,Br,I)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526548","3.8717","","3.8717","","11.607","","90","","90","","90","","173.99","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","Y Ba2 Cu2.85 (C O3)0.144 O6.73","","- C0.144 Ba2 Cu2.85 O7.162 Y -","- C0.144 Ba2 Cu2.85 O7.168 Y -","- C0.144 Ba2 Cu2.85 O7.168 Y -","1","0.0625","","Karen, P.; Kjekshus, A.; Karen, V.; Huang, Q.; Mighell, A.D.; Santoro, A.","Neutron powder diffraction study of the crystal structure of the oxycarbonate phase Y Ba2 Cu2.85 (C O3)0.15 O6.73","Physica C (Amsterdam)","2000","336","","279","286","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526549","3.8977","","3.8977","","9.552","","90","","90","","90","","145.115","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 Y O4 I","","- Bi2 I O4 Y -","- Bi2 I O4 Y -","- Bi2 I O4 Y -","1","0.0625","","Schmidt, M.; Oppermann, H.; Hennig, C.; Soeger, N.; Gmelin, E.; Henn, R.W.; Binnewies, M.","Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2 SE O4 X (X=Cl,Br,I)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526551","3.8975","","3.8975","","9.559","","90","","90","","90","","145.206","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 Ho O4 I","","- Bi2 Ho I O4 -","- Bi2 Ho I O4 -","- Bi2 Ho I O4 -","1","0.0625","","Schmidt, M.; Oppermann, H.; Henn, R.W.; Hennig, C.; Gmelin, E.; Soeger, N.; Binnewies, M.","Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2 SE O4 X (X=Cl,Br,I)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526553","3.8832","","3.8832","","9.554","","90","","90","","90","","144.067","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 Tm O4 I","","- Bi2 I O4 Tm -","- Bi2 I O4 Tm -","- Bi2 I O4 Tm -","1","0.0625","","Schmidt, M.; Oppermann, H.; Hennig, C.; Henn, R.W.; Binnewies, M.; Soeger, N.; Gmelin, E.","Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2 SE O4 X (X=Cl,Br,I)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526555","3.875","","3.875","","9.548","","90","","90","","90","","143.369","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 Yb O4 I","","- Bi2 I O4 Yb -","- Bi2 I O4 Yb -","- Bi2 I O4 Yb -","1","0.0625","","Schmidt, M.; Hennig, C.; Oppermann, H.; Henn, R.W.; Gmelin, E.; Soeger, N.; Binnewies, M.","Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2 SE O4 X (X=Cl,Br,I)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526557","3.8721","","3.8721","","9.546","","90","","90","","90","","143.125","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 Lu O4 I","","- Bi2 I Lu O4 -","- Bi2 I Lu O4 -","- Bi2 I Lu O4 -","1","0.0625","","Schmidt, M.; Hennig, C.; Oppermann, H.; Henn, R.W.; Gmelin, E.; Soeger, N.; Binnewies, M.","Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2 SE O4 X (X=Cl,Br,I)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526560","3.653","","3.653","","5.337","","90","","90","","90","","71.219","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","Li2 Na N","","- Li2 N Na -","- Li2 N Na -","- Li4 N2 Na2 -","2","0.0625","","Schoen, J.C.; Wevers, M.A.C.; Jansen, M.","Investigation of the possible ternary nitrides in the system (Li3 N)/(Na3 N)","Solid State Sciences","2000","2","","449","456","","","","","","","","","","","","","","","","","","","","","","has coordinates","282761","2023-04-20","06:45:55",""
"1526561","7.4512","","14.112","","18.838","","90","","90","","90","","1980.84","","","","","","","","","","","","","3","I m m 2","I 2 -2","44","","Na4.26 (Al4.26 Si31.74 O72)","","- Al4.256 O72 Si31.744 -","- Al4.256 O72 Si31.744 -","- Al4.256 O72 Si31.744 -","1","0.125","","Kato, M.; Itabashi, K.","Structure refinement of Na-ferrierite by the space group determined from the ordered distribution of Al atoms in its framework","X-sen Bunseki no Shinpo","2000","31","","1","10","","","","","","","","","","","","","","","","","","","","","","has coordinates","147760","2020-10-21","18:00:00",""
"1526562","5.265","","5.265","","5.265","","90","","90","","90","","145.947","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","Li2 Na N","","- Li2 N Na -","- Li2 N Na -","- Li8 N4 Na4 -","4","0.0208333","","Schoen, J.C.; Jansen, M.; Wevers, M.A.C.","Investigation of the possible ternary nitrides in the system (Li3 N)/(Na3 N)","Solid State Sciences","2000","2","","449","456","","","","","","","","","","","","","","","","","","","","","","has coordinates","282761","2023-04-20","06:45:56",""
"1526563","3.698","","6.365","","4.6","","90","","90","","90","","108.274","","","","","","","","","","","","","3","C m m m","-C 2 2","65","","Li2 Na N","","- Li2 N Na -","- Li2 N Na -","- Li4 N2 Na2 -","2","0.125","","Schoen, J.C.; Jansen, M.; Wevers, M.A.C.","Investigation of the possible ternary nitrides in the system (Li3 N)/(Na3 N)","Solid State Sciences","2000","2","","449","456","","","","","","","","","","","","","","","","","","","","","","has coordinates","282761","2023-04-20","06:45:56",""
"1526565","3.65","","3.65","","4.6","","90","","90","","120","","53.073","","","","","","","","","","","","","3","P 6/m m m","-P 6 2","191","","Li2 Na N","","- Li2 N Na -","- Li2 N Na -","- Li2 N Na -","1","0.0416667","","Schoen, J.C.; Wevers, M.A.C.; Jansen, M.","Investigation of the possible ternary nitrides in the system (Li3 N)/(Na3 N)","Solid State Sciences","2000","2","","449","456","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526566","9.254","","11.671","","6.729","","91.09","","112.12","","109.17","","627.421","","","","","","","","","","","","","4","P -1","-P 1","2","","Sm (N O3)3 (H2 O)6","","- H12 N3 O15 Sm -","- H12 N3 O15 Sm -","- H24 N6 O30 Sm2 -","2","1","","Kawashima, R.; Sasaki, M.; Shiozaki, Y.; Satoh, S.; Kino, Y.; Isoda, H.","Report on temperature dependence of crystal structure for samarium nitrate having metastable phenomena","Journal of the Physical Society of Japan","2000","69","","3297","3303","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526567","3.895","","3.895","","6.114","","90","","90","","90","","92.756","","","","","","","","","","","","","3","P 4/n m m :2","-P 4a 2a","129","","Li Na2 N","","- Li N Na2 -","- Li N Na2 -","- Li2 N2 Na4 -","2","0.125","","Schoen, J.C.; Jansen, M.; Wevers, M.A.C.","Investigation of the possible ternary nitrides in the system (Li3 N)/(Na3 N)","Solid State Sciences","2000","2","","449","456","","","","","","","","","","","","","","","","","","","","","","has coordinates","282761","2023-04-20","06:45:56",""
"1526569","4","","4","","4.2","","90","","90","","120","","58.197","","","","","","","","","","","","","3","P 6/m m m","-P 6 2","191","","Li Na2 N","","- Li N Na2 -","- Li N Na2 -","- Li N Na2 -","1","0.0416667","","Schoen, J.C.; Wevers, M.A.C.; Jansen, M.","Investigation of the possible ternary nitrides in the system (Li3 N)/(Na3 N)","Solid State Sciences","2000","2","","449","456","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526570","3.652","","3.652","","5.436","","90","","90","","90","","72.5","","","","","","","","","","","","","3","P -4 m 2","P -4 -2","115","","Li3 Na3 N2","","- Li3 N2 Na3 -","- Li3 N2 Na3 -","- Li3 N2 Na3 -","1","0.125","","Schoen, J.C.; Wevers, M.A.C.; Jansen, M.","Investigation of the possible ternary nitrides in the system (Li3 N)/(Na3 N)","Solid State Sciences","2000","2","","449","456","","","","","","","","","","","","","","","","","","","","","","has coordinates","147770","2020-10-21","18:00:00",""
"1526572","3.854","","3.676","","6.32","","90","","90.31","","90","","89.536","","","","","","","","","","","","","3","P 1 m 1","P -2y","6","","Li3 Na3 N2","","- Li3 N2 Na3 -","- Li3 N2 Na3 -","- Li3 N2 Na3 -","1","0.5","","Schoen, J.C.; Wevers, M.A.C.; Jansen, M.","Investigation of the possible ternary nitrides in the system (Li3 N)/(Na3 N)","Solid State Sciences","2000","2","","449","456","","","","","","","","","","","","","","","","","","","","","","has coordinates","147772","2020-10-21","18:00:00",""
"1526573","15.993","","6.473","","8.735","","90","","90","","90","","904.271","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Sr Ni10 P6","","- Ni10 P6 Sr -","- Ni10 P6 Sr -","- Ni40 P24 Sr4 -","4","0.5","","Keimes, V.; Hellmann, A.; Mewis, A.; Huhnt, C.; Schuette, N.","Sr Ni10 P6, Eu Ni10 P6 und Ba Co10 As6: Phasenumwandlungen und Kristallstrukturen","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","1653","1659","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526574","3.965","","3.965","","5.504","","90","","90","","90","","86.53","","","","","","","","","","","","","3","P 4/m m m","-P 4 2","123","","Li5 Na N2","","- Li5 N2 Na -","- Li5 N2 Na -","- Li5 N2 Na -","1","0.0625","","Schoen, J.C.; Wevers, M.A.C.; Jansen, M.","Investigation of the possible ternary nitrides in the system (Li3 N)/(Na3 N)","Solid State Sciences","2000","2","","449","456","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526575","15.925","","6.478","","8.72","","90","","90","","90","","899.574","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Eu Ni10 P6 -","- Eu Ni10 P6 -","- Eu4 Ni40 P24 -","4","0.5","","Keimes, V.; Hellmann, A.; Mewis, A.; Schuette, N.; Huhnt, C.","Sr Ni10 P6, Eu Ni10 P6 und Ba Co10 As6: Phasenumwandlungen und Kristallstrukturen","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","1653","1659","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1526576","4.28","","3.86","","7.827","","90","","121.71","","90","","110.005","","","","","","","","","","","","","3","P 1 m 1","P -2y","6","","Li5 Na N2","","- Li5 N2 Na -","- Li5 N2 Na -","- Li5 N2 Na -","1","0.5","","Schoen, J.C.; Wevers, M.A.C.; Jansen, M.","Investigation of the possible ternary nitrides in the system (Li3 N)/(Na3 N)","Solid State Sciences","2000","2","","449","456","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526577","6.481","","16.08","","8.763","","90","","90","","90","","913.231","","","","","","","","","","","","","3","C m c a","-C 2ac 2","64","","Sr Ni10 P6","","- Ni10 P6 Sr -","- Ni10 P6 Sr -","- Ni40 P24 Sr4 -","4","","","Keimes, V.; Hellmann, A.; Mewis, A.; Huhnt, C.; Schuette, N.","Sr Ni10 P6, Eu Ni10 P6 und Ba Co10 As6: Phasenumwandlungen und Kristallstrukturen","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","1653","1659","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526578","6.731","","5.944","","6.383","","90","","91.18","","90","","255.324","","","","","","","","","","","","","3","C 1 2 1","C 2y","5","","Li Na5 N2","","- Li N2 Na5 -","- Li N2 Na5 -","- Li2 N4 Na10 -","2","0.5","","Schoen, J.C.; Wevers, M.A.C.; Jansen, M.","Investigation of the possible ternary nitrides in the system (Li3 N)/(Na3 N)","Solid State Sciences","2000","2","","449","456","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526579","6.509","","16.063","","8.766","","90","","90","","90","","916.521","","","","","","","","","","","","","3","C m c a","-C 2ac 2","64","","","","- Eu Ni10 P6 -","- Eu Ni10 P6 -","- Eu4 Ni40 P24 -","4","","","Keimes, V.; Schuette, N.; Hellmann, A.; Huhnt, C.; Mewis, A.","Sr Ni10 P6, Eu Ni10 P6 und Ba Co10 As6: Phasenumwandlungen und Kristallstrukturen","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","1653","1659","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1526580","6.57","","4.056","","3.7288","","89.48","","90.53","","88.84","","99.336","","","","","","","","","","","","","3","P 1","P 1","1","","Li Na5 N2","","- Li N2 Na5 -","- Li N2 Na5 -","- Li N2 Na5 -","1","1","","Schoen, J.C.; Wevers, M.A.C.; Jansen, M.","Investigation of the possible ternary nitrides in the system (Li3 N)/(Na3 N)","Solid State Sciences","2000","2","","449","456","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526581","16.405","","6.858","","8.955","","90","","90","","90","","1007.49","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Ba Co10 As6","","- As6 Ba Co10 -","- As6 Ba Co10 -","- As24 Ba4 Co40 -","4","0.5","","Keimes, V.; Hellmann, A.; Huhnt, C.; Mewis, A.; Schuette, N.","Sr Ni10 P6, Eu Ni10 P6 und Ba Co10 As6: Phasenumwandlungen und Kristallstrukturen","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","1653","1659","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526582","5.979","","5.979","","35.875","","90","","90","","120","","1110.66","","","","","","","","","","","","","5","R -3 m :H","-R 3 2""","166","","K1.56 Cd1.03 Fe9.97 O16.77 (H2 O)0.66","","- Cd1.03 Fe9.97 H1.32 K1.56 O17.43 -","- Cd1.03 Fe9.97 K1.56 O17.432 -","- Cd3.09 Fe29.91 K4.68 O52.296 -","3","0.0833333","","Keklikoglou, P.; Stergiou, A.C.; Kalogirou, O.","Crystallographic study of hydrated polycrystalline M-(beta"",beta) - ferrites (M = K(+), Mg(2+), Ca(2+))","Solid State Ionics","2000","136","","441","446","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526583","7.982","","12.267","","14.599","","90","","90","","90","","1429.46","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Rb2 (Pd I4) (I2)","","- I6 Pd Rb2 -","- I6 Pd Rb2 -","- I24 Pd4 Rb8 -","4","0.5","","Schuepp, B.; Heines, P.; Keller, H.L.","Zwei neue Iodopalladate mit gleicher Summenformel: Rb2 Pd I4 * I2 -ein neuer Strukturtyp mit eingelagerten I2-Molekuelen - und Rb2 Pd I6","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","202","207","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526584","5.983","","5.983","","23.851","","90","","90","","120","","739.393","","","","","","","","","","","","","5","P 63/m m c","-P 6c 2c","194","","K1.42 Cd0.48 Fe10.52 O17 (H2 O)0.33","","- Cd0.48 Fe10.52 H0.66 K1.42 O17.33 -","- Cd0.48 Fe10.52 K1.42 O17.33 -","- Cd0.96 Fe21.04 K2.84 O34.66 -","2","0.0833333","","Keklikoglou, P.; Kalogirou, O.; Stergiou, A.C.","Crystallographic study of hydrated polycrystalline M-(beta"",beta) - ferrites (M = K(+), Mg(2+), Ca(2+))","Solid State Ionics","2000","136","","441","446","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526585","11.185","","11.185","","11.185","","90","","90","","90","","1399.29","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","Rb2 (Pd I6)","","- I6 Pd Rb2 -","- I6 Pd Rb2 -","- I24 Pd4 Rb8 -","4","0.0208333","","Schuepp, B.; Heines, P.; Keller, H.L.","Zwei neue Iodopalladate mit gleicher Summenformel: Rb2 Pd I4 * I2 -ein neuer Strukturtyp mit eingelagerten I2-Molekuelen - und Rb2 Pd I6","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","202","207","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526586","5.976","","5.976","","36.045","","90","","90","","120","","1114.8","","","","","","","","","","","","","6","R -3 m :H","-R 3 2""","166","","Mg0.68 K0.18 Cd1.03 Fe9.97 O16.83 (H2 O)1.59","","- Cd1.03 Fe9.97 H3.18 K0.18 Mg0.68 O18.42 -","- Cd1.03 Fe9.97 K0.18 Mg0.68 O18.422 -","- Cd3.09 Fe29.91 K0.54 Mg2.04 O55.266 -","3","0.0833333","","Keklikoglou, P.; Stergiou, A.C.; Kalogirou, O.","Crystallographic study of hydrated polycrystalline M-(beta"",beta) - ferrites (M = K(+), Mg(2+), Ca(2+))","Solid State Ionics","2000","136","","441","446","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526587","6.56","","6.56","","7.413","","90","","90","","120","","276.269","","","","","","","","","","","","","4","P -3","-P 3","147","","K (Sn (N H2)3)","","- H6 K N3 Sn -","- H6 K N3 Sn -","- H12 K2 N6 Sn2 -","2","0.333333","","Scotti, N.; Jacobs, H.","Kaliumtriamidostannat(II), K (Sn (N H2)3) - Synthese und Kristallstruktur","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","2275","2278","","","","","","","","","","","","","","","","","","","","","","has coordinates","186594","2020-10-21","18:00:00",""
"1526588","5.978","","5.978","","23.85","","90","","90","","120","","738.127","","","","","","","","","","","","","6","P 63/m m c","-P 6c 2c","194","","Mg0.43 K0.57 Cd0.59 Fe10.41 O17 (H2 O)1.0","","- Cd0.59 Fe10.41 H2 K0.57 Mg0.43 O18 -","- Cd0.59 Fe10.41 K0.57 Mg0.43 O17.99 -","- Cd1.18 Fe20.82 K1.14 Mg0.86 O35.98 -","2","0.0833333","","Keklikoglou, P.; Stergiou, A.C.; Kalogirou, O.","Crystallographic study of hydrated polycrystalline M-(beta"",beta) - ferrites (M = K(+), Mg(2+), Ca(2+))","Solid State Ionics","2000","136","","441","446","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526590","5.964","","5.964","","35.655","","90","","90","","120","","1098.31","","","","","","","","","","","","","5","R -3 m :H","-R 3 2""","166","","Ca0.80 Cd0.88 Fe10.17 O16.85 (H2 O)1.50","","- Ca0.8 Cd0.88 Fe10.17 H3 O18.35 -","- Ca0.8 Cd0.88 Fe10.17 O18.35 -","- Ca2.4 Cd2.64 Fe30.51 O55.05 -","3","0.0833333","","Keklikoglou, P.; Stergiou, A.C.; Kalogirou, O.","Crystallographic study of hydrated polycrystalline M-(beta"",beta) - ferrites (M = K(+), Mg(2+), Ca(2+))","Solid State Ionics","2000","136","","441","446","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526592","5.971","","5.971","","23.706","","90","","90","","120","","731.953","","","","","","","","","","","","","5","P 63/m m c","-P 6c 2c","194","","Ca Cd0.91 Fe10.09 O17 (H2 O)0.99","","- Ca Cd0.91 Fe10.09 H1.98 O17.99 -","- Ca Cd0.91 Fe10.09 O17.99 -","- Ca2 Cd1.82 Fe20.18 O35.98 -","2","0.0833333","","Keklikoglou, P.; Kalogirou, O.; Stergiou, A.C.","Crystallographic study of hydrated polycrystalline M-(beta"", beta) - ferrites (M = K(+), Mg(2+), Ca(2+))","Solid State Ionics","2000","136","","441","446","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526606","4.254","","4.254","","102.02","","90","","90","","120","","1598.86","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","","","- Ge1.1 Sb5.1 Te10.02 -","- Ge1.1 Sb5.1 Te10.02 -","- Ge3.3 Sb15.3 Te30.06 -","3","0.0833333","","Shelimova, L.E.; Kosyakov, V.I.; Kretova, M.A.; Karpinskii, O.G.; Shestakov, V.A.; Kuznetsov, F.A.; Zemskov, V.S.","Homologous series of layered tetradymite-like compounds in the Sb-Te and (Ge Te) - (Sb2 Te3) systems","Neorganicheskie Materialy","2000","36","","928","936","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1526607","5.4625","","5.4286","","24.94499","","90","","90","","90","","739.712","","","","","","","","","","","","","4","A 21 a m","A -2 2a","36","","Ca (Bi2 Ta2 O9)","","- Bi2 Ca O9 Ta2 -","- Bi2 Ca O9 Ta2 -","- Bi8 Ca4 O36 Ta8 -","4","0.5","","Shimakawa, Y.; Kubo, Y.; Asano, H.; Nakagawa, Y.; Izumi, F.; Kamiyama, T.; Goto, S.","Crystal structure and ferroelectric properties of A Bi2 Ta2 O9 (A = Ca, Sr and Ba)","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2000","61","","6559","6564","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526608","3.9265","","3.9265","","25.58659","","90","","90","","90","","394.479","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Ba (Bi2 Ta2 O9)","","- Ba Bi2 O9 Ta2 -","- Ba Bi2 O9 Ta2 -","- Ba2 Bi4 O18 Ta4 -","2","0.0625","","Shimakawa, Y.; Izumi, F.; Kubo, Y.; Goto, S.; Nakagawa, Y.; Asano, H.; Kamiyama, T.","Crystal structure and ferroelectric properties of A Bi2 Ta2 O9 (A =Ca, Sr and Ba)","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2000","61","","6559","6564","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526610","2.9997","","2.9997","","16.17259","","90","","90","","120","","126.028","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","Na0.9 (Ni0.45 Ti0.55) O2","","- Na0.9 Ni0.45 O2 Ti0.55 -","- Na0.9 Ni0.45 O2 Ti0.55 -","- Na2.7 Ni1.35 O6 Ti1.65 -","3","0.0833333","","Shin, Y.-J.; Yi, M.-Y.","Preparation and structural properties of layer-type oxides Nax Nix/2 Ti1-x/2 O2 (0.60 < x < 1.0)","Solid State Ionics","2000","132","","131","141","","","","","","","","","","","","","","","","","","","","","","has coordinates","147821","2020-10-21","18:00:00",""
"1526611","2.9614","","2.9614","","11.1403","","90","","90","","120","","84.61","","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","Na0.67 (Ni0.33) Ti0.67 O2","","- Na0.67 Ni0.33 O2 Ti0.67 -","- Na0.67 Ni0.33 O2 Ti0.67 -","- Na1.34 Ni0.66 O4 Ti1.34 -","2","0.0833333","","Shin, Y.-J.; Yi, M.-Y.","Preparation and structural properties of layer-type oxides Nax Nix/2 Ti1-x/2 O2 (0.60 < x < 1.0)","Solid State Ionics","2000","132","","131","141","","","","","","","","","","","","","","","","","","","","","","has coordinates","147822","2020-10-21","18:00:00",""
"1526613","9.83677","","9.83677","","56.3493","","90","","90","","120","","4721.98","","","","","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","La7 (Ru O6)3","","- La7 O18 Ru3 -","- La7 O18 Ru3 -","- La84 O216 Ru36 -","12","0.333333","","Khalifah, P.; Huang, Q.; Zandbergen, H.W.; Ho, D.M.; Cava, R.J.","La7 Ru3 O18 and La4.87 Ru2 O12: geometric frustration in two closely related structures with isolated Ru O6 octahedra","Journal of Solid State Chemistry","2000","155","","189","197","","","","","","","","","","","","","","","","","","","","","","has coordinates","147831","2020-10-21","18:00:00",""
"1526614","5.5798","","10.1286","","19.01","","90","","90.815","","90","","1074.25","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","La4.87 (Ru O6)2","","- La4.87 O12 Ru2 -","- La4.87 O12 Ru2 -","- La19.48 O48 Ru8 -","4","1","","Khalifah, P.; Huang, Q.; Ho, D.M.; Zandbergen, H.W.; Cava, R.J.","La7 Ru3 O18 and La4.87 Ru2 O12: geometric frustration in two closely related structures with isolated Ru O6 octahedra","Journal of Solid State Chemistry","2000","155","","189","197","","","","","","","","","","","","","","","","","","","","","","has coordinates","147833","2020-10-21","18:00:00",""
"1526615","11.2093","","7.4617","","7.60771","","90","","90","","90","","636.312","","","","","","","","","","","","","3","C m c m","-C 2c 2","63","","La3 (Ru O7)","","- La3 O7 Ru -","- La3 O7 Ru -","- La12 O28 Ru4 -","4","0.25","","Khalifah, P.; Cava, R.J.; Huang, Q.; Lynn, J.W.; Erwin, R.W.","Synthesis and crystal structure of La3 Ru O7","Materials Research Bulletin","2000","35","","1","7","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526616","10.517","","10.824","","16.916","","66.94","","67.14","","72.4","","1606.79","","","","","","","","","","","","","5","P -1","-P 1","2","","Na Cs5 (Mo7 O24) (H2 O)5","","- Cs5 H10 Mo7 Na O29 -","- Cs5 Mo7 Na O29 -","- Cs10 Mo14 Na2 O58 -","2","1","","Khazheeva, Z.I.; Khaikina, E.G.; Khal'baeva, K.M.; Molchanov, V.N.; Shibanova, T.A.; Simonov, V.I.","Crystal structure of Na Cs5 Mo7 O24 * 5(H2 O)","Kristallografiya","2000","45","","996","998","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526617","7.093","","7.782","","8.994","","90","","91.67","","90","","496.237","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Na2 (Pd (N O3)4)","","- N4 Na2 O12 Pd -","- N4 Na2 O12 Pd -","- N8 Na4 O24 Pd2 -","2","0.5","","Khranenko, S.P.; Baidina, I.A.; Gromilov, S.A.; Belyaev, A.V.","Synthesis and crystal structure of Na2 (Pd (N O3)4)","Zhurnal Strukturnoi Khimii (Issue-No. from 1981)","2000","41","","862","866","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526618","7.967","","10.956","","13.679","","90","","96.69","","90","","1185.86","","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Rb2 (U O2) (Mo O4)2 (H2 O)","","- H2 Mo2 O11 Rb2 U -","- Mo2 O11 Rb2 U -","- Mo8 O44 Rb8 U4 -","4","1","","Khrustalev, V.N.; Andreev, G.B.; Antipin, M.Yu.; Budantseva, N.A.; Fedoseev, A.M.; Shirokova, I.B.","Synthesis and crystal structure of rubidium uranyl dimolybdate Rb2 U O2 (Mo O4)2 * (H2 O)","Zhurnal Neorganicheskoi Khimii","2000","45","","1996","1998","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526620","8.699","","8.699","","3.876","","90","","90","","90","","293.307","","","","","","","","","","","","","5","P 4/m","-P 4","83","","La4 Ba Cu4 Ni O13.3","","- Ba Cu4 La4 Ni O13.3 -","- Ba Cu4 La4 Ni O13.3 -","- Ba Cu4 La4 Ni O13.3 -","1","0.125","","Shivakumara, C.; Hegde, M.S.; Rajagopal, H.; Sequiera, A.","Neutron diffraction studies of La4 Ba Cu4 M O13+d (M = Ni and Co) oxides","Materials Research Bulletin","2000","35","","2063","2068","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526621","8.695","","8.695","","3.876","","90","","90","","90","","293.037","","","","","","","","","","","","","5","P 4/m","-P 4","83","","La4 Ba Cu4 Co O13.49","","- Ba Co Cu4 La4 O13.49 -","- Ba Co1.002 Cu3.998 La4 O13.49 -","- Ba Co1.002 Cu3.998 La4 O13.49 -","1","0.125","","Shivakumara, C.; Rajagopal, H.; Hegde, M.S.; Sequiera, A.","Neutron diffraction studies of La4 Ba Cu4 M O13+d (M = Ni and Co) oxides","Materials Research Bulletin","2000","35","","2063","2068","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526625","12.016","","12.016","","14.12","","90","","90","","90","","2038.71","","","","","","","","","","","","","4","I 41/a m d :2","-I 4bd 2","141","","Pr4 S3 (Si2 O7)","","- O7 Pr4 S3 Si2 -","- O7 Pr4 S3 Si2 -","- O56 Pr32 S24 Si16 -","8","0.25","","Sieke, C.; Schleid, T.","Pr4 S3 (Si2 O7) und Pr3 Cl3 (Si2 O7) : durch weiche Fremdanionen modifizierte Derivate von Praseodymsilicat","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","196","201","","","","","","","","","","","","","","","","","","","","","","has coordinates","147854","2020-10-21","18:00:00",""
"1526627","5.3096","","12.002","","7.8311","","90","","109.07","","90","","471.656","","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","Pr3 Cl3 (Si2 O7)","","- Cl3 O7 Pr3 Si2 -","- Cl3 O7 Pr3 Si2 -","- Cl6 O14 Pr6 Si4 -","2","1","","Sieke, C.; Schleid, T.","Pr4 S3 (Si2 O7) und Pr3 Cl3 (Si2 O7) : durch weiche Fremdanionen modifizierte Derivate von Praseodymsilicat","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","196","201","","","","","","","","","","","","","","","","","","","","","","has coordinates","147856","2020-10-21","18:00:00",""
"1526629","14.166","","6.3879","","8.7221","","90","","98.403","","90","","780.798","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Nd3 Cl (Si O4)2","","- Cl Nd3 O8 Si2 -","- Cl Nd3 O8 Si2 -","- Cl4 Nd12 O32 Si8 -","4","0.5","","Sieke, C.; Hartenbach, I.; Schleid, T.","Zur Dimorphie von Nd3 Cl (Si O4)2","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","2236","2239","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526630","7.0936","","18.157","","6.3148","","90","","90","","90","","813.337","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Nd3 Cl (Si O4)2","","- Cl Nd3 O8 Si2 -","- Cl Nd3 O8 Si2 -","- Cl4 Nd12 O32 Si8 -","4","0.5","","Sieke, C.; Hartenbach, I.; Schleid, T.","Zur Dimorphie von Nd3 Cl (Si O4)2","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","2236","2239","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526631","7.3992","","23.001","","4.5139","","90","","90","","90","","768.216","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Yb5 In2 Sb6","","- In2 Sb6 Yb5 -","- In2 Sb6 Yb5 -","- In4 Sb12 Yb10 -","2","0.25","","Kim, S.-J.; Ireland, J.R.; Kanatzidis, M.G.; Kannewurf, C.R.","Yb5 In2 Sb6: a new rare earth Zintl phase with a narrow band gap","Journal of Solid State Chemistry","2000","155","","55","61","","","","","","","","","","","","","","","","","","","","","","has coordinates","147863","2020-10-21","18:00:00",""
"1526632","12.4175","","11.1583","","13.553","","90","","111.82","","90","","1743.34","","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","K4 Pu (S O4)4 (H2 O)2","","- H4 K4 O18 Pu S4 -","- K4 O18 Pu S4 -","- K16 O72 Pu4 S16 -","4","1","","Singh Mudher, K.D.; Krishnan, K.","Crystal structure of K4 Pu (S O4)4 * 2(H2 O)","Journal of Alloys Compd.","2000","313","","65","68","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526634","8.575","","8.575","","8.575","","90","","90","","90","","630.525","","","","","","","","","","","","","4","I m -3 m","-I 4 2 3","229","","K8 Ca2 (U6 O24)","","- Ca2 K8 O24 U6 -","- Ca2 K8 O24 U6 -","- Ca2 K8 O24 U6 -","1","0.0104167","","Singh Mudher, K.D.; Keskar, M.","Preparation and structure of K8 Ca2 U6 O24, K8 Sr2 U6 O24 and K8 Ba2 U6 O24","Materials Research Bulletin","2000","35","","33","38","","","","","","","","","","","","","","","","","","","","","","has coordinates","147866","2020-10-21","18:00:00",""
"1526636","8.659","","8.659","","8.659","","90","","90","","90","","649.237","","","","","","","","","","","","","4","I m -3 m","-I 4 2 3","229","","K8 Sr2 (U6 O24)","","- K8 O24 Sr2 U6 -","- K8 O24 Sr2 U6 -","- K8 O24 Sr2 U6 -","1","0.0104167","","Singh Mudher, K.D.; Keskar, M.","Preparation and structure of K8 Ca2 U6 O24, K8 Sr2 U6 O24 and K8 Ba2 U6 O24","Materials Research Bulletin","2000","35","","33","38","","","","","","","","","","","","","","","","","","","","","","has coordinates","147868","2020-10-21","18:00:00",""
"1526637","4.7365","","4.7365","","3.201","","90","","90","","90","","71.813","","","","","","","","","","","","","2","P 42/m n m","-P 4n 2n","136","","Sn O2","","- O2 Sn -","- O2 Sn -","- O4 Sn2 -","2","0.125","","Kim, Y.-I.; Jung, M.-J.; Kim, K.H.","Application of inverse pole figure to Rietveld refinement: III. Rietveld refinement of Sn O2 thin film using X-ray diffraction data","The Korean Journal of Ceramics","2000","6","","354","358","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526638","8.723","","8.723","","8.723","","90","","90","","90","","663.739","","","","","","","","","","","","","4","I m -3 m","-I 4 2 3","229","","K8 Ba2 (U6 O24)","","- Ba2 K8 O24 U6 -","- Ba2 K8 O24 U6 -","- Ba2 K8 O24 U6 -","1","0.0104167","","Singh Mudher, K.D.; Keskar, M.","Preparation and structure of K8 Ca2 U6 O24, K8 Sr2 U6 O24 and K8 Ba2 U6 O24","Materials Research Bulletin","2000","35","","33","38","","","","","","","","","","","","","","","","","","","","","","has coordinates","147870","2020-10-21","18:00:00",""
"1526641","18.02411","","13.91737","","9.65536","","90","","90","","90","","2422.03","","","","","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","Al (P O4)","","- Al O4 P -","- Al O4 P -","- Al24 O96 P24 -","24","3","","Kirchner, R.M.; Grosse-Kunstleve, R.W.; Pluth, J.J.; Smith, J.V.; Broach, R.W.; Wilson, S.T.","The structures of as-synthesized Al P O4 - 53(A), calcined dehydrated Al P O4 - 53(B), and Al P O4 - 53(C), a new phase determined by the FOCUS method","Microporous and Mesoporous Materials","2000","39","","319","332","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526643","10.32122","","13.63081","","17.45386","","90","","90","","90","","2455.52","","","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","(Al24 (P O4)24) ((C H3) N H2)8 (H2 O)16","","- C8 H72 Al24 N8 O112 P24 -","- C8 Al24 N8 O112 P24 -","- C8 Al24 N8 O112 P24 -","1","0.25","","Kirchner, R.M.; Wilson, S.T.; Pluth, J.J.; Grosse-Kunstleve, R.W.; Broach, R.W.; Smith, J.V.","The structures of as-synthesized Al P O4 - 53(A), calcined dehydrated Al P O4 - 53(B), and Al P O4 - 53(C), a new phase determined by the FOCUS method","Microporous and Mesoporous Materials","2000","39","","319","332","","","","","","","","","","","","","","","","","","","","","","has coordinates","147875","2020-10-21","18:00:00",""
"1526644","16.44398","","5.1075","","13.4846","","90","","88.259","","90","","1132.02","","","","","","","","","","","","","3","C 1 2 1","C 2y","5","","Al (P O4)","","- Al O4 P -","- Al O4 P -","- Al12 O48 P12 -","12","3","","Kirchner, R.M.; Grosse-Kunstleve, R.W.; Pluth, J.J.; Broach, R.W.; Wilson, S.T.; Smith, J.V.","The structures of as-synthesized Al P O4 - 53(A), calcined dehydrated Al P O4 - 53(B), and Al P O4 - 53(C), a new phase determined by the FOCUS method","Microporous and Mesoporous Materials","2000","39","","319","332","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526645","7.59","","7.59","","13.886","","90","","90","","120","","692.774","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","(Ta2.39 Nb0.61) Te I7","","- I7 Nb0.61 Ta2.39 Te -","- I7 Nb0.606 Ta2.394 Te -","- I14 Nb1.212 Ta4.788 Te2 -","2","0.166667","","Smith, M.D.; Miller, G.J.","Tantalum-niobium mixing in Ta3-x Nbx Te I7 (0 <= x <= 3)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","94","102","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526647","7.62","","7.62","","6.913","","90","","90","","120","","347.622","","","","","","","","","","","","","4","P 3 m 1","P 3 -2""","156","","(Ta1.34 Nb1.66) Te I7","","- I7 Nb1.66 Ta1.34 Te -","- I7 Nb1.662 Ta1.338 Te -","- I7 Nb1.662 Ta1.338 Te -","1","0.166667","","Smith, M.D.; Miller, G.J.","Tantalum-niobium mixing in Ta3-x Nbx Te I7 (0 <= x <= 3)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","94","102","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526648","3.657","","3.657","","10.213","","90","","90","","120","","118.286","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Cd (O D) Cl","","- Cd Cl D O -","- Cd Cl D0.999 O -","- Cd2 Cl2 D1.998 O2 -","2","0.166667","","Kister, S.; Kockelmann, W.; Keller, H.L.","Hydrogen position, hydrogen bonding and hydroxide dynamics in the Cd (O H) Cl structure type","Physik (Berlin)","2000","276","","262","263","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526649","7.622","","7.622","","6.902","","90","","90","","120","","347.251","","","","","","","","","","","","","4","P 3 m 1","P 3 -2""","156","","(Ta0.86 Nb2.14) Te I7","","- I7 Nb2.14 Ta0.86 Te -","- I7 Nb2.142 Ta0.858 Te -","- I7 Nb2.142 Ta0.858 Te -","1","0.166667","","Smith, M.D.; Miller, G.J.","Tantalum-niobium mixing in Ta3-x Nbx Te I7 (0 <= x <= 3)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","94","102","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526651","7.599","","7.599","","13.892","","90","","90","","120","","694.718","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","(Ta1.97 Nb1.03) Te I7","","- I7 Nb1.03 Ta1.97 Te -","- I7 Nb1.026 Ta1.974 Te -","- I14 Nb2.052 Ta3.948 Te2 -","2","0.166667","","Smith, M.D.; Miller, G.J.","Tantalum-niobium mixing in Ta3-x Nbx Te I7 (0 <= x <= 3)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","94","102","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526654","25.06","","25.06","","25.06","","90","","90","","90","","15737.8","","","","","","","","","","","","","5","F d -3 :2","-F 2uv 2vw 3","203","","Na7.4 Se46.1 (Al96 Si96 O384)","","- Al96 Na7.4 O384 Se46.1 Si96 -","- Al96 Na7.408 O384 Se46.032 Si96 -","- Al96 Na7.408 O384 Se46.032 Si96 -","1","0.0104167","","Smolin, Yu.I.; Shepelev, Yu.F.; Lapshin, A.E.; Vasil'eva, E.A.","Structure of selenium and tellurium clusters in cavities of NaX zeolite","Kristallografiya","2000","45","","27","31","","","","","","","","","","","","","","","","","","","","","","has coordinates","147888","2020-10-21","18:00:00",""
"1526656","25.14","","25.14","","25.14","","90","","90","","90","","15889","","","","","","","","","","","","","5","F d -3 :2","-F 2uv 2vw 3","203","","Na36 Te38.1 (Al96 Si96 O384)","","- Al96 Na36 O384 Si96 Te38.1 -","- Al96 Na36 O384 Si96 Te38.064 -","- Al96 Na36 O384 Si96 Te38.064 -","1","0.0104167","","Smolin, Yu.I.; Shepelev, Yu.F.; Lapshin, A.E.; Vasil'eva, E.A.","Structure of selenium and tellurium clusters in cavities of NaX zeolite","Kristallografiya","2000","45","","27","31","","","","","","","","","","","","","","","","","","","","","","has coordinates","147890","2020-10-21","18:00:00",""
"1526658","13.438","","6.666","","18.203","","90","","101.9","","90","","1595.54","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Er2 (S O4)3 (H2 O)8","","- Er2 H16 O20 S3 -","- Er2 O20 S3 -","- Er8 O80 S12 -","4","0.5","","Soboleva, L.V.; Pietraszko, A.; Kirpichnikova, L.F.; Shuvalov, L.A.","Growth of Er2 (S O4)3 * 8(H2 O) crystals and study of their structure and properties","Kristallografiya","2000","45","","791","792","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526660","5.4482","","10.916","","15.445","","90","","90","","90","","918.554","","","","","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","K Al O2","","- Al K O2 -","- Al K O2 -","- Al16 K16 O32 -","16","2","","Sokolowski, J.; Kotarba, A.","The structure of potassium aluminium oxide K Al O2","Materials Science Forum","2000","321","","954","959","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526662","9.23","","9.31","","12.975","","83.36","","84.1","","82.33","","1093.24","","","","","","","","","","","","","3","P -1","-P 1","2","","(Re6 Se4 Br4) Br6","","- Br10 Re6 Se4 -","- Br10 Re6 Se4 -","- Br20 Re12 Se8 -","2","1","","Solodovnikov, S.F.; Yarovoi, S.S.; Mironov, Yu.V.; Virovets, A.V.; Fedorov, V.E.","Crystal chemistry of octahedral clusters of rhenium chalcohalides Re6 X4 Y10 (X = S, Se, Te; Y = Cl, Br)","Khim. Interesakh. Ustoich. Razvit.","2000","8","","285","290","","","","","","","","","","","","","","","","","","","","","","has coordinates","147896","2020-10-21","18:00:00",""
"1526663","13.718","","13.718","","8.4526","","90","","90","","120","","1377.54","","","","","","","","","","","","","3","P 6 c c","P 6 -2c","184","","Al (P O4)","","- Al O4 P -","- Al O3.9996 P -","- Al12 O47.9952 P12 -","12","1","","Klap, G.J.; Graafsma, H.; van Koningsveld, H.; Schreurs, A.M.M.","Absolute configuration and domain structure of (Al P O4)-5 studied by single-crystal X-ray diffraction","Microporous and Mesoporous Materials","2000","38","","403","412","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526666","6.773","","20.866","","6.551","","90","","102.98","","90","","902.167","","","","","","","","","","","","","5","C 1 m 1","C -2y","8","","(Y (N4 C2 H O3)2 (N O3) (H2 O)5) (H2 O)2","","- C4 H16 N9 O16 Y -","- C4 H16 N9 O16 Y -","- C8 H32 N18 O32 Y2 -","2","0.5","","Song, J.; Kang, B.; Ning, B.; Hu, R.","Preparation, crystal structure and thermal decomposition process of (Y (NTO)2 NO3 (H2 O)5) * 2(H2 O)","Thermochimica Acta","2000","352","","111","115","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526678","9.804","","9.804","","58.467","","90","","90","","120","","4866.85","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","Nd2 Zr3 (Mo O4)9","","- Mo9 Nd2 O36 Zr3 -","- Mo9 Nd2 O36 Zr3 -","- Mo54 Nd12 O216 Zr18 -","6","0.166667","","Klevtsova, R.F.; Solodovnikov, S.F.; Tushinova, Yu.L.; Bazarova, Zh.G.; Bazarov, B.G.; Glinskaya, L.A.","A new type of mixed framework in the crystal structure of binary molybdate Nd2 Zr3 (Mo O4)9","Zhurnal Strukturnoi Khimii (Issue-No. from 1981)","2000","41","","343","348","","","","","","","","","","","","","","","","","","","","","","has coordinates","147913","2020-10-21","18:00:00",""
"1526680","6.1486","","7.3155","","7.5371","","90","","90","","90","","339.019","","","","","","","","","","","","","3","P n n m","-P 2 2n","58","","Mn (N (C N)2)2","","- C4 Mn N6 -","- C4 Mn N6 -","- C8 Mn2 N12 -","2","0.25","","Kmety, C.R.; Huang, Q.-Z.; Lynn, J.W.; McCall, S.; Manson, J.L.; Epstein, A.J.; Crow, J.E.; Erwin, R.W.; Stevenson, K.L.; Miller, J.S.","Noncollinear antiferromagnetic structure of the molecule-based magnet Mn (N (C N)2)2","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2000","62","","5576","5588","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526681","12.368","","12.368","","11.83","","90","","90","","120","","1567.16","","","","","","","","","","","","","6","R -3 :H","-R 3","148","","(Co (N H3)6) (Os (S C N)6)","","- C6 H18 Co N12 Os S6 -","- C6 H18 Co N12 Os S6 -","- C18 H54 Co3 N36 Os3 S18 -","3","0.166667","","Staehler, O.; Preetz, W.","Darstellung, Kristallstruktur, Schwingungsspektren und Normalkoordinatenanalyse von (Co (N H3)6) (Os (S C N)6)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","2077","2080","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526682","8.76035","","6.2214","","6.20939","","90","","90","","90","","338.422","","","","","","","","","","","","","3","P m c n","-P 2n 2a","62","","Ba (Ce O3)","","- Ba Ce O3 -","- Ba Ce O3 -","- Ba4 Ce4 O12 -","4","0.5","","Knight, K.S.","Powder neutron diffraction studies of Ba Ce0.9 Y0.1 O2.95 and Ba Ce O3 at 4.2 K: a possible structural site for the proton","Solid State Ionics","2000","127","","43","48","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526684","8.75847","","6.22666","","6.21109","","90","","90","","90","","338.728","","","","","","","","","","","","","5","P m c n","-P 2n 2a","62","","Ba Ce0.9 Y0.1 H0.14 O2.95","","- Ba Ce0.9 H0.14 O2.95 Y0.1 -","- Ba Ce0.9 H0.14 O2.95 Y0.1 -","- Ba4 Ce3.6 H0.56 O11.8 Y0.4 -","4","0.5","","Knight, K.S.","Powder neutron diffraction studies of Ba Ce0.9 Y0.1 O2.95 and Ba Ce O3 at 4.2 K: a possible structural site for the proton","Solid State Ionics","2000","127","","43","48","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526685","2.9302","","2.9302","","14.5395","","90","","90","","120","","108.112","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","Li1.8 Ir0.6 Fe0.6 O3","","- Fe0.6 Ir0.6 Li1.8 O3 -","- Fe0.6 Ir0.6 Li1.8 O3 -","- Fe1.2 Ir1.2 Li3.6 O6 -","2","0.0555556","","Kobayashi, H.; Yamamoto, Y.; Uebou, Y.; Kageyama, H.; Tabuchi, M.; Tamaki, J.; Matsuoka, M.; Sukeshini, A.M.","Synthesis, structures and charge-discharge characteristics of the layered oxide, Li1.8 Ir0.6 Fe0.6 O3","Electrochemical Society Proceedings","2000","99","","254","264","","","","","","","","","","","","","","","","","","","","","","has coordinates","147920","2020-10-21","18:00:00",""
"1526686","12.743","","12.743","","27.794","","90","","90","","120","","3908.63","","","","","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","Rb9.15 (W6 N15)","","- N15 Rb9.15 W6 -","- N15 Rb9.15 W6 -","- N90 Rb54.9 W36 -","6","0.166667","","Stegen, H.; Jacobs, H.","Alkalimetallnitrido-tecto-metallate(VI) mit Netzwerken von Sechsringen spitzenverknuepfter Tetraeder ((M N N3/2)6) mit M = Mo, W der unerwarteten Zusammensetzung A9+x (M6 N15) mit A = Rb, Cs und 0 < x < 1","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","639","644","","","","","","","","","","","","","","","","","","","","","","has coordinates","147921","2020-10-21","18:00:00",""
"1526688","13.104","","13.104","","28.43","","90","","90","","120","","4227.81","","","","","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","Cs9.98 (Mo6 N15)","","- Cs9.98 Mo6 N15 -","- Cs9.98 Mo6 N15 -","- Cs59.88 Mo36 N90 -","6","0.166667","","Stegen, H.; Jacobs, H.","Alkalimetallnitrido-tecto-metallate(VI) mit Netzwerken von Sechsringen spitzenverknuepfter Tetraeder ((M N N3/2)6) mit M = Mo,W der unerwarteten Zusammensetzung A9+x (M6 N15) mit A = Rb, Cs und0 < x < 1","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","639","644","","","","","","","","","","","","","","","","","","","","","","has coordinates","147923","2020-10-21","18:00:00",""
"1526690","13.136","","13.136","","28.4719","","90","","90","","120","","4254.74","","","","","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","Cs9.67 (W6 N15)","","- Cs9.67 N15 W6 -","- Cs9.67 N15 W6 -","- Cs58.02 N90 W36 -","6","0.166667","","Stegen, H.; Jacobs, H.","Alkalimetallnitrido-tecto-metallate(VI) mit Netzwerken von Sechsringen spitzenverknuepfter Tetraeder ((M N N3/2)6) mit M = Mo,W der unerwarteten Zusammensetzung A9+x (M6 N15) mit A = Rb, Cs und0 < x < 1","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","639","644","","","","","","","","","","","","","","","","","","","","","","has coordinates","147925","2020-10-21","18:00:00",""
"1526693","5.4744","","5.4766","","9.1505","","83.53","","76.68","","60.06","","231.335","","","","","","","","","","","","","6","P -1","-P 1","2","","(Fe1.4 Mg0.6) (Fe0.16 Al3.84) Si2 O10 (O H)4","","- Al3.84 Fe1.56 H4 Mg0.6 O14 Si2 -","- Al3.844 Fe1.558 Mg0.598 O14 Si2 -","- Al3.844 Fe1.558 Mg0.598 O14 Si2 -","1","0.5","","Koch-Mueller, M.; Kahlenberg, V.; Schmidt, C.; Wirth, R.","Location of (O H) groups and oxidation processes in triclinic chloritoid","Physics and Chemistry of Minerals (Germany)","2000","27","","703","712","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526694","5.9436","","5.9436","","35.743","","90","","90","","120","","1093.51","","","","","","","","","","","","","6","R -3 m :H","-R 3 2""","166","","K0.294 Na0.62 Ba0.62 Mg0.29 Fe10.44 O17","","- Ba0.62 Fe10.44 K0.294 Mg0.29 Na0.62 O17 -","- Ba0.618 Fe10.44 K0.294 Mg0.29 Na0.618 O17 -","- Ba1.854 Fe31.32 K0.882 Mg0.87 Na1.854 O51 -","3","0.0833333","","Stergiou, A.C.; Gioureli, D.K.; Samaras, D.; Litsardakis, G.","Crystal structure of non-stoichiometric beta"" K-Ba-Na mixed ferrite K0.30 Na0.62 Ba0.62 Fe10.44 Mg0.29 O17","Solid State Ionics","2000","136","","513","517","","","","","","","","","","","","","","","","","","","","","","has coordinates","147929","2020-10-21","18:00:00",""
"1526695","3.9768","","3.9768","","21.70619","","90","","90","","90","","343.282","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","K1.98 Sr1.04 (Ta2.16 O7)","","- K1.98 O7 Sr1.04 Ta2.16 -","- K1.98 O7 Sr1.04 Ta2.16 -","- K3.96 O14 Sr2.08 Ta4.32 -","2","0.0625","","Kodenkandath, T.A.; Wiley, J.B.","Synthesis and structure of a double-layered perovskite and its hydrate, K2 Sr Ta2 O7 * m(H2 O) (m=0,2)","Materials Research Bulletin","2000","35","","1737","1742","","","","","","","","","","","","","","","","","","","","","","has coordinates","147930","2020-10-21","18:00:00",""
"1526696","3.9599","","3.9599","","12.7658","","90","","90","","90","","200.178","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","K2 Sr (Ta2 O7) (H2 O)2","","- H4 K2 O9 Sr Ta2 -","- K1.978 O9 Sr1.001 Ta2.014 -","- K1.978 O9 Sr1.001 Ta2.014 -","1","0.0625","","Kodenkandath, T.A.; Wiley, J.B.","Synthesis and structure of a double-layered perovskite and its hydrate, K2 Sr Ta2 O7 * m(H2 O) (m=0,2)","Materials Research Bulletin","2000","35","","1737","1742","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526697","8.968","","8.968","","18.119","","90","","90","","90","","1457.22","","","","","","","","","","","","","2","P 4","P 4","75","","","","- Pr Te2 -","- Pr Te1.998 -","- Pr16 Te31.968 -","16","4","","Stoewe, K.","Die Kristallstruktur von Pr Te2","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","803","811","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1526699","4.0259","","4.0259","","9.556","","90","","90","","90","","154.882","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","","","- Ce Ni2 Si2 -","- Ce Ni2 Si2 -","- Ce2 Ni4 Si4 -","2","0.0625","","Streletskii, A.N.; Morozkin, A.V.; Portnoy, V.K.; Berestetskaya, I.V.; Verbetskii, V.N.","Possibilities of the Ce Ni2 Si2 hydrogenation under mechanical treatment","Materials Research Bulletin","2000","35","","719","726","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1526711","9.9872","","9.9872","","9.9872","","90","","90","","90","","996.165","","","","","","","","","","","","","5","P a -3","-P 2ac 2ab 3","205","","(Ru (N H3)6) (Al F6)","","- Al F6 H18 N6 Ru -","- Al F6 H18 N6 Ru -","- Al4 F24 H72 N24 Ru4 -","4","0.166667","","Subramanian, M.A.; Harlow, R.H.; Rao, V.N.M.","New (Ru (N H3)6) M F6 phases: precursors to catalysts for halogenation reactions","Materials Research Bulletin","2000","35","","1587","1592","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526715","9.48","","9.48","","6.898","","90","","90","","120","","536.872","","","","","","","","","","","","","4","P -6","P -6","174","","Ca9.55 ((P O4)5.52 (C O3)0.48) (C O3)1.157","","- C1.637 Ca9.55 O26.991 P5.52 -","- C1.56 Ca9.55 O26.99 P5.52 -","- C1.56 Ca9.55 O26.99 P5.52 -","1","0.166667","","Suetsugu, Y.; Takahashi, Y.; Okamura, F.P.; Tanaka, J.","Structure analysis of A-type carbonate apatite by a single-crystal X-ray diffraction method","Journal of Solid State Chemistry","2000","155","","292","297","","","","","","","","","","","","","","","","","","","","","","has coordinates","147956","2020-10-21","18:00:00",""
"1526719","12.831","","27.052","","9.298","","90","","90.81","","90","","3227.05","","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(C (N H2)3)2 (Pb I4)","","- C2 H12 I4 N6 Pb -","- C2 I4 N6 Pb -","- C16 I32 N48 Pb8 -","8","2","","Szafranski, M.; Katrusiak, A.","Phase transitions in the layered structure of diguanidinium tetraiodoplumbate","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2000","61","","1026","1035","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526720","5.561","","5.561","","26.24","","90","","90","","120","","702.749","","","","","","","","","","","","","3","R -3 :H","-R 3","148","","La4 (Ti3 O12)","","- La4 O12 Ti3 -","- La4 O12 Ti3 -","- La12 O36 Ti9 -","3","0.166667","","Konstantinov, P.; Krezhov, K.; Svab, E.; Torok, G.; Meszaros, G.","Neutron powder diffraction refinement of the crystal structure of La4 Ti3 O12","Physik (Berlin)","2000","276","","260","261","","","","","","","","","","","","","","","","","","","","","","has coordinates","147961","2020-10-21","18:00:00",""
"1526724","8.5146","","9.5848","","6.3052","","90","","97.981","","90","","509.588","","","","","","","","","","","","","4","C 1 2 1","C 2y","5","","K Cr (P2 S7)","","- Cr K P2 S7 -","- Cr K P2 S7 -","- Cr2 K2 P4 S14 -","2","0.5","","Kopnin, E.; Coste, S.; Jobic, S.; Evain, M.; Brec, R.","Synthesis and crystal structure determination of three layered-type thiophosphate compounds K M P2 S7 (M = Cr, V, In)","Materials Research Bulletin","2000","35","","1401","1410","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526726","8.7506","","9.9685","","6.3151","","90","","98.906","","90","","544.227","","","","","","","","","","","","","4","C 1 2 1","C 2y","5","","K In (P2 S7)","","- In K P2 S7 -","- In K P2 S7 -","- In2 K2 P4 S14 -","2","0.5","","Kopnin, E.; Coste, S.; Jobic, S.; Brec, R.; Evain, M.","Synthesis and crystal structure determination of three layered-typethiophosphate compounds K M P2 S7 (M = Cr, V, In)","Materials Research Bulletin","2000","35","","1401","1410","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526728","8.5553","","9.5765","","6.3323","","90","","98.63","","90","","512.93","","","","","","","","","","","","","4","C 1 2 1","C 2y","5","","K V (P2 S7)","","- K P2 S7 V -","- K P2 S7 V -","- K2 P4 S14 V2 -","2","0.5","","Kopnin, E.; Coste, S.; Brec, R.; Jobic, S.; Evain, M.","Synthesis and crystal structure determination of three layered-typethiophosphate compounds K M P2 S7 (M = Cr, V, In)","Materials Research Bulletin","2000","35","","1401","1410","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526730","8.484","","7.842","","10.353","","90","","90.5","","90","","688.775","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Na (H2 P O4) (H3 P O4)","","- H5 Na O8 P2 -","- H5 Na O8 P2 -","- H20 Na4 O32 P8 -","4","1","","Kosterina, E.V.; Rybakov, V.B.; Troyanov, S.I.; Kemnitz, E.","Crystal structure of two modifications of sodium hydrogen phosphate Na H5 (P O4)2","Kristallografiya","2000","45","","620","624","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526732","7.127","","13.346","","7.177","","90","","95.51","","90","","679.5","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Na (H2 P O4) (H3 P O4)","","- H5 Na O8 P2 -","- H5 Na O8 P2 -","- H20 Na4 O32 P8 -","4","1","","Kosterina, E.V.; Rybakov, V.B.; Kemnitz, E.; Troyanov, S.I.","Crystal structure of two modifications of sodium hydrogen phosphate Na H5 (P O4)2","Kristallografiya","2000","45","","620","624","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526733","3.973","","11.228","","5.595","","90","","134.75","","90","","177.253","","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Nd2 Gd2 O3 F6","","- F6 Gd2 Nd2 O3 -","- F6 Gd2 Nd2 O3 -","- F6 Gd2 Nd2 O3 -","1","0.25","","Takashima, M.; Nakajima, Y.; Tanioka, T.; Yonezawa, S.; Leblanc, M.","Oxide ion conductive structure and chemical stability of Nd2 Gd2 O3 F6","Solid State Sciences","2000","2","","71","76","","","","","","","","","","","","","","","","","","","","","","has coordinates","147974","2020-10-21","18:00:00",""
"1526736","4.321","","16.344","","8.731","","90","","90","","90","","616.604","","","","","","","","","","","","","3","I m m m","-I 2 2","71","","Ho Pt Ge2","","- Ge2 Ho Pt -","- Ge2 Ho Pt -","- Ge16 Ho8 Pt8 -","8","0.5","","Kotsanidis, P.A.; Schaefer, W.","Neutron diffraction study of R Pt Ge2 (R = Dy, Ho) compounds","Physik (Berlin)","2000","276","","648","649","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526738","3.8874","","3.8874","","13.992","","90","","90","","90","","211.445","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","Sr2 Ni N2","","- N2 Ni Sr2 -","- N2 Ni Sr2 -","- N4 Ni2 Sr4 -","2","0.0625","","Kowach, G.R.; Brese, N.E.; DiSalvo, F.J.; Bolle, U.M.; Warren, C.J.","An unusual metallic nitride: Sr2 Ni N2","Journal of Solid State Chemistry","2000","154","","542","550","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526739","8.293","","8.293","","5.078","","90","","90","","120","","302.445","","","","","","","","","","","","","5","P 3 2 1","P 3 2""","150","","Sr3 (Ta Ga3 Si2 O14)","","- Ga3 O14 Si2 Sr3 Ta -","- Ga3 O14 Si2 Sr3 Ta -","- Ga3 O14 Si2 Sr3 Ta -","1","0.166667","","Takeda, H.; Sato, J.; Fukuda, T.; Kawasaki, K.; Morikoshi, H.; Kato, T.; Shimamura, K.","Synthesis and characterization of Sr3 Ta Ga3 Si2 O14 single crystals","Materials Research Bulletin","2000","35","","245","252","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526740","7.81","","3.89","","14.01","","90","","90","","90","","425.636","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Sr2 Ni N2","","- N2 Ni Sr2 -","- N2 Ni Sr2 -","- N8 Ni4 Sr8 -","4","0.5","","Kowach, G.R.; Brese, N.E.; Bolle, U.M.; Warren, C.J.; DiSalvo, F.J.","An unusual metallic nitride: Sr2 Ni N2","Journal of Solid State Chemistry","2000","154","","542","550","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526741","5.35326","","7.5548","","5.34146","","90","","90","","90","","216.024","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","(Ca0.9 Sr0.1) (Fe O3)","","- Ca0.9 Fe O3 Sr0.1 -","- Ca0.9 Fe O3 Sr0.1 -","- Ca3.6 Fe4 O12 Sr0.4 -","4","0.5","","Takeda, T.; Kanno, R.; Kawamoto, Y.; Izumi, F.; Takano, M.; Kawasaki, S.; Kamiyama, T.","Metal-semiconductor transition, charge disproportionation, and low-temperature structure of Ca1-x Srx Fe O3 synthesized under high-oxygen pressure","Solid State Sciences","2000","2","","673","687","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526742","10.197","","4.045","","6.614","","90","","101.11","","90","","267.694","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","Tb2 Al3 Si2","","- Al3 Si2 Tb2 -","- Al3 Si2 Tb2 -","- Al6 Si4 Tb4 -","2","0.25","","Kranenberg, C.; Mewis, A.","Darstellung und Kristallstrukturen von Ln2 Al3 Si2 und Ln2 Al Si2 (Ln : Y, Tb - Lu)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","1448","1453","","","","","","","","","","","","","","","","","","","","","","has coordinates","147983","2020-10-21","18:00:00",""
"1526743","5.3602","","7.5762","","5.3605","","90","","90","","90","","217.69","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","(Ca0.8 Sr0.2) (Fe O3)","","- Ca0.8 Fe O3 Sr0.2 -","- Ca0.8 Fe O3 Sr0.2 -","- Ca3.2 Fe4 O12 Sr0.8 -","4","0.5","","Takeda, T.; Kanno, R.; Kawamoto, Y.; Takano, M.; Kawasaki, S.; Izumi, F.; Kamiyama, T.","Metal-semiconductor transition, charge disproportionation, and low-temperature structure of Ca1-x Srx Fe O3 synthesized under high-oxygen pressure","Solid State Sciences","2000","2","","673","687","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526744","10.144","","4.028","","6.58","","90","","101.04","","90","","263.883","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","Dy2 Al3 Si2","","- Al3 Dy2 Si2 -","- Al3 Dy2 Si2 -","- Al6 Dy4 Si4 -","2","0.25","","Kranenberg, C.; Mewis, A.","Darstellung und Kristallstrukturen von Ln2 Al3 Si2 und Ln2 Al Si2 (Ln : Y, Tb - Lu)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","1448","1453","","","","","","","","","","","","","","","","","","","","","","has coordinates","147985","2020-10-21","18:00:00",""
"1526745","5.39295","","7.6062","","5.3824","","90","","90","","90","","220.785","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","(Ca0.6 Sr0.4) (Fe O3)","","- Ca0.6 Fe O3 Sr0.4 -","- Ca0.6 Fe O3 Sr0.4 -","- Ca2.4 Fe4 O12 Sr1.6 -","4","0.5","","Takeda, T.; Takano, M.; Kanno, R.; Kawamoto, Y.; Kawasaki, S.; Kamiyama, T.; Izumi, F.","Metal-semiconductor transition, charge disproportionation, and low-temperature structure of Ca1-x Srx Fe O3 synthesized under high-oxygen pressure","Solid State Sciences","2000","2","","673","687","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526746","8.663","","5.748","","4.05","","90","","90","","90","","201.669","","","","","","","","","","","","","3","I m m m","-I 2 2","71","","Y2 Al Si2","","- Al Si2 Y2 -","- Al Si2 Y2 -","- Al2 Si4 Y4 -","2","0.125","","Kranenberg, C.; Mewis, A.","Darstellung und Kristallstrukturen von Ln2 Al3 Si2 und Ln2 Al Si2 (Ln : Y, Tb - Lu)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","1448","1453","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526747","3.8367","","3.8367","","3.8367","","90","","90","","90","","56.477","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","(Ca0.2 Sr0.8) (Fe O3)","","- Ca0.2 Fe O3 Sr0.8 -","- Ca0.2 Fe O3 Sr0.8 -","- Ca0.2 Fe O3 Sr0.8 -","1","0.0208333","","Takeda, T.; Kamiyama, T.; Kanno, R.; Izumi, F.; Kawamoto, Y.; Takano, M.; Kawasaki, S.","Metal-semiconductor transition, charge disproportionation, and low-temperature structure of Ca1-x Srx Fe O3 synthesized under high-oxygen pressure","Solid State Sciences","2000","2","","673","687","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526748","8.578","","5.732","","4.022","","90","","90","","90","","197.758","","","","","","","","","","","","","3","I m m m","-I 2 2","71","","Ho2 Al Si2","","- Al Ho2 Si2 -","- Al Ho2 Si2 -","- Al2 Ho4 Si4 -","2","0.125","","Kranenberg, C.; Mewis, A.","Darstellung und Kristallstrukturen von Ln2 Al3 Si2 und Ln2 Al Si2 (Ln : Y, Tb - Lu)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","1448","1453","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526749","5.31301","","5.34719","","7.52351","","90","","90.063","","90","","213.74","","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Ca (Fe O3)","","- Ca Fe O3 -","- Ca Fe O3 -","- Ca4 Fe4 O12 -","4","1","","Takeda, T.; Takano, M.; Kawamoto, Y.; Kanno, R.; Kamiyama, T.; Kawasaki, S.; Izumi, F.","Metal-semiconductor transition, charge disproportionation, and low-temperature structure of Ca1-x Srx Fe O3 synthesized under high-oxygen pressure","Solid State Sciences","2000","2","","673","687","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526750","8.529","","5.719","","4.011","","90","","90","","90","","195.646","","","","","","","","","","","","","3","I m m m","-I 2 2","71","","Er2 Al Si2","","- Al Er2 Si2 -","- Al Er2 Si2 -","- Al2 Er4 Si4 -","2","0.125","","Kranenberg, C.; Mewis, A.","Darstellung und Kristallstrukturen von Ln2 Al3 Si2 und Ln2 Al Si2 (Ln : Y, Tb - Lu)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","1448","1453","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526751","5.35168","","7.54004","","5.32613","","90","","90","","90","","214.919","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Ca (Fe O3)","","- Ca Fe O3 -","- Ca Fe O3 -","- Ca4 Fe4 O12 -","4","0.5","","Takeda, T.; Kanno, R.; Kawamoto, Y.; Takano, M.; Kawasaki, S.; Kamiyama, T.; Izumi, F.","Metal-semiconductor transition, charge disproportionation, and low-temperature structure of Ca1-x Srx Fe O3 synthesized under high-oxygen pressure","Solid State Sciences","2000","2","","673","687","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526752","8.454","","5.737","","3.984","","90","","90","","90","","193.226","","","","","","","","","","","","","3","I m m m","-I 2 2","71","","Tm2 Al Si2","","- Al Si2 Tm2 -","- Al Si2 Tm2 -","- Al2 Si4 Tm4 -","2","0.125","","Kranenberg, C.; Mewis, A.","Darstellung und Kristallstrukturen von Ln2 Al3 Si2 und Ln2 Al Si2 (Ln : Y, Tb - Lu)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","1448","1453","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526753","8.774","","6.239","","6.204","","90","","90","","90","","339.613","","","","","","","","","","","","","4","P m c n","-P 2n 2a","62","","Ba (Ce0.9 Y0.1) O2.95","","- Ba Ce0.9 O2.95 Y0.1 -","- Ba Ce0.9 O2.951 Y0.1 -","- Ba4 Ce3.6 O11.804 Y0.4 -","4","0.5","","Takeuchi, K.; Richardson, J.W.jr.; Loong, C.-K.; Guan, J.; Dorris, S.E.; Balachandran, U.","The crystal structures and phase transitions in Y-doped Ba Ce O3: their dependence on Y concentration and hydrogen doping","Solid State Ionics","2000","138","","63","77","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526754","8.416","","5.662","","4.001","","90","","90","","90","","190.653","","","","","","","","","","","","","3","I m m m","-I 2 2","71","","Lu2 Al Si2","","- Al Lu2 Si2 -","- Al Lu2 Si2 -","- Al2 Lu4 Si4 -","2","0.125","","Kranenberg, C.; Mewis, A.","Darstellung und Kristallstrukturen von Ln2 Al3 Si2 und Ln2 Al Si2 (Ln : Y, Tb - Lu)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","1448","1453","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526755","6.218","","6.218","","15.192","","90","","90","","120","","508.683","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","Ba (Ce0.7 Y0.3) O2.85","","- Ba Ce0.7 O2.85 Y0.3 -","- Ba Ce0.7 O2.85 Y0.3 -","- Ba6 Ce4.2 O17.1 Y1.8 -","6","0.166667","","Takeuchi, K.; Loong, C.-K.; Balachandran, U.; Richardson, J.W.jr.; Guan, J.; Dorris, S.E.","The crystal structures and phase transitions in Y-doped Ba Ce O3: their dependence on Y concentration and hydrogen doping","Solid State Ionics","2000","138","","63","77","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526756","6.765","","6.765","","4.226","","90","","90","","90","","193.404","","","","","","","","","","","","","3","P 4/m b m","-P 4 2ab","127","","Yb2 Al Si2","","- Al Si2 Yb2 -","- Al Si2 Yb2 -","- Al2 Si4 Yb4 -","2","0.125","","Kranenberg, C.; Mewis, A.","Darstellung und Kristallstrukturen von Ln2 Al3 Si2 und Ln2 Al Si2 (Ln : Y, Tb - Lu)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","1448","1453","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526757","6.211","","6.211","","15.196","","90","","90","","120","","507.672","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","Ba (Ce0.8 Y0.2) O2.9","","- Ba Ce0.8 O2.9 Y0.2 -","- Ba Ce0.8 O2.901 Y0.2 -","- Ba6 Ce4.8 O17.406 Y1.2 -","6","0.166667","","Takeuchi, K.; Loong, C.-K.; Balachandran, U.; Guan, J.; Dorris, S.E.; Richardson, J.W.jr.","The crystal structures and phase transitions in Y-doped Ba Ce O3: their dependence on Y concentration and hydrogen doping","Solid State Ionics","2000","138","","63","77","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526758","8.2963","","12.7646","","10.1156","","90","","90","","90","","1071.23","","","","","","","","","","","","","4","C m c m","-C 2c 2","63","","K Cu Zr F7","","- Cu F7 K Zr -","- Cu F7 K Zr -","- Cu8 F56 K8 Zr8 -","8","0.5","","Kraus, M.; Mueller, B.G.","K Cu M(IV) F7 (M(IV) = Zr(4+), Hf(4+)), ein neuer Strukturtyp","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","1929","1933","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526759","6.231","","8.76","","6.214","","90","","90.58","","90","","339.165","","","","","","","","","","","","","4","I 1 2/m 1","-I 2y","12","","Ba (Ce0.85 Y0.15) O2.925","","- Ba Ce0.85 O2.925 Y0.15 -","- Ba Ce0.85 O2.924 Y0.15 -","- Ba4 Ce3.4 O11.696 Y0.6 -","4","0.5","","Takeuchi, K.; Loong, C.-K.; Richardson, J.W.jr.; Guan, J.; Dorris, S.E.; Balachandran, U.","The crystal structures and phase transitions in Y-doped Ba Ce O3: their dependence on Y concentration and hydrogen doping","Solid State Ionics","2000","138","","63","77","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526760","8.2894","","12.7742","","10.0999","","90","","90","","90","","1069.48","","","","","","","","","","","","","4","C m c m","-C 2c 2","63","","K Cu Hf F7","","- Cu F7 Hf K -","- Cu F7 Hf K -","- Cu8 F56 Hf8 K8 -","8","0.5","","Kraus, M.; Mueller, B.G.","K Cu M(IV) F7 (M(IV) = Zr(4+), Hf(4+)), ein neuer Strukturtyp","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","1929","1933","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526761","6.242","","8.731","","6.23","","90","","91.15","","90","","339.46","","","","","","","","","","","","","4","I 1 2/m 1","-I 2y","12","","Ba (Ce0.8 Y0.2) O2.9","","- Ba Ce0.8 O2.9 Y0.2 -","- Ba Ce0.8 O2.9 Y0.2 -","- Ba4 Ce3.2 O11.6 Y0.8 -","4","0.5","","Takeuchi, K.; Dorris, S.E.; Loong, C.-K.; Guan, J.; Richardson, J.W.jr.; Balachandran, U.","The crystal structures and phase transitions in Y-doped Ba Ce O3: their dependence on Y concentration and hydrogen doping","Solid State Ionics","2000","138","","63","77","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526762","12.1368","","12.1368","","12.1368","","90","","90","","90","","1787.77","","","","","","","","","","","","","4","P n -3 m :2","-P 4bc 2bc 3","224","","H3 P W12 O40 (H2 O)6.12","","- H15.24 O46.12 P W12 -","- O46.12 P W12 -","- O92.24 P2 W24 -","2","0.0416667","","Kremenovic, A.; Spasojevic-de Bire, A.; Sciau, P.; Dimitrijevic, R.; Mioc, U.B.; Colomban, P.","Keggin's ion structural modification and expansion of dodecatungstophosphoric acid hexahydrate induced by temperature treatment : in situ X-ray powder diffraction and Raman investigations","Solid State Ionics","2000","132","","39","53","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526763","6.239","","8.726","","6.235","","90","","91.24","","90","","339.363","","","","","","","","","","","","","4","I 1 2/m 1","-I 2y","12","","Ba (Ce0.75 Y0.25) O2.875","","- Ba Ce0.75 O2.875 Y0.25 -","- Ba Ce0.75 O2.874 Y0.25 -","- Ba4 Ce3 O11.496 Y -","4","0.5","","Takeuchi, K.; Loong, C.-K.; Balachandran, U.; Guan, J.; Dorris, S.E.; Richardson, J.W.jr.","The crystal structures and phase transitions in Y-doped Ba Ce O3: their dependence on Y concentration and hydrogen doping","Solid State Ionics","2000","138","","63","77","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526764","12.1555","","12.1555","","12.1555","","90","","90","","90","","1796.05","","","","","","","","","","","","","4","P n -3 m :2","-P 4bc 2bc 3","224","","H3 P W12 O40 (H2 O)6","","- H15 O46 P W12 -","- O46 P W12 -","- O92 P2 W24 -","2","0.0416667","","Kremenovic, A.; Spasojevic-de Bire, A.; Colomban, P.; Sciau, P.; Dimitrijevic, R.; Mioc, U.B.","Keggin's ion structural modification and expansion of dodecatungstophosphoric acid hexahydrate induced by temperature treatment : in situ X-ray powder diffraction and Raman investigations","Solid State Ionics","2000","132","","39","53","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526765","6.207","","6.207","","15.163","","90","","90","","120","","505.917","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","Ba (Ce0.75 Y0.25) O2.875","","- Ba Ce0.75 O2.875 Y0.25 -","- Ba Ce0.75 O2.874 Y0.25 -","- Ba6 Ce4.5 O17.244 Y1.5 -","6","0.166667","","Takeuchi, K.; Richardson, J.W.jr.; Loong, C.-K.; Guan, J.; Dorris, S.E.; Balachandran, U.","The crystal structures and phase transitions in Y-doped Ba Ce O3: their dependence on Y concentration and hydrogen doping","Solid State Ionics","2000","138","","63","77","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526766","5.84","","5.84","","14.308","","90","","90","","120","","422.606","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","Rb Ni F3","","- F3 Ni Rb -","- F3 Ni Rb -","- F18 Ni6 Rb6 -","6","0.25","","Krezhov, K.; Konstantinov, P.","Neutron diffraction investigation of Rb Ni F3","Materials Science Forum","2000","321","","938","941","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526768","6.243","","8.725","","6.243","","90","","91.54","","90","","339.934","","","","","","","","","","","","","4","I 1 2/m 1","-I 2y","12","","Ba (Ce0.7 Y0.3) O2.85","","- Ba Ce0.7 O2.85 Y0.3 -","- Ba Ce0.7 O2.85 Y0.3 -","- Ba4 Ce2.8 O11.4 Y1.2 -","4","0.5","","Takeuchi, K.; Balachandran, U.; Loong, C.-K.; Richardson, J.W.jr.; Guan, J.; Dorris, S.E.","The crystal structures and phase transitions in Y-doped Ba Ce O3: their dependence on Y concentration and hydrogen doping","Solid State Ionics","2000","138","","63","77","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526773","3.8652","","3.8652","","20.177","","90","","90","","90","","301.44","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","(La1.3 Sr1.7) (Mn2 O7)","","- La1.3 Mn2 O7 Sr1.7 -","- La1.299 Mn2 O7 Sr1.701 -","- La2.598 Mn4 O14 Sr3.402 -","2","0.0625","","Kubota, M.; Fujioka, H.; Hirota, K.; Ohoyama, K.; Moritomo, Y.; Yoshizawa, H.; Endoh, Y.","Relation between crystal and magnetic structures of layered manganite La2-2x Sr1+2x Mn2 O7 (0.30 < x < 0.50)","Journal of the Physical Society of Japan","2000","69","","1606","1609","","","","","","","","","","","","","","","","","","","","","","has coordinates","148016","2020-10-21","18:00:00",""
"1526774","9.118","","9.118","","9.118","","90","","90","","90","","758.052","","","","","","","","","","","","","4","I m -3","-I 2 2 3","204","","Ba0.61 (Fe1.6 Co2.4) Sb12","","- Ba0.61 Co2.4 Fe1.6 Sb12 -","- Ba0.61 Co2.4 Fe1.6 Sb12 -","- Ba1.22 Co4.8 Fe3.2 Sb24 -","2","0.0416667","","Tang, X.-F.; Hirai, T.; Chen, Li.-D.; Goto, T.; Yuan, R.-Z.","Solid state reaction synthesis and structure of filled skutterudite compounds Bay Fex Co4-x Sb12","Wu Li Hsueh Pao (= Acta Physica Sinica)","2000","49","","2196","2200","","","","","","","","","","","","","","","","","","","","","","has coordinates","148017","2020-10-21","18:00:00",""
"1526775","3.8729","","3.8729","","20.056","","90","","90","","90","","300.827","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","(La1.1 Sr1.9) (Mn2 O7)","","- La1.1 Mn2 O7 Sr1.9 -","- La1.101 Mn2 O7 Sr1.899 -","- La2.202 Mn4 O14 Sr3.798 -","2","0.0625","","Kubota, M.; Ohoyama, K.; Fujioka, H.; Hirota, K.; Moritomo, Y.; Endoh, Y.; Yoshizawa, H.","Relation between crystal and magnetic structures of layered manganite La2-2x Sr1+2x Mn2 O7 (0.30 < x < 0.50)","Journal of the Physical Society of Japan","2000","69","","1606","1609","","","","","","","","","","","","","","","","","","","","","","has coordinates","148018","2020-10-21","18:00:00",""
"1526776","3.8556","","3.8556","","20.239","","90","","90","","90","","300.866","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","(La1.4 Sr1.6) (Mn2 O7)","","- La1.4 Mn2 O7 Sr1.6 -","- La1.401 Mn2 O7 Sr1.599 -","- La2.802 Mn4 O14 Sr3.198 -","2","0.0625","","Kubota, M.; Yoshizawa, H.; Fujioka, H.; Moritomo, Y.; Ohoyama, K.; Hirota, K.; Endoh, Y.","Relation between crystal and magnetic structures of layered manganite La2-2x Sr1+2x Mn2 O7 (0.30 < x < 0.50)","Journal of the Physical Society of Japan","2000","69","","1606","1609","","","","","","","","","","","","","","","","","","","","","","has coordinates","148020","2020-10-21","18:00:00",""
"1526777","5.5671","","5.5671","","22.4603","","90","","90","","120","","602.843","","","","","","","","","","","","","4","P -3 c 1","-P 3 2""c","165","","Ba La4 (Ti4 O15)","","- Ba La4 O15 Ti4 -","- Ba La4 O15 Ti4 -","- Ba2 La8 O30 Ti8 -","2","0.166667","","Teneze, N.; Trolliard, G.; Mercurio, D.; Frit, B.","Cation-deficient perovskite-related compounds (Ba, La)n Tin-1 O3n (n=4,5 and 6): a Rietveld refinement from neutron powder diffraction data","Materials Research Bulletin","2000","35","","1603","1614","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526778","3.8645","","3.8645","","20.065","","90","","90","","90","","299.658","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","(La1.2 Sr1.8) (Mn2 O7)","","- La1.2 Mn2 O7 Sr1.8 -","- La1.2 Mn2 O7 Sr1.8 -","- La2.4 Mn4 O14 Sr3.6 -","2","0.0625","","Kubota, M.; Fujioka, H.; Hirota, K.; Ohoyama, K.; Moritomo, Y.; Endoh, Y.; Yoshizawa, H.","Relation between crystal and magnetic structures of layered manganite La2-2x Sr1+2x Mn2 O7 (0.30 < x < 0.50)","Journal of the Physical Society of Japan","2000","69","","1606","1609","","","","","","","","","","","","","","","","","","","","","","has coordinates","148023","2020-10-21","18:00:00",""
"1526779","5.5809","","5.5809","","41.05579","","90","","90","","120","","1107.42","","","","","","","","","","","","","4","R -3 :H","-R 3","148","","Ba2 La4 (Ti5 O18)","","- Ba2 La4 O18 Ti5 -","- Ba2 La4 O18 Ti5 -","- Ba6 La12 O54 Ti15 -","3","0.166667","","Teneze, N.; Mercurio, D.; Frit, B.; Trolliard, G.","Cation-deficient perovskite-related compounds (Ba, La)n Tin-1 O3n (n=4,5 and 6): a Rietveld refinement from neutron powder diffraction data","Materials Research Bulletin","2000","35","","1603","1614","","","","","","","","","","","","","","","","","","","","","","has coordinates","148024","2020-10-21","18:00:00",""
"1526780","3.8782","","3.8782","","19.952","","90","","90","","90","","300.087","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","(La1.04 Sr1.96) (Mn2 O7)","","- La1.04 Mn2 O7 Sr1.96 -","- La1.041 Mn2 O7 Sr1.959 -","- La2.082 Mn4 O14 Sr3.918 -","2","0.0625","","Kubota, M.; Fujioka, H.; Hirota, K.; Endoh, Y.; Ohoyama, K.; Moritomo, Y.; Yoshizawa, H.","Relation between crystal and magnetic structures of layered manganite La2-2x Sr1+2x Mn2 O7 (0.30 < x < 0.50)","Journal of the Physical Society of Japan","2000","69","","1606","1609","","","","","","","","","","","","","","","","","","","","","","has coordinates","148025","2020-10-21","18:00:00",""
"1526781","5.661","","7.83","","5.551","","90","","90","","90","","246.052","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","La0.98 (Mn0.88 V0.1) O3","","- La0.98 Mn0.88 O3 V0.1 -","- La0.98 Mn0.882 O3 V0.098 -","- La3.92 Mn3.528 O12 V0.392 -","4","0.5","","Teplykh, A.E.; Pirogov, A.N.; Men'shikov, A.Z.; Bazuev, G.V.","Crystal structure and magnetic state of the La Mn1-x Vx O3 perovskites","Physics of the Solid State","2000","42","","2241","2249","","","","","","","","","","","","","","","","","","","","","","has coordinates","148026","2020-10-21","18:00:00",""
"1526782","3.8731","","3.8731","","19.918","","90","","90","","90","","298.788","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","(La Sr2) (Mn2 O7)","","- La Mn2 O7 Sr2 -","- La0.999 Mn2 O7 Sr2.001 -","- La1.998 Mn4 O14 Sr4.002 -","2","0.0625","","Kubota, M.; Yoshizawa, H.; Fujioka, H.; Ohoyama, K.; Moritomo, Y.; Hirota, K.; Endoh, Y.","Relation between crystal and magnetic structures of layered manganite La2-2x Sr1+2x Mn2 O7 (0.30 < x < 0.50)","Journal of the Physical Society of Japan","2000","69","","1606","1609","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526783","5.642","","7.859","","5.548","","90","","90","","90","","246.001","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","La0.99 (Mn0.79 V0.2) O3","","- La0.99 Mn0.79 O3 V0.2 -","- La0.99 Mn0.792 O3 V0.198 -","- La3.96 Mn3.168 O12 V0.792 -","4","0.5","","Teplykh, A.E.; Pirogov, A.N.; Men'shikov, A.Z.; Bazuev, G.V.","Crystal structure and magnetic state of the La Mn1-x Vx O3 perovskites","Physics of the Solid State","2000","42","","2241","2249","","","","","","","","","","","","","","","","","","","","","","has coordinates","148028","2020-10-21","18:00:00",""
"1526785","5.62","","7.87","","5.559","","90","","90","","90","","245.871","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","La0.98 (Mn0.686 V0.294) O3","","- La0.98 Mn0.686 O3 V0.294 -","- La0.98 Mn0.686 O3 V0.294 -","- La3.92 Mn2.744 O12 V1.176 -","4","0.5","","Teplykh, A.E.; Pirogov, A.N.; Men'shikov, A.Z.; Bazuev, G.V.","Crystal structure and magnetic state of the La Mn1-x Vx O3 perovskites","Physics of the Solid State","2000","42","","2241","2249","","","","","","","","","","","","","","","","","","","","","","has coordinates","148030","2020-10-21","18:00:00",""
"1526786","5.1612","","5.1612","","14.028","","90","","90","","120","","323.614","","","","","","","","","","","","","3","P -3 c 1","-P 3 2""c","165","","","","- Mg4 Nb2 O9 -","- Mg4 Nb2 O9 -","- Mg8 Nb4 O18 -","2","0.166667","","Kumada, N.; Taki, K.; Kinomura, N.","Single crystal structure refinement of a magnesium niobium oxide: Mg4 Nb2 O9","Materials Research Bulletin","2000","35","","1017","1021","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1526787","5.611","","7.877","","5.562","","90","","90","","90","","245.828","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","La (Mn0.5 V0.5) O3","","- La Mn0.5 O3 V0.5 -","- La Mn0.5 O3 V0.5 -","- La4 Mn2 O12 V2 -","4","0.5","","Teplykh, A.E.; Pirogov, A.N.; Men'shikov, A.Z.; Bazuev, G.V.","Crystal structure and magnetic state of the La Mn1-x Vx O3 perovskites","Physics of the Solid State","2000","42","","2241","2249","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526788","5.5672","","5.5672","","15.989","","90","","90","","120","","429.166","","","","","","","","","","","","","3","R -3 :H","-R 3","148","","Na (Bi O3)","","- Bi Na O3 -","- Bi Na O3 -","- Bi6 Na6 O18 -","6","0.333333","","Kumada, N.; Kinomura, N.; Sleight, A.W.","Neutron powder diffraction refinement of ilmenite-type bismuth oxides: A Bi O3 (A = Na, Ag)","Materials Research Bulletin","2000","35","","2397","2402","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526789","5.589","","7.863","","5.559","","90","","90","","90","","244.298","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","La0.99 (Mn0.297 V0.693) O3","","- La0.99 Mn0.297 O3 V0.693 -","- La0.99 Mn0.297 O3 V0.693 -","- La3.96 Mn1.188 O12 V2.772 -","4","0.5","","Teplykh, A.E.; Pirogov, A.N.; Men'shikov, A.Z.; Bazuev, G.V.","Crystal structure and magnetic state of the La Mn1-x Vx O3 perovskites","Physics of the Solid State","2000","42","","2241","2249","","","","","","","","","","","","","","","","","","","","","","has coordinates","148034","2020-10-21","18:00:00",""
"1526790","5.577","","7.857","","5.556","","90","","90","","90","","243.456","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","La0.99 (Mn0.2 V0.79) O3","","- La0.99 Mn0.2 O3 V0.79 -","- La0.99 Mn0.198 O3 V0.792 -","- La3.96 Mn0.792 O12 V3.168 -","4","0.5","","Teplykh, A.E.; Pirogov, A.N.; Men'shikov, A.Z.; Bazuev, G.V.","Crystal structure and magnetic state of the La Mn1-x Vx O3 perovskites","Physics of the Solid State","2000","42","","2241","2249","","","","","","","","","","","","","","","","","","","","","","has coordinates","148036","2020-10-21","18:00:00",""
"1526791","5.56","","7.853","","5.553","","90","","90","","90","","242.459","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","La0.99 (Mn0.1 V0.89) O3","","- La0.99 Mn0.1 O3 V0.89 -","- La0.99 Mn0.099 O3 V0.891 -","- La3.96 Mn0.396 O12 V3.564 -","4","0.5","","Teplykh, A.E.; Pirogov, A.N.; Men'shikov, A.Z.; Bazuev, G.V.","Crystal structure and magnetic state of the La Mn1-x Vx O3 perovskites","Physics of the Solid State","2000","42","","2241","2249","","","","","","","","","","","","","","","","","","","","","","has coordinates","148038","2020-10-21","18:00:00",""
"1526797","3.4146","","3.4146","","5.8552","","90","","90","","120","","59.122","","","","","","","","","","","","","3","P -3 m 1","-P 3 2""","164","","Cu0.375 Ti S2","","- Cu0.375 S2 Ti -","- Cu0.3752 S2 Ti -","- Cu0.3752 S2 Ti -","1","0.0833333","","Kusawake, T.; Takahashi, Y.; Ohshima, K.I.","Structural analysis of the layered compounds Cux Ti S2","Molecular Crystals and Liquid Crystals","2000","341","","93","98","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526798","5.6082","","7.9642","","5.6084","","90","","90","","90","","250.498","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Sr2 Fe Nb O6","","- Fe Nb O6 Sr2 -","- Fe Nb O6 Sr2 -","- Fe2 Nb2 O12 Sr4 -","2","0.25","","Tezuka, K.; Henmi, K.; Hinatsu, Y.; Masaki, N.M.","Magnetic susceptibilities and Mossbauer spectra of perovskites A2 Fe Nb O6 (A= Sr, Ba)","Journal of Solid State Chemistry","2000","154","","591","597","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526800","8.1181","","8.1181","","8.1181","","90","","90","","90","","535.012","","","","","","","","","","","","","4","F m -3 m","-F 4 2 3","225","","","","- Ba2 Fe Nb O6 -","- Ba2 Fe Nb O6 -","- Ba8 Fe4 Nb4 O24 -","4","0.0208333","","Tezuka, K.; Henmi, K.; Masaki, N.M.; Hinatsu, Y.","Magnetic susceptibilities and Mossbauer spectra of perovskites A2 Fe Nb O6 (A = Sr, Ba)","Journal of Solid State Chemistry","2000","154","","591","597","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1526813","11.2812","","11.2812","","11.2812","","90","","90","","90","","1435.71","","","","","","","","","","","","","3","F m -3","-F 2 2 3","202","","Cs2 (B12 H12)","","- B12 Cs2 H12 -","- B12 Cs2 H12 -","- B48 Cs8 H48 -","4","0.0416667","","Tiritiris, I.; Schleid, T.; Mueller, K.; Preetz, W.","Strukturelle Untersuchungen an Cs2 (B12 H12)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","323","325","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526815","9.7051","","9.7051","","7.2546","","90","","90","","120","","591.758","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","La10 (Si6 O22 N2) O2","","- La10 N2 O24 Si6 -","- La10 N2.0004 O23.9996 Si6 -","- La10 N2.0004 O23.9996 Si6 -","1","0.0833333","","Titeux, S.; Gervais, M.; Verdier, P.; Laurent, Y.","Synthesis and X-ray diffraction study of substituted La10 (Si6 O22 N2) O2 silicon apatites","Materials Science Forum","2000","325","","17","20","","","","","","","","","","","","","","","","","","","","","","has coordinates","148064","2020-10-21","18:00:00",""
"1526817","9.7191","","9.7191","","7.2073","","90","","90","","120","","589.597","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","La9 Ti (Si6 O21 N3) O2","","- La9 N3 O23 Si6 Ti -","- La9 N3 O23 Si6 Ti -","- La9 N3 O23 Si6 Ti -","1","0.0833333","","Titeux, S.; Gervais, M.; Verdier, P.; Laurent, Y.","Synthesis and X-ray diffraction study of substituted La10 (Si6 O22 N2) O2 silicon apatites","Materials Science Forum","2000","325","","17","20","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526830","13.453","","3.9812","","6.2908","","90","","90","","90","","336.929","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Cu Y S2","","- Cu S2 Y -","- Cu S2 Y -","- Cu4 S8 Y4 -","4","0.5","","Lauxmann, P.; Schleid, T.","Cu Y S2 : ein ternaeres Kupfer(I) - Yttrium(III) - Sulfid mit Ketten (1 infty)((Cu (S1)3/3 (S2)1/1)(3-)) cis-kantenverknuepfter (Cu S4)(7-) - Tetraeder","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","1608","1612","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526831","3.9419","","3.9419","","8.4398","","90","","90","","90","","131.142","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","Cu Pr O S","","- Cu O Pr S -","- Cu O Pr S -","- Cu2 O2 Pr2 S2 -","2","0.125","","Lauxmann, P.; Schleid, T.","Cu Pr O S : kein einpraegsames Akronym, vielmehr ein echtes quaternaeres Chalkogenid mit aufgefuellter Pb F Cl Struktur","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","2253","2255","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526832","5.1162","","11.1352","","5.3946","","90","","94.616","","90","","306.333","","","","","","","","","","","","","3","I 1 2/a 1","-I 2ya","15","","","","- Eu0.6 Nb O3.4 -","- Eu0.6 Nb O3.4 -","- Eu2.4 Nb4 O13.6 -","4","0.5","","Toda, K.; Honda, M.; Ishimoto, Y.; Ye, Z.-G.; Sato, M.","Oxygen defect in non-stoichiometric europium orthoniobate, Eux Nb O4-1.5(1-x)","Solid State Ionics","2000","136","","25","30","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1526833","5.1162","","11.1347","","5.3965","","90","","94.603","","90","","306.433","","","","","","","","","","","","","3","I 1 2/a 1","-I 2ya","15","","","","- Eu0.5 Nb O3.25 -","- Eu0.5 Nb O3.25 -","- Eu2 Nb4 O13 -","4","0.5","","Toda, K.; Honda, M.; Ishimoto, Y.; Sato, M.; Ye, Z.-G.","Oxygen defect in non-stoichiometric europium orthoniobate, Eux Nb O4-1.5(1-x)","Solid State Ionics","2000","136","","25","30","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1526834","5.2886","","12.3391","","13.0321","","90","","90","","90","","850.43","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","W2 O3 (P2 O7)","","- O10 P2 W2 -","- O10 P2 W2 -","- O40 P8 W8 -","4","0.5","","Leclaire, A.; Chardon, J.; Raveau, B.","Stabilization of a W(V) diphosphate, W2 O3 . P2 O7, with an empty tunnel structure","Journal of Solid State Chemistry","2000","155","","112","115","","","","","","","","","","","","","","","","","","","","","","has coordinates","148085","2020-10-21","18:00:00",""
"1526835","5.1178","","11.1384","","5.398","","90","","94.614","","90","","306.711","","","","","","","","","","","","","3","I 1 2/a 1","-I 2ya","15","","","","- Eu0.45 Nb O3.175 -","- Eu0.45 Nb O3.1748 -","- Eu1.8 Nb4 O12.6992 -","4","0.5","","Toda, K.; Sato, M.; Honda, M.; Ishimoto, Y.; Ye, Z.-G.","Oxygen defect in non-stoichiometric europium orthoniobate, Eux Nb O4-1.5(1-x)","Solid State Ionics","2000","136","","25","30","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1526840","14.3419","","15.5528","","3.9948","","90","","90","","90","","891.067","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Nd7 V O4 Se8","","- Nd7 O4 Se8 V -","- Nd7 O4 Se8 V -","- Nd14 O8 Se16 V2 -","2","0.25","","Tougait, O.; Ibers, J.A.","Synthesis and characterization of the rare-earth vanadium oxyselenides Ln7 V O4 Se8 (Ln = Nd, Sm, Gd)","Journal of Solid State Chemistry","2000","154","","564","568","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526841","5.487","","5.507","","30.33","","90","","90","","90","","916.479","","","","","","","","","","","","","5","A m a a","-A 2a 2","66","","Bi2 Sr2 Pr Cu2 O8.5","","- Bi2 Cu2 O8.5 Pr Sr2 -","- Bi2 Cu2 O8.5 Pr Sr2 -","- Bi8 Cu8 O34 Pr4 Sr8 -","4","0.25","","Lee, T.-J.; Huang, C.F.; Yeh, K.W.; Teo, C.C.; Khor, T.S.; Ku, H.C.; Sakabe, K.; Huang, Y.; Hung, H.H.; Sakabe, N.","X-ray structure analysis of Bi2212 using synchrotron source and high dynamic range imaging plate detector","Chinese Journal of Physics (Taipei)","2000","38","","243","261","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526842","14.2","","15.451","","3.9511","","90","","90","","90","","866.888","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Sm7 V O4 Se8","","- O4 Se8 Sm7 V -","- O4 Se8 Sm7 V -","- O8 Se16 Sm14 V2 -","2","0.25","","Tougait, O.; Ibers, J.A.","Synthesis and characterization of the rare-earth vanadium oxyselenides Ln7 V O4 Se8 (Ln = Nd, Sm, Gd)","Journal of Solid State Chemistry","2000","154","","564","568","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526844","13.639","","13.639","","6.545","","90","","90","","90","","1217.52","","","","","","","","","","","","","4","I -4 2 d","I -4 2bw","122","","K7.98 (Ga7.98 Si12.02 O40) (H2 O)6.32","","- Ga7.98 K7.48 O46.32 Si12.02 -","- Ga7.98 K7.48 O46.32 Si12.02 -","- Ga7.98 K7.48 O46.32 Si12.02 -","1","0.0625","","Lee, Y.-J.; Kim, S.-J.; Parise, J.B.","Synthesis and crystal structures of gallium- and germanium variants of the fibrous zeolites with the NAT, EDI and THO structure types","Microporous and Mesoporous Materials","2000","34","","255","271","","","","","","","","","","","","","","","","","","","","","","has coordinates","148096","2020-10-21","18:00:00",""
"1526845","10.61","","8.3","","5.097","","90","","90","","90","","448.857","","","","","","","","","","","","","5","P n a 21","P 2c -2n","33","","Li (Al Ge O4) (H2 O)","","- Al Ge H2 Li O5 -","- Al Ge Li O5 -","- Al4 Ge4 Li4 O20 -","4","1","","Tripathi, A.; Parise, J.B.; Kim, S.-J.; Johnson, G.M.","Synthesis and single-crystal structure of a lithium aluminogermanate with the zeolite ABW topology","Microporous and Mesoporous Materials","2000","34","","273","279","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526846","9.773","","9.773","","13.141","","90","","90","","90","","1255.12","","","","","","","","","","","","","6","P -4 21 c","P -4 2n","114","","Rb6.98 Na1.11 (Ga7.99 Si12.01 O40) (H2 O)3.32","","- Ga7.99 H6.64 Na1.11 O43.32 Rb6.98 Si12.01 -","- Ga7.99 Na1.112 O43.32 Rb6.984 Si12.01 -","- Ga7.99 Na1.112 O43.32 Rb6.984 Si12.01 -","1","0.125","","Lee, Y.-J.; Kim, S.-J.; Parise, J.B.","Synthesis and crystal structures of gallium- and germanium-variantsof the fibrous zeolites with the NAT, EDI and THOstructure types","Microporous and Mesoporous Materials","2000","34","","255","271","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526847","14.335","","14.198","","13.421","","90","","90","","90","","2731.55","","","","","","","","","","","","","5","P n 2 n","P -2n -2n","34","","Rb20 (Ga20 Ge20 O80) (H2 O)14.86","","- Ga20 Ge20 H29.72 O94.86 Rb20 -","- Ga20 Ge20 O94.86 Rb20 -","- Ga20 Ge20 O94.86 Rb20 -","1","0.25","","Lee, Y.-J.; Parise, J.B.; Kim, S.-J.","Synthesis and crystal structures of gallium- and germanium variants of the fibrous zeolites with the NAT, EDI and THO structure types","Microporous and Mesoporous Materials","2000","34","","255","271","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526848","5.285","","9.807","","5.227","","90","","90","","90","","270.915","","","","","","","","","","","","","2","I b a m","-I 2 2c","72","","","","- Be Cl2 -","- Be Cl2 -","- Be4 Cl8 -","4","0.25","","Troyanov, S.I.","Crystal modifications of beryllium dihalides Be Cl2, Be Br2 and Be I2","Zhurnal Neorganicheskoi Khimii","2000","45","","1619","1624","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1526849","12.968","","12.968","","5.132","","90","","90","","120","","747.418","","","","","","","","","","","","","6","P 63","P 6c","173","","Na6 Cs2 (Al6 Ge6 O24) (Ge (O H)6)","","- Al6 Cs2 Ge7 H6 Na6 O30 -","- Al6 Cs2 Ge7 Na6 O30 -","- Al6 Cs2 Ge7 Na6 O30 -","1","0.166667","","Lee, Y.-J.; Parise, J.B.; Tripathi, A.; Kim, S.-J.; Vogt, T.","Synthesis and crystal structures of gallium and germanium variants of cancrinite","Microporous and Mesoporous Materials","2000","39","","445","455","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526850","5.569","","10.405","","5.543","","90","","90","","90","","321.192","","","","","","","","","","","","","2","I b a m","-I 2 2c","72","","","","- Be Br2 -","- Be Br2 -","- Be4 Br8 -","4","0.25","","Troyanov, S.I.","Crystal modifications of beryllium dihalides Be Cl2, Be Br2 and Be I2","Zhurnal Neorganicheskoi Khimii","2000","45","","1619","1624","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1526851","12.95","","12.95","","5.117","","90","","90","","120","","743.166","","","","","","","","","","","","","6","P 63 m c","P 6c -2c","186","","Na6 Cs2 (Ga6 Ge6 O24) (Ge (O H)6)","","- Cs2 Ga6 Ge7 H6 Na6 O30 -","- Cs2 Ga6 Ge7 Na6 O30 -","- Cs2 Ga6 Ge7 Na6 O30 -","1","0.0833333","","Lee, Y.-J.; Parise, J.B.; Vogt, T.; Kim, S.-J.; Tripathi, A.","Synthesis and crystal structures of gallium and germanium variants of cancrinite","Microporous and Mesoporous Materials","2000","39","","445","455","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526852","6.025","","11.316","","6.035","","90","","90","","90","","411.46","","","","","","","","","","","","","2","I b a m","-I 2 2c","72","","","","- Be I2 -","- Be I2 -","- Be4 I8 -","4","0.25","","Troyanov, S.I.","Crystal modifications of beryllium dihalides Be Cl2, Be Br2 and Be I2","Zhurnal Neorganicheskoi Khimii","2000","45","","1619","1624","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1526853","24.996","","24.996","","24.996","","90","","90","","90","","15617.5","","","","","","","","","","","","","5","F d -3 :2","-F 2uv 2vw 3","203","","Ag92 (Al92 Si100 O384) (H2 O)48","","- Ag92 Al92 H96 O432 Si100 -","- Ag91.9936 Al91.9968 O432 Si100.003 -","- Ag91.9936 Al91.9968 O432 Si100.003 -","1","0.0104167","","Lee, S.H.; Kim, Y.; Seff, K.","Weak Ag(+)-Ag(+) bonding in zeolite X. Crystal structures of Ag92 Si100 Al92 O384 hydrated and fully dehydrated in flowing oxygen","Microporous and Mesoporous Materials","2000","41","","49","59","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526854","10.595","","10.595","","18.036","","90","","90","","90","","2024.61","","","","","","","","","","","","","2","I 41/a c d :2","-I 4bd 2c","142","","","","- Be Cl2 -","- Be Cl2 -","- Be32 Cl64 -","32","1","","Troyanov, S.I.","Crystal modifications of beryllium dihalides Be Cl2, Be Br2 and Be I2","Zhurnal Neorganicheskoi Khimii","2000","45","","1619","1624","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1526855","12.19","","12.19","","21.325","","90","","90","","90","","3168.81","","","","","","","","","","","","","2","I 41/a c d :2","-I 4bd 2c","142","","","","- Be I2 -","- Be I2 -","- Be32 I64 -","32","1","","Troyanov, S.I.","Crystal modifications of beryllium dihalides Be Cl2, Be Br2 and Be I2","Zhurnal Neorganicheskoi Khimii","2000","45","","1619","1624","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1526856","13.471","","23.91","","6.229","","90","","90","","90","","2006.31","","","","","","","","","","","","","3","F d d 2","F 2 -2d","43","","(N O)2 (Be (N O3)4)","","- Be N6 O14 -","- Be N6 O14 -","- Be8 N48 O112 -","8","0.5","","Troyanov, S.I.; Tikhomirov, G.A.; Morozov, I.V.; Znamenkov, K.O.","Crystal structure of beryllium nitrate complexes (N O)2 (Be (N O3)4) and Be O (N O3)6","Zhurnal Neorganicheskoi Khimii","2000","45","","1941","1948","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526857","13.638","","13.638","","6.475","","90","","90","","120","","1042.97","","","","","","","","","","","","","3","P 3","P 3","143","","Be4 O (N O3)6","","- Be4 N6 O19 -","- Be4 N6 O19 -","- Be12 N18 O57 -","3","1","","Troyanov, S.I.; Tikhomirov, G.A.; Znamenkov, K.O.; Morozov, I.V.","Crystal structure of beryllium nitrate complexes (N O)2 (Be (N O3)4) and Be O (N O3)6","Zhurnal Neorganicheskoi Khimii","2000","45","","1941","1948","","","","","","","","","","","","","","","","","","","","","","has coordinates","148112","2020-10-21","18:00:00",""
"1526858","18.46799","","31.97029","","16.67589","","90","","90","","90","","9845.9","","","","","","","","","","","","","3","C 1 m 1","C -2y","8","","Al (P O4)","","- Al O4 P -","- Al O4 P -","- Al72 O288 P72 -","72","18","","de Onate Martinez, J.; McCusker, L.B.; Baerlocher, C.","Characterization and structural analysis of differently prepared samples of dehydrated VPI-5","Microporous and Mesoporous Materials","2000","34","","99","113","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526859","18.52179","","32.12469","","8.40026","","90","","90","","90","","4998.21","","","","","","","","","","","","","3","C 1 m 1","C -2y","8","","Al (P O4)","","- Al O4 P -","- Al O4 P -","- Al36 O144 P36 -","36","9","","de Onate Martinez, J.; McCusker, L.B.; Baerlocher, C.","Characterization and structural analysis of differently prepared samples of dehydrated VPI-5","Microporous and Mesoporous Materials","2000","34","","99","113","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526863","10.6273","","10.6273","","10.6273","","90","","90","","90","","1200.24","","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Tl2 Nb2 O6.636","","- Nb2 O6.636 Tl2 -","- Nb2 O6.636 Tl2 -","- Nb16 O53.088 Tl16 -","8","0.0416667","","Uma, S.; Kodialam, S.; Yokochi, A.; Khosrovani, N.","Structure and properties of Tl2 Nb2 O6+x phases with the pyrochlore structure","Journal of Solid State Chemistry","2000","155","","225","228","","","","","","","","","","","","","","","","","","","","","","has coordinates","148119","2020-10-21","18:00:00",""
"1526864","10.6712","","10.6712","","10.6712","","90","","90","","90","","1215.18","","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Tl2 Nb2 O6.11","","- Nb2 O6.11 Tl2 -","- Nb2 O6.11 Tl2 -","- Nb16 O48.88 Tl16 -","8","0.0416667","","Uma, S.; Yokochi, A.; Kodialam, S.; Khosrovani, N.","Structure and properties of Tl2 Nb2 O6+x phases with the pyrochlore structure","Journal of Solid State Chemistry","2000","155","","225","228","","","","","","","","","","","","","","","","","","","","","","has coordinates","148120","2020-10-21","18:00:00",""
"1526869","5.52266","","5.49047","","7.7713","","90","","90","","90","","235.641","","","","","","","","","","","","","3","P b n m","-P 2c 2ab","62","","La (Ga O3)","","- Ga La O3 -","- Ga La O3 -","- Ga4 La4 O12 -","4","0.5","","Vasylechko, L.; Savytskii, D.; Matkovskii, A.; Berkowski, M.; Fink-Finowicki, J.","Crystal structure of La1-x Ndx Ga O3 single crystals (0 < x < 0.2)","Materials Research Bulletin","2000","35","","333","340","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526870","5.51092","","5.49041","","7.76891","","90","","90","","90","","235.066","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","(La0.88 Nd0.12) (Ga O3)","","- Ga La0.88 Nd0.12 O3 -","- Ga La0.88 Nd0.12 O3 -","- Ga4 La3.52 Nd0.48 O12 -","4","0.5","","Vasylechko, L.; Berkowski, M.; Matkovskii, A.; Savytskii, D.; Fink-Finowicki, J.","Crystal structure of La1-x Ndx Ga O3 single crystals (0 < x < 0.2)","Materials Research Bulletin","2000","35","","333","340","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526871","5.50279","","5.49054","","7.7663","","90","","90","","90","","234.645","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","(La0.8 Nd0.2) (Ga O3)","","- Ga La0.8 Nd0.2 O3 -","- Ga La0.8 Nd0.2 O3 -","- Ga4 La3.2 Nd0.8 O12 -","4","0.5","","Vasylechko, L.; Fink-Finowicki, J.; Berkowski, M.; Savytskii, D.; Matkovskii, A.","Crystal structure of La1-x Ndx Ga O3 single crystals (0 < x < 0.2)","Materials Research Bulletin","2000","35","","333","340","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526901","12.2855","","13.1792","","17.3794","","87.236","","76.388","","87.691","","2730.52","","","","","","","","","","","","","7","P -1","-P 1","2","","Tl4 (Se8 (Re (C N))6) (H2 O)1.5","","- C6 H3 N6 O1.5 Re6 Se8 Tl4 -","- C6 N6 O1.5 Re6 Se8 Tl4 -","- C24 N24 O6 Re24 Se32 Tl16 -","4","2","","Virovets, A.V.; Naumov, N.G.; Naumov, D.Yu.; Howard, J.A.K.; Fedorov, V.E.","Crystal structure of Tl4 (Re6 Se8 (C N)6) * 1.5(H2 O)","Zhurnal Strukturnoi Khimii (Issue-No. from 1981)","2000","41","","1085","1091","","","","","","","","","","","","","","","","","","","","","","has coordinates","148173","2020-10-21","18:00:00",""
"1526902","7.021","","8.393","","4.94","","90","","109.71","","90","","274.046","","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","Li Sc (P2 O7)","","- Li O7 P2 Sc -","- Li O7 P2 Sc -","- Li2 O14 P4 Sc2 -","2","1","","Vitins, G.; Kanepe, Z.; Vitins, A.; Dindune, A.; Ronis, J.; Lusis, A.","Structural and conductivity studies in Li Fe P2 O7, Li Sc P2 O7 and Na Sc P2 O7","Journal of Solid State Electrochemistry","2000","4","","146","152","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526906","3.8778","","3.8778","","11.6873","","90","","90","","90","","175.746","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","Y Ba2 Cu2.609 Co0.391 O7.23","","- Ba2 Co0.391 Cu2.609 O7.23 Y -","- Ba2 Co0.391 Cu2.609 O7.23 Y -","- Ba2 Co0.391 Cu2.609 O7.23 Y -","1","0.0625","","Voronin, V.I.; Leonidov, I.A.; Mitberg, E.; Goshchitskii, B.N.; Kozhevnikov, V.L.","Valence state of cobalt atoms and crystal structure of Y Ba2 Cu3-x Cox O6+d solid solution","Zhurnal Strukturnoi Khimii (Issue-No. from 1981)","2000","41","","626","631","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526907","3.8854","","3.8854","","11.6746","","90","","90","","90","","176.244","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","Y Ba2 Cu2.412 Co0.588 O7.26","","- Ba2 Co0.588 Cu2.412 O7.26 Y -","- Ba2 Co0.588 Cu2.412 O7.26 Y -","- Ba2 Co0.588 Cu2.412 O7.26 Y -","1","0.0625","","Voronin, V.I.; Mitberg, E.; Goshchitskii, B.N.; Kozhevnikov, V.L.; Leonidov, I.A.","Valence state of cobalt atoms and crystal structure of Y Ba2 Cu3-x Cox O6+d solid solution","Zhurnal Strukturnoi Khimii (Issue-No. from 1981)","2000","41","","626","631","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526917","11.414","","11.41","","15.586","","90","","100.6","","90","","1995.19","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","K (In Se2)","","- In K Se2 -","- In K Se2 -","- In16 K16 Se32 -","16","2","","Wang, P.; Huang, X.-Y.; Liu, Y.-L.; Guo, H.-Y.; Li, J.; Wei, Y.-G.","Solid state synthesis at intermediate temperature and structural characterization of K In Se2","Hua Hsueh Hsueh Pao","2000","58","","1005","1008","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526919","7.1931","","25.77","","15.9999","","90","","96.856","","90","","2944.63","","","","","","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","((C H3 N H3)0.5 (N H4)1.5) Sb8 S13 (H2 O)2.775","","- C0.5 H14.55 N2 O2.775 S13 Sb8 -","- C0.5 N2 O2.775 S13 Sb8 -","- C2 N8 O11.1 S52 Sb32 -","4","1","","Wang, X.-Q.; Liu, L.-M.; Jacobson, A.J.","Hydrothermal synthesis and crystal structures of ((C H3 N H3)0.5 (N H4)1.5) Sb8 S13 . 2.8(H2 O) and Rb2 Sb8 S13 . 3.3(H2 O)","Journal of Solid State Chemistry","2000","155","","409","416","","","","","","","","","","","","","","","","","","","","","","has coordinates","148198","2020-10-21","18:00:00",""
"1526920","7.1899","","25.76","","15.973","","90","","96.541","","90","","2939.13","","","","","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","Rb2 Sb8 S13 (H2 O)3.28","","- H6.56 O3.28 Rb2 S13 Sb8 -","- O3.28 Rb2 S13 Sb8 -","- O13.12 Rb8 S52 Sb32 -","4","1","","Wang, X.-Q.; Liu, L.-M.; Jacobson, A.J.","Hydrothermal synthesis and crystal structures of ((C H3 N H3)0.5 (N H4)1.5) Sb8 S13 . 2.8(H2 O) and Rb2 Sb8 S13 . 3.3(H2 O)","Journal of Solid State Chemistry","2000","155","","409","416","","","","","","","","","","","","","","","","","","","","","","has coordinates","148199","2020-10-21","18:00:00",""
"1526922","3.7932","","3.7932","","13.1147","","90","","90","","90","","188.699","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","(La1.85 Sr0.15) (Cu0.9 Zn0.1) O4","","- Cu0.9 La1.85 O4 Sr0.15 Zn0.1 -","- Cu0.9 La1.85 O4 Sr0.15 Zn0.1 -","- Cu1.8 La3.7 O8 Sr0.3 Zn0.2 -","2","0.0625","","Wang, F.Z.; Wu, X.S.; Jiang, S.S.","Microstructure of Zn, Ni, Mg doped La1.85 Sr0.15 Cu O4 in high doping level","Wu Li Hsueh Pao (= Acta Physica Sinica)","2000","49","","1541","1544","","","","","","","","","","","","","","","","","","","","","","has coordinates","148201","2020-10-21","18:00:00",""
"1526923","5.36369","","5.3932","","13.0635","","90","","90","","90","","377.894","","","","","","","","","","","","","5","B m a b","-B 2ab 2","64","","(La1.85 Sr0.15) (Cu0.7 Zn0.3) O4","","- Cu0.7 La1.85 O4 Sr0.15 Zn0.3 -","- Cu0.7 La1.85 O4 Sr0.15 Zn0.3 -","- Cu2.8 La7.4 O16 Sr0.6 Zn1.2 -","4","","","Wang, F.Z.; Wu, X.S.; Jiang, S.S.","Microstructure of Zn, Ni, Mg doped La1.85 Sr0.15 Cu O4 in high doping level","Wu Li Hsueh Pao (= Acta Physica Sinica)","2000","49","","1541","1544","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1526924","3.7701","","3.7701","","13.2003","","90","","90","","90","","187.624","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","(La1.85 Sr0.15) (Cu0.99 Ni0.01) O4","","- Cu0.99 La1.85 Ni0.01 O4 Sr0.15 -","- Cu0.99 La1.85 Ni0.01 O4 Sr0.15 -","- Cu1.98 La3.7 Ni0.02 O8 Sr0.3 -","2","0.0625","","Wang, F.Z.; Wu, X.S.; Jiang, S.S.","Microstructure of Zn, Ni, Mg doped La1.85 Sr0.15 Cu O4 in high doping level","Wu Li Hsueh Pao (= Acta Physica Sinica)","2000","49","","1541","1544","","","","","","","","","","","","","","","","","","","","","","has coordinates","148203","2020-10-21","18:00:00",""
"1526925","3.7823","","3.7823","","13.0848","","90","","90","","90","","187.188","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","(La1.85 Sr0.15) (Cu0.8 Ni0.2) O4","","- Cu0.8 La1.85 Ni0.2 O4 Sr0.15 -","- Cu0.8 La1.85 Ni0.2 O4 Sr0.15 -","- Cu1.6 La3.7 Ni0.4 O8 Sr0.3 -","2","0.0625","","Wang, F.Z.; Wu, X.S.; Jiang, S.S.","Microstructure of Zn, Ni, Mg doped La1.85 Sr0.15 Cu O4 in high doping level","Wu Li Hsueh Pao (= Acta Physica Sinica)","2000","49","","1541","1544","","","","","","","","","","","","","","","","","","","","","","has coordinates","148204","2020-10-21","18:00:00",""
"1526926","3.8025","","3.8025","","13.0655","","90","","90","","90","","188.914","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","(La1.85 Sr0.15) (Cu0.7 Ni0.3) O4","","- Cu0.7 La1.85 Ni0.3 O4 Sr0.15 -","- Cu0.7 La1.85 Ni0.3 O4 Sr0.15 -","- Cu1.4 La3.7 Ni0.6 O8 Sr0.3 -","2","0.0625","","Wang, F.Z.; Wu, X.S.; Jiang, S.S.","Microstructure of Zn, Ni, Mg doped La1.85 Sr0.15 Cu O4 in high doping level","Wu Li Hsueh Pao (= Acta Physica Sinica)","2000","49","","1541","1544","","","","","","","","","","","","","","","","","","","","","","has coordinates","148205","2020-10-21","18:00:00",""
"1526927","3.7789","","3.7789","","13.1599","","90","","90","","90","","187.924","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","(La1.85 Sr0.15) (Cu0.9 Mg0.1) O4","","- Cu0.9 La1.85 Mg0.1 O4 Sr0.15 -","- Cu0.9 La1.85 Mg0.1 O4 Sr0.15 -","- Cu1.8 La3.7 Mg0.2 O8 Sr0.3 -","2","0.0625","","Wang, F.Z.; Wu, X.S.; Jiang, S.S.","Microstructure of Zn, Ni, Mg doped La1.85 Sr0.15 Cu O4 in high doping level","Wu Li Hsueh Pao (= Acta Physica Sinica)","2000","49","","1541","1544","","","","","","","","","","","","","","","","","","","","","","has coordinates","148206","2020-10-21","18:00:00",""
"1526928","3.7861","","3.7861","","13.1926","","90","","90","","90","","189.11","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","(La1.85 Sr0.15) (Cu0.8 Mg0.2) O4","","- Cu0.8 La1.85 Mg0.2 O4 Sr0.15 -","- Cu0.8 La1.85 Mg0.2 O4 Sr0.15 -","- Cu1.6 La3.7 Mg0.4 O8 Sr0.3 -","2","0.0625","","Wang, F.Z.; Wu, X.S.; Jiang, S.S.","Microstructure of Zn, Ni, Mg doped La1.85 Sr0.15 Cu O4 in high doping level","Wu Li Hsueh Pao (= Acta Physica Sinica)","2000","49","","1541","1544","","","","","","","","","","","","","","","","","","","","","","has coordinates","148207","2020-10-21","18:00:00",""
"1526930","10.6718","","10.6718","","10.6718","","90","","90","","90","","1215.38","","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Pr2 O (Te O3)2","","- O7 Pr2 Te2 -","- O7 Pr2 Te2 -","- O56 Pr16 Te16 -","8","0.0416667","","Weber, F.A.; Schleid, T.","Pr2 Te2 O7 : a praseodymium(III) oxide oxotellurate(IV) according to Pr2 O (Te O3)2 with pyrochlore-type crystal structure","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","1285","1287","","","","","","","","","","","","","","","","","","","","","","has coordinates","148211","2020-10-21","18:00:00",""
"1526931","3.771","","3.771","","9.43","","90","","90","","90","","134.099","","","","","","","","","","","","","2","I 41/a m d :2","-I 4bd 2","141","","Ti O2","","- O2 Ti -","- O2 Ti -","- O8 Ti4 -","4","0.125","","Weirich, T.E.; Winterer, M.; Seifried, S.; Fuess, H.; Hahn, H.","Rietveld analysis of electron powder diffraction data from nanocrystalline anatase, Ti O2","Ultramicroscopy","2000","81","","263","270","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526932","3.976","","3.976","","3.976","","90","","90","","90","","62.855","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","Sr W O1.69 N1.31","","- N1.31 O1.69 Sr W -","- N1.308 O1.689 Sr W -","- N1.308 O1.689 Sr W -","1","0.0208333","","Weller, M.T.; Skinner, S.J.","Neutron and X-ray powder diffraction studies of the oxynitrides Sr W (O, N)3, Ba3 W2 (O, N)8 and Ba3 Mo2 (O, N)8","International Journal of Inorganic Materials","2000","2","","463","467","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526933","6.0083","","6.0083","","21.4637","","90","","90","","120","","671.025","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","Ba3 W2 O6.27 N1.73","","- Ba3 N1.73 O6.27 W2 -","- Ba3 N1.732 O6.268 W2 -","- Ba9 N5.196 O18.804 W6 -","3","0.0833333","","Weller, M.T.; Skinner, S.J.","Neutron and X-ray powder diffraction studies of the oxynitrides Sr W (O, N)3, Ba3 W2 (O, N)8 and Ba3 Mo2 (O, N)8","International Journal of Inorganic Materials","2000","2","","463","467","","","","","","","","","","","","","","","","","","","","","","has coordinates","148214","2020-10-21","18:00:00",""
"1526934","5.9706","","5.9706","","21.502","","90","","90","","120","","663.813","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","Ba3 Mo2 (O6.04 N1.96)","","- Ba3 Mo2 N1.96 O6.04 -","- Ba3 Mo2 N1.958 O6.042 -","- Ba9 Mo6 N5.874 O18.126 -","3","0.0833333","","Weller, M.T.; Skinner, S.J.","Neutron and X-ray powder diffraction studies of the oxynitrides Sr W (O, N)3, Ba3 W2 (O, N)8 and Ba3 Mo2 (O, N)8","International Journal of Inorganic Materials","2000","2","","463","467","","","","","","","","","","","","","","","","","","","","","","has coordinates","148215","2020-10-21","18:00:00",""
"1526939","12.831","","6.41","","10.584","","90","","90","","90","","870.499","","","","","","","","","","","","","5","P n a 21","P 2c -2n","33","","K (Ti0.936 Sn0.064) O (P O4)","","- K O5 P Sn0.064 Ti0.936 -","- K O5 P Sn0.0645 Ti0.9355 -","- K8 O40 P8 Sn0.516 Ti7.484 -","8","2","","Wen, L.; Sorokina, N.I.; Yanovskii, V.K.; Vigdorchik, A.G.; Verin, I.A.; Voronkova, V.I.; Simonov, V.I.","Atomic structure of K Ti0.93 Sn0.07 O P O4 single crystals","Kristallografiya","2000","45","","429","431","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526943","8.621","","23.543","","11.358","","90","","110.58","","90","","2158.15","","","","","","","","","","","","","5","C 1 c 1","C -2yc","9","","(Na4 (H2 O)14) (Sn S4)","","- H28 Na4 O14 S4 Sn -","- H28 Na4 O14 S4 Sn -","- H112 Na16 O56 S16 Sn4 -","4","1","","Willett, R. D.; Vij, A.; Imhof, J. M.; Cleary, D. A.","Redetermination of the crystal structure of [Na~4~(H~2~O)~14~]SnS~4~: a compound containing a novel chain of aquated sodium ions","Journal of Chemical Crystallography","2000","30","6","405","410","10.1023/A:1009534006447","","","","","","","","","","","","","","","","","","","","","has coordinates","189203","2020-10-21","18:00:00",""
"1526947","8.38898","","5.99334","","5.89586","","90","","89.997","","90","","296.432","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(Bi2.8 Ca1.2) Sr4 O12","","- Bi2.8 Ca1.2 O12 Sr4 -","- Bi2.8 Ca1.2 O12 Sr4 -","- Bi2.8 Ca1.2 O12 Sr4 -","1","0.25","","Wong-Ng, W.; Kaduk, J. A.; Huang, Q.; Roth, R. S.","Crystal structure of the monoclinic perovskite Sr~3.94~Ca~1.31~Bi~2.70~O~12~","Powder Diffraction","2000","15","4","227","233","10.1017/S0885715600011131","","","","","","","","","","","","","","","","","","","","","has coordinates","188691","2020-10-21","18:00:00",""
"1526955","5.92767","","5.92767","","14.5699","","90","","90","","120","","443.359","","","","","","","","","","","","","2","R -3 m :H","-R 3 2""","166","","","","- Fe3 O4 -","- Fe3 O4 -","- Fe18 O24 -","6","0.166667","","Wright, J.P.; Bell, A.M.T.; Attfield, J.P.","Variable temperature powder neutron diffraction study of the Verwey transition in magnetite Fe3 O4","Solid State Sciences","2000","2","","747","753","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1526959","3.8802","","3.8159","","11.657","","90","","90","","90","","172.599","","","","","","","","","","","","","5","P m m m","-P 2 2","47","","Y (Ba1.96 K0.04) Cu3 O7","","- Ba1.96 Cu3 K0.04 O7 Y -","- Ba1.96 Cu3 K0.04 O7 Y -","- Ba1.96 Cu3 K0.04 O7 Y -","1","0.125","","Wu, X.S.; Gao, J.","Comparison of superconductivity-depression for lanthanum and potassium replacing barium in Y Ba2 Cu3 Oy ceramic cuprate","Physica C (Amsterdam)","2000","329","","285","291","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526960","3.8744","","3.8127","","11.6534","","90","","90","","90","","172.143","","","","","","","","","","","","","5","P m m m","-P 2 2","47","","Y (Ba1.93 K0.07) Cu3 O7","","- Ba1.93 Cu3 K0.07 O7 Y -","- Ba1.93 Cu3 K0.07 O7 Y -","- Ba1.93 Cu3 K0.07 O7 Y -","1","0.125","","Wu, X.S.; Gao, J.","Comparison of superconductivity-depression for lanthanum and potassium replacing barium in Y Ba2 Cu3 Oy ceramic cuprate","Physica C (Amsterdam)","2000","329","","285","291","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526961","3.8761","","3.8133","","11.6598","","90","","90","","90","","172.34","","","","","","","","","","","","","5","P m m m","-P 2 2","47","","Y (Ba1.82 K0.18) Cu3 O7","","- Ba1.82 Cu3 K0.18 O7 Y -","- Ba1.82 Cu3 K0.18 O7 Y -","- Ba1.82 Cu3 K0.18 O7 Y -","1","0.125","","Wu, X.S.; Gao, J.","Comparison of superconductivity-depression for lanthanum and potassium replacing barium in Y Ba2 Cu3 Oy ceramic cuprate","Physica C (Amsterdam)","2000","329","","285","291","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526962","3.873","","3.8193","","11.65","","90","","90","","90","","172.329","","","","","","","","","","","","","5","P m m m","-P 2 2","47","","Y (Ba1.71 K0.29) Cu3 O7","","- Ba1.71 Cu3 K0.29 O7 Y -","- Ba1.71 Cu3 K0.29 O7 Y -","- Ba1.71 Cu3 K0.29 O7 Y -","1","0.125","","Wu, X.S.; Gao, J.","Comparison of superconductivity-depression for lanthanum and potassium replacing barium in Y Ba2 Cu3 Oy ceramic cuprate","Physica C (Amsterdam)","2000","329","","285","291","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526963","3.8856","","3.8211","","11.6869","","90","","90","","90","","173.519","","","","","","","","","","","","","4","P m m m","-P 2 2","47","","Ba2 Y Cu3 O7","","- Ba2 Cu3 O7 Y -","- Ba2 Cu3 O7 Y -","- Ba2 Cu3 O7 Y -","1","0.125","","Wu, X.S.; Wang, F.Z.; Nie, S.; Jiang, S.S.; Liu, J.S.; Yang, L.","Structure and superconductivity in Y Ba2 Cu3 Oy with additives of Na N O3 and Na Cl","Physica C (Amsterdam)","2000","339","","129","136","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526964","3.8858","","3.8239","","11.6866","","90","","90","","90","","173.65","","","","","","","","","","","","","6","P m m m","-P 2 2","47","","Y (Ba1.888 Na0.094 Cl0.018) Cu3 (O6.961 Cl0.039)","","- Ba1.888 Cl0.057 Cu3 Na0.094 O6.961 Y -","- Ba1.888 Cl0.057 Cu3 Na0.094 O6.961 Y -","- Ba1.888 Cl0.057 Cu3 Na0.094 O6.961 Y -","1","0.125","","Wu, X.S.; Wang, F.Z.; Yang, L.; Nie, S.; Liu, J.S.; Jiang, S.S.","Structure and superconductivity in Y Ba2 Cu3 Oy with additives of Na N O3 and Na Cl","Physica C (Amsterdam)","2000","339","","129","136","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526965","3.8858","","3.8248","","11.691","","90","","90","","90","","173.756","","","","","","","","","","","","","6","P m m m","-P 2 2","47","","Y (Ba1.583 Na0.211 Cl0.206) Cu3 (Cl0.13 O6.87)","","- Ba1.583 Cl0.336 Cu3 Na0.211 O6.87 Y -","- Ba1.582 Cl0.336 Cu3 Na0.212 O6.87 Y -","- Ba1.582 Cl0.336 Cu3 Na0.212 O6.87 Y -","1","0.125","","Wu, X.S.; Wang, F.Z.; Nie, S.; Jiang, S.S.; Liu, J.S.; Yang, L.","Structure and superconductivity in Y Ba2 Cu3 Oy with additives of Na N O3 and Na Cl","Physica C (Amsterdam)","2000","339","","129","136","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526966","3.8866","","3.8295","","11.6916","","90","","90","","90","","174.015","","","","","","","","","","","","","6","P m m m","-P 2 2","47","","Y (Ba1.715 Na0.169 Cl0.116) Cu3 (Cl0.105 O6.895)","","- Ba1.715 Cl0.221 Cu3 Na0.169 O6.895 Y -","- Ba1.714 Cl0.221 Cu3 Na0.17 O6.895 Y -","- Ba1.714 Cl0.221 Cu3 Na0.17 O6.895 Y -","1","0.125","","Wu, X.S.; Wang, F.Z.; Nie, S.; Liu, J.S.; Yang, L.; Jiang, S.S.","Structure and superconductivity in Y Ba2 Cu3 Oy with additives of Na N O3 and Na Cl","Physica C (Amsterdam)","2000","339","","129","136","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526967","3.8824","","3.8182","","11.6774","","90","","90","","90","","173.103","","","","","","","","","","","","","5","P m m m","-P 2 2","47","","Y (Ba1.95 Na0.05) Cu3 O7","","- Ba1.95 Cu3 Na0.05 O7 Y -","- Ba1.95 Cu3 Na0.05 O7 Y -","- Ba1.95 Cu3 Na0.05 O7 Y -","1","0.125","","Wu, X.S.; Wang, F.Z.; Nie, S.; Yang, L.; Liu, J.S.; Jiang, S.S.","Structure and superconductivity in Y Ba2 Cu3 Oy with additives of Na N O3 and Na Cl","Physica C (Amsterdam)","2000","339","","129","136","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526968","3.8763","","3.8155","","11.6609","","90","","90","","90","","172.465","","","","","","","","","","","","","5","P m m m","-P 2 2","47","","Y (Ba1.91 Na0.09) Cu3 O7","","- Ba1.91 Cu3 Na0.09 O7 Y -","- Ba1.91 Cu3 Na0.09 O7 Y -","- Ba1.91 Cu3 Na0.09 O7 Y -","1","0.125","","Wu, X.S.; Wang, F.Z.; Nie, S.; Liu, J.S.; Yang, L.; Jiang, S.S.","Structure and superconductivity in Y Ba2 Cu3 Oy with additives of Na N O3 and Na Cl","Physica C (Amsterdam)","2000","339","","129","136","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526969","3.8719","","3.8101","","11.6538","","90","","90","","90","","171.921","","","","","","","","","","","","","5","P m m m","-P 2 2","47","","Y (Ba1.87 Na0.13) Cu3 O7","","- Ba1.87 Cu3 Na0.13 O7 Y -","- Ba1.87 Cu3 Na0.13 O7 Y -","- Ba1.87 Cu3 Na0.13 O7 Y -","1","0.125","","Wu, X.S.; Wang, F.Z.; Nie, S.; Liu, J.S.; Yang, L.; Jiang, S.S.","Structure and superconductivity in Y Ba2 Cu3 Oy with additives of Na N O3 and Na Cl","Physica C (Amsterdam)","2000","339","","129","136","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526975","3.8429","","3.9032","","11.713","","90","","90","","90","","175.69","","","","","","","","","","","","","5","P m m m","-P 2 2","47","","Eu (Ba0.95 La0.05)2 Cu3 O6.85","","- Ba1.9 Cu3 Eu La0.1 O6.85 -","- Ba1.9 Cu3 Eu La0.1 O6.85 -","- Ba1.9 Cu3 Eu La0.1 O6.85 -","1","0.125","","Xu, Y.-W.; Kramer, M.J.; Dennis, K.W.; Wu, H.; O'Connor, A.; McCallum, R.W.; Yelon, W.B.; Malik, S.K.","Substitution for Ba by Pr, La, and Eu in Eu (Ba1-x Rx)2 Cu3 O7+d solid solutions","Physica C (Amsterdam)","2000","333","","195","206","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526976","3.8509","","3.8941","","11.688","","90","","90","","90","","175.271","","","","","","","","","","","","","5","P m m m","-P 2 2","47","","Eu (Ba0.9 La0.1)2 Cu3 O7.05","","- Ba1.8 Cu3 Eu La0.2 O7.05 -","- Ba1.8 Cu3 Eu La0.2 O7.05 -","- Ba1.8 Cu3 Eu La0.2 O7.05 -","1","0.125","","Xu, Y.-W.; Kramer, M.J.; Dennis, K.W.; Wu, H.; O'Connor, A.; McCallum, R.W.; Malik, S.K.; Yelon, W.B.","Substitution for Ba by Pr, La, and Eu in Eu (Ba1-x Rx)2 Cu3 O7+d solid solutions","Physica C (Amsterdam)","2000","333","","195","206","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526977","3.8742","","3.8742","","11.644","","90","","90","","90","","174.77","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","Eu (Ba0.85 La0.15)2 Cu3 O7.06","","- Ba1.7 Cu3 Eu La0.3 O7.06 -","- Ba1.7 Cu3 Eu La0.3 O7.06 -","- Ba1.7 Cu3 Eu La0.3 O7.06 -","1","0.0625","","Xu, Y.-W.; Kramer, M.J.; Dennis, K.W.; Wu, H.; O'Connor, A.; Yelon, W.B.; McCallum, R.W.; Malik, S.K.","Substitution for Ba by Pr, La, and Eu in Eu (Ba1-x Rx)2 Cu3 O7+d solid solutions","Physica C (Amsterdam)","2000","333","","195","206","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526978","3.8747","","3.8747","","11.611","","90","","90","","90","","174.319","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","Eu (Ba0.8 La0.2)2 Cu3 O7.16","","- Ba1.6 Cu3 Eu La0.4 O7.16 -","- Ba1.6 Cu3 Eu La0.4 O7.16 -","- Ba1.6 Cu3 Eu La0.4 O7.16 -","1","0.0625","","Xu, Y.-W.; O'Connor, A.; Dennis, K.W.; Kramer, M.J.; McCallum, R.W.; Wu, H.; Yelon, W.B.; Malik, S.K.","Substitution for Ba by Pr, La, and Eu in Eu (Ba1-x Rx)2 Cu3 O7+d solid solutions","Physica C (Amsterdam)","2000","333","","195","206","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526979","3.8738","","3.8738","","11.591","","90","","90","","90","","173.938","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","Eu (Ba0.75 La0.25)2 Cu3 O7.14","","- Ba1.5 Cu3 Eu La0.5 O7.14 -","- Ba1.5 Cu3 Eu La0.5 O7.14 -","- Ba1.5 Cu3 Eu La0.5 O7.14 -","1","0.0625","","Xu, Y.-W.; Kramer, M.J.; Wu, H.; O'Connor, A.; Dennis, K.W.; Malik, S.K.; McCallum, R.W.; Yelon, W.B.","Substitution for Ba by Pr, La, and Eu in Eu (Ba1-x Rx)2 Cu3 O7+d solid solutions","Physica C (Amsterdam)","2000","333","","195","206","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526980","3.8429","","3.9015","","11.7","","90","","90","","90","","175.419","","","","","","","","","","","","","5","P m m m","-P 2 2","47","","Eu (Ba0.95 Pr0.05)2 Cu3 O6.93","","- Ba1.9 Cu3 Eu O6.93 Pr0.1 -","- Ba1.9 Cu3 Eu O6.93 Pr0.1 -","- Ba1.9 Cu3 Eu O6.93 Pr0.1 -","1","0.125","","Xu, Y.-W.; McCallum, R.W.; Kramer, M.J.; Wu, H.; Dennis, K.W.; Malik, S.K.; O'Connor, A.; Yelon, W.B.","Substitution for Ba by Pr, La, and Eu in Eu (Ba1-x Rx)2 Cu3 O7+d solid solutions","Physica C (Amsterdam)","2000","333","","195","206","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526981","3.8569","","3.89","","11.669","","90","","90","","90","","175.074","","","","","","","","","","","","","5","P m m m","-P 2 2","47","","Eu (Ba0.9 Pr0.1)2 Cu3 O6.94","","- Ba1.8 Cu3 Eu O6.94 Pr0.2 -","- Ba1.8 Cu3 Eu O6.94 Pr0.2 -","- Ba1.8 Cu3 Eu O6.94 Pr0.2 -","1","0.125","","Xu, Y.-W.; Kramer, M.J.; Wu, H.; Dennis, K.W.; O'Connor, A.; Malik, S.K.; McCallum, R.W.; Yelon, W.B.","Substitution for Ba by Pr, La, and Eu in Eu (Ba1-x Rx)2 Cu3 O7+d solid solutions","Physica C (Amsterdam)","2000","333","","195","206","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526982","3.8747","","3.8747","","11.642","","90","","90","","90","","174.785","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","Eu (Ba0.85 Pr0.15)2 Cu3 O6.96","","- Ba1.7 Cu3 Eu O6.96 Pr0.3 -","- Ba1.7 Cu3 Eu O6.96 Pr0.3 -","- Ba1.7 Cu3 Eu O6.96 Pr0.3 -","1","0.0625","","Xu, Y.-W.; Kramer, M.J.; Dennis, K.W.; Malik, S.K.; Wu, H.; McCallum, R.W.; O'Connor, A.; Yelon, W.B.","Substitution for Ba by Pr, La, and Eu in Eu (Ba1-x Rx)2 Cu3 O7+d solid solutions","Physica C (Amsterdam)","2000","333","","195","206","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526983","3.8732","","3.8732","","11.61","","90","","90","","90","","174.169","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","Eu (Ba0.8 Pr0.2)2 Cu3 O7.02","","- Ba1.6 Cu3 Eu O7.02 Pr0.4 -","- Ba1.6 Cu3 Eu O7.02 Pr0.4 -","- Ba1.6 Cu3 Eu O7.02 Pr0.4 -","1","0.0625","","Xu, Y.-W.; Dennis, K.W.; Kramer, M.J.; McCallum, R.W.; O'Connor, A.; Wu, H.; Malik, S.K.; Yelon, W.B.","Substitution for Ba by Pr, La, and Eu in Eu (Ba1-x Rx)2 Cu3 O7+d solid solutions","Physica C (Amsterdam)","2000","333","","195","206","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526984","3.8703","","3.8703","","11.577","","90","","90","","90","","173.414","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","Eu (Ba0.75 Pr0.25)2 Cu3 O7.1","","- Ba1.5 Cu3 Eu O7.1 Pr0.5 -","- Ba1.5 Cu3 Eu O7.1 Pr0.5 -","- Ba1.5 Cu3 Eu O7.1 Pr0.5 -","1","0.0625","","Xu, Y.-W.; Kramer, M.J.; Dennis, K.W.; Wu, H.; O'Connor, A.; McCallum, R.W.; Malik, S.K.; Yelon, W.B.","Substitution for Ba by Pr, La, and Eu in Eu (Ba1-x Rx)2 Cu3 O7+d solid solutions","Physica C (Amsterdam)","2000","333","","195","206","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526985","3.8406","","3.8954","","11.695","","90","","90","","90","","174.965","","","","","","","","","","","","","4","P m m m","-P 2 2","47","","Eu (Ba0.95 Eu0.05)2 Cu3 O7","","- Ba1.9 Cu3 Eu1.1 O7 -","- Ba1.9 Cu3 Eu1.1 O7 -","- Ba1.9 Cu3 Eu1.1 O7 -","1","0.125","","Xu, Y.-W.; O'Connor, A.; Kramer, M.J.; Wu, H.; Yelon, W.B.; McCallum, R.W.; Dennis, K.W.; Malik, S.K.","Substitution for Ba by Pr, La, and Eu in Eu (Ba1-x Rx)2 Cu3 O7+d solid solutions","Physica C (Amsterdam)","2000","333","","195","206","","","","","","","","","","","","","","","","","","","","","","has coordinates","148272","2020-10-21","18:00:00",""
"1526986","3.8584","","3.8742","","11.665","","90","","90","","90","","174.371","","","","","","","","","","","","","4","P m m m","-P 2 2","47","","Eu (Ba0.9 Eu0.1)2 Cu3 O7.02","","- Ba1.8 Cu3 Eu1.2 O7.02 -","- Ba1.8 Cu3 Eu1.2 O7.01 -","- Ba1.8 Cu3 Eu1.2 O7.01 -","1","0.125","","Xu, Y.-W.; Kramer, M.J.; Dennis, K.W.; Wu, H.; O'Connor, A.; Yelon, W.B.; McCallum, R.W.; Malik, S.K.","Substitution for Ba by Pr, La, and Eu in Eu (Ba1-x Rx)2 Cu3 O7+d solid solutions","Physica C (Amsterdam)","2000","333","","195","206","","","","","","","","","","","","","","","","","","","","","","has coordinates","148273","2020-10-21","18:00:00",""
"1526987","3.8651","","3.8651","","11.626","","90","","90","","90","","173.681","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Eu (Ba0.85 Eu0.15)2 Cu3 O7.02","","- Ba1.7 Cu3 Eu1.3 O7.02 -","- Ba1.7 Cu3 Eu1.3 O7.02 -","- Ba1.7 Cu3 Eu1.3 O7.02 -","1","0.0625","","Xu, Y.-W.; Kramer, M.J.; O'Connor, A.; Dennis, K.W.; Wu, H.; McCallum, R.W.; Yelon, W.B.; Malik, S.K.","Substitution for Ba by Pr, La, and Eu in Eu (Ba1-x Rx)2 Cu3 O7+d solid solutions","Physica C (Amsterdam)","2000","333","","195","206","","","","","","","","","","","","","","","","","","","","","","has coordinates","148274","2020-10-21","18:00:00",""
"1526989","6.658","","6.658","","5.161","","90","","90","","90","","228.782","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","Na2 (Ti Ge O5)","","- Ge Na2 O5 Ti -","- Ge Na2 O5 Ti -","- Ge2 Na4 O10 Ti2 -","2","0.125","","Yakubovich, O.V.; Kireev, V.V.; Mel'nikov, O.K.","Refinement of crystal structure of Ge analog of natisite Na2 (Ti O Ge O4) and prediction of new phases with anionic (M T O5) radicals","Kristallografiya","2000","45","","635","641","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526990","4.683","","3.4203","","5.1245","","90","","99.707","","90","","80.905","","","","","","","","","","","","","2","C 1 2/c 1","-C 2yc","15","","","","- Cu O -","- Cu O -","- Cu4 O4 -","4","0.5","","Yamada, H.; Soejima, Y.; Kawaminami, M.; Zheng, X.G.","Structural study of Cu O at low temperatures","Transaction of the Material Research Society of Japan","2000","25","","1199","1202","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1526995","9.5129","","9.5129","","9.5129","","90","","90","","90","","860.872","","","","","","","","","","","","","4","F m -3 m","-F 4 2 3","225","","Na Ca5 Ta O8","","- Ca5 Na O8 Ta -","- Ca4.9998 Na1.0002 O8 Ta -","- Ca19.9992 Na4.0008 O32 Ta4 -","4","0.0208333","","Yamane, H.; Takahashi, H.; Kubota, S.; Shimada, M.","Preparation, crystal structures and electric properties of Na - Ca - Ta - O compounds","Tohoku Daigaku Sozai Kogaku Kenkyusho Iho","2000","56","","25","29","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527000","3.825","","3.825","","15.4","","90","","90","","90","","225.312","","","","","","","","","","","","","7","P 4/m m m","-P 4 2","123","","(Hg0.45 Pb0.45 Cu0.1) (Sr0.74 Ba0.26)2 (Ca0.91 Sr0.09)2 Cu3 O8.31","","- Ba0.52 Ca1.82 Cu3.1 Hg0.45 O8.31 Pb0.45 Sr1.66 -","- Ba0.52 Ca1.82 Cu3.1 Hg0.45 O8.31 Pb0.45 Sr1.66 -","- Ba0.52 Ca1.82 Cu3.1 Hg0.45 O8.31 Pb0.45 Sr1.66 -","1","0.0625","","Yamawaki, K.; Sasaki, S.; Lee, S.; Akao, T.; Yamauchi, H.","Single-crystal X-ray study of (Hg, Pb)-1223 superconductor at low temperature","Physica C (Amsterdam)","2000","338","","67","71","","","","","","","","","","","","","","","","","","","","","","has coordinates","148288","2020-10-21","18:00:00",""
"1527002","14.641","","14.214","","7.9148","","90","","117.36","","90","","1462.87","","","","","","","","","","","","","9","C 1 2/m 1","-C 2y","12","","(K Na0.9) (Ca0.6 Na0.3) Ca1.4 (Nb2.7 Ti1.2 Fe0.05) (Nb2.65 Ti1.3 Fe0.05) (Si16 O48) ((O H)4.75 O3.25) (H2 O)11","","- Ca2 Fe0.1 H26.75 K Na1.2 Nb5.35 O67 Si16 Ti2.5 -","- Ca2 Fe0.1 K Na1.2 Nb5.35 O67 Si16 Ti2.5 -","- Ca2 Fe0.1 K Na1.2 Nb5.35 O67 Si16 Ti2.5 -","1","0.125","","Yamnova, N.A.; Pekov, I.V.; Schneider, J.; Kabalov, Yu.K.; Chukanov, N.V.","Crystal structure of a new Ca, Nb - member of the labuntsovite group","Doklady Akad. Nauk","2000","375","","487","490","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527003","5.365","","11.88","","21.03","","84.87","","92.25","","103.01","","1300.48","","","","","","","","","","","","","11","A -1","-P 1 (-x,-1/2*y+1/2*z,1/2*y+1/2*z)","2","","(Na1.03 K1.97) Fe (Fe Mn0.52 Ca0.38 Na0.1) (Fe3.36 Mg0.64) Ti2 (Si8 O26) (O H)4 (F0.6 (O H)0.4)","","- Ca0.38 F0.6 Fe5.36 H4.4 K1.97 Mg0.64 Mn0.52 Na1.13 O30.4 Si8 Ti2 -","- Ca0.38 F0.6 Fe5.36 H4 K1.97 Mg0.64 Mn0.52 Na1.13 O30.4 Si8 Ti2 -","- Ca0.76 F1.2 Fe10.72 H8 K3.94 Mg1.28 Mn1.04 Na2.26 O60.8 Si16 Ti4 -","2","","","Yamnova, N.A.; Egorov-Tismenko, Yu.K.; Zlykhenskaya, I.V.; Khomyakov, A.R.","Refined crystal structure of iron-rich triclinic astrophyllite","Kristallografiya","2000","45","","642","648","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527004","8.615","","13.03","","7.2","","89.99","","116.01","","89.98","","726.366","","","","","","","","","","","","","4","C -1","-P 1 (1/2*x+1/2*y,1/2*x-1/2*y,-z)","2","","K (Al Si3 O8)","","- Al K O8 Si3 -","- Al1.01 K O8 Si2.99 -","- Al4.04 K4 O32 Si11.96 -","4","","","Yamnova, N.A.; Khomyakov, A.P.; Zlykhenskaya, I.V.","Refinement of the crystal structure of sanidine-like feldspar","Kristallografiya","2000","45","","824","829","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527007","4.0273","","13.77","","14.259","","90","","90","","90","","790.746","","","","","","","","","","","","","4","C m c 21","C 2c -2","36","","K Bi2 Cu S4","","- Bi2 Cu K S4 -","- Bi2 Cu K S4 -","- Bi8 Cu4 K4 S16 -","4","0.5","","Yang, Y.-T.; Brazis, P.; Ibers, J.A.; Kannewurf, C.R.","Structures and conductivities of the quaternary A/Bi/Cu/S phases K Bi2 Cu S4 and A3 Bi5 Cu2 S10 (A = Rb, Cs)","Journal of Solid State Chemistry","2000","155","","243","249","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527008","14.571","","17.8189","","4.0686","","90","","90","","90","","1056.37","","","","","","","","","","","","","4","P n n m","-P 2 2n","58","","Rb3 Bi5 Cu2 S10","","- Bi5 Cu2 Rb3 S10 -","- Bi5 Cu2 Rb3 S10 -","- Bi10 Cu4 Rb6 S20 -","2","0.25","","Yang, Y.-T.; Brazis, P.; Ibers, J.A.; Kannewurf, C.R.","Structures and conductivities of the quaternary A/Bi/Cu/S phases K Bi2 Cu S4 and A3 Bi5 Cu2 S10 (A = Rb, Cs)","Journal of Solid State Chemistry","2000","155","","243","249","","","","","","","","","","","","","","","","","","","","","","has coordinates","148296","2020-10-21","18:00:00",""
"1527009","15.041","","17.994","","4.0973","","90","","90","","90","","1108.93","","","","","","","","","","","","","4","P n n m","-P 2 2n","58","","Cs3 Bi5 Cu2 S10","","- Bi5 Cs3 Cu2 S10 -","- Bi5 Cs3 Cu2 S10 -","- Bi10 Cs6 Cu4 S20 -","2","0.25","","Yang, Y.-T.; Brazis, P.; Kannewurf, C.R.; Ibers, J.A.","Structures and conductivities of the quaternary A/Bi/Cu/S phases K Bi2 Cu S4 and A3 Bi5 Cu2 S10 (A = Rb, Cs)","Journal of Solid State Chemistry","2000","155","","243","249","","","","","","","","","","","","","","","","","","","","","","has coordinates","148297","2020-10-21","18:00:00",""
"1527010","10.277","","10.277","","5.793","","90","","90","","120","","529.867","","","","","","","","","","","","","4","P 63","P 6c","173","","La3 (Al0.44 Si0.93 S7)","","- Al0.44 La3 S7 Si0.93 -","- Al0.44 La3 S7 Si0.93 -","- Al0.88 La6 S14 Si1.86 -","2","0.333333","","Yang, Y.-T.; Ibers, J.A.","Accidental silicon-containing compounds: crystal structures of La3 Al0.44 Si0.93 S7, Ba Sm4 (Si O4)3 Se, and monoclinic and orthorhombic Ln2 (Si O4) Te (Ln = Nd and Sm)","Journal of Solid State Chemistry","2000","155","","433","440","","","","","","","","","","","","","","","","","","","","","","has coordinates","148298","2020-10-21","18:00:00",""
"1527011","9.869","","9.869","","6.851","","90","","90","","120","","577.871","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Ba Sm4 (Si O4)3 Se","","- Ba O12 Se Si3 Sm4 -","- Ba O12 Se Si3 Sm4 -","- Ba2 O24 Se2 Si6 Sm8 -","2","0.166667","","Yang, Y.-T.; Ibers, J.A.","Accidental silicon-containing compounds: crystal structures of La3 Al0.44 Si0.93 S7, Ba Sm4 (Si O4)3 Se, and monoclinic and orthorhombic Ln2 (Si O4) Te (Ln = Nd and Sm)","Journal of Solid State Chemistry","2000","155","","433","440","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527012","9.823","","6.421","","8.676","","90","","94.6","","90","","545.463","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Nd2 (Si O4) Te","","- Nd2 O4 Si Te -","- Nd2 O4 Si Te -","- Nd8 O16 Si4 Te4 -","4","1","","Yang, Y.-T.; Ibers, J.A.","Accidental silicon-containing compounds: crystal structures of La3 Al0.44 Si0.93 S7, Ba Sm4 (Si O4)3 Se, and monoclinic and orthorhombic Ln2 (Si O4) Te (Ln = Nd and Sm)","Journal of Solid State Chemistry","2000","155","","433","440","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527013","9.76","","6.357","","8.601","","90","","94.87","","90","","531.717","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Sm2 (Si O4) Te","","- O4 Si Sm2 Te -","- O4 Si Sm2 Te -","- O16 Si4 Sm8 Te4 -","4","1","","Yang, Y.-T.; Ibers, J.A.","Accidental silicon-containing compounds: crystal structures of La3 Al0.44 Si0.93 S7, Ba Sm4 (Si O4)3 Se, and monoclinic and orthorhombic Ln2 (Si O4) Te (Ln = Nd and Sm)","Journal of Solid State Chemistry","2000","155","","433","440","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527014","6.279","","7.189","","11.168","","90","","90","","90","","504.121","","","","","","","","","","","","","4","P b c m","-P 2c 2b","57","","Nd2 (Si O4) Te","","- Nd2 O4 Si Te -","- Nd2 O4 Si Te -","- Nd8 O16 Si4 Te4 -","4","0.5","","Yang, Y.-T.; Ibers, J.A.","Accidental silicon-containing compounds: crystal structures of La3 Al0.44 Si0.93 S7, Ba Sm4 (Si O4)3 Se, and monoclinic and orthorhombic Ln2 (Si O4) Te (Ln = Nd and Sm)","Journal of Solid State Chemistry","2000","155","","433","440","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527015","6.201","","7.091","","11.077","","90","","90","","90","","487.07","","","","","","","","","","","","","4","P b c m","-P 2c 2b","57","","Sm2 (Si O4) Te","","- O4 Si Sm2 Te -","- O4 Si Sm2 Te -","- O16 Si4 Sm8 Te4 -","4","0.5","","Yang, Y.-T.; Ibers, J.A.","Accidental silicon-containing compounds: crystal structures of La3 Al0.44 Si0.93 S7, Ba Sm4 (Si O4)3 Se, and monoclinic and orthorhombic Ln2 (Si O4) Te (Ln = Nd and Sm)","Journal of Solid State Chemistry","2000","155","","433","440","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527016","4.187","","4.187","","4.187","","90","","90","","90","","73.402","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","Ba (In0.70 Ga0.30) O2.5","","- Ba Ga0.3 In0.7 O2.5 -","- Ba Ga0.3 In0.7 O2.499 -","- Ba Ga0.3 In0.7 O2.499 -","1","0.0208333","","Yao, T.; Inagaki, T.; Uchimoto, Y.; Kinuhata, M.; Yoshida, H.","Crystal structure of Ga-doped Ba2 In2 O5 and its oxide ion conductivity","Solid State Ionics","2000","132","","189","198","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527017","4.174","","4.174","","4.174","","90","","90","","90","","72.721","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","Ba (In0.60 Ga0.40) O2.5","","- Ba Ga0.4 In0.6 O2.5 -","- Ba Ga0.4 In0.6 O2.499 -","- Ba Ga0.4 In0.6 O2.499 -","1","0.0208333","","Yao, T.; Uchimoto, Y.; Kinuhata, M.; Inagaki, T.; Yoshida, H.","Crystal structure of Ga-doped Ba2 In2 O5 and its oxide ion conductivity","Solid State Ionics","2000","132","","189","198","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527018","4.164","","4.164","","4.164","","90","","90","","90","","72.199","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","Ba (In0.55 Ga0.45) O2.5","","- Ba Ga0.45 In0.55 O2.5 -","- Ba Ga0.45 In0.55 O2.499 -","- Ba Ga0.45 In0.55 O2.499 -","1","0.0208333","","Yao, T.; Uchimoto, Y.; Kinuhata, M.; Inagaki, T.; Yoshida, H.","Crystal structure of Ga-doped Ba2 In2 O5 and its oxide ion conductivity","Solid State Ionics","2000","132","","189","198","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527023","6.843","","6.843","","19.35","","90","","90","","120","","784.702","","","","","","","","","","","","","3","P 61","P 61","169","","(Ga0.6 In0.4)2 Se3","","- Ga1.2 In0.8 Se3 -","- Ga1.2 In0.8 Se3 -","- Ga7.2 In4.8 Se18 -","6","1","","Ye, J.; Hanada, T.; Nakamura, Y.; Nittono, O.","X-ray crystallographic study of the optically active semiconductor (Gax In1-x)2 Se3","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2000","62","","16549","16554","","","","","","","","","","","","","","","","","","","","","","has coordinates","148311","2020-10-21","18:00:00",""
"1527024","6.985","","6.985","","18.99","","90","","90","","120","","802.395","","","","","","","","","","","","","3","P 61","P 61","169","","(Ga0.4 In0.6)2 Se3","","- Ga0.8 In1.2 Se3 -","- Ga0.8 In1.2 Se3 -","- Ga4.8 In7.2 Se18 -","6","1","","Ye, J.; Hanada, T.; Nakamura, Y.; Nittono, O.","X-ray crystallographic study of the optically active semiconductor (Gax In1-x)2 Se3","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2000","62","","16549","16554","","","","","","","","","","","","","","","","","","","","","","has coordinates","148312","2020-10-21","18:00:00",""
"1527036","5.352","","7.428","","5.295","","90","","91.24","","90","","210.452","","","","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","(Ho0.2 Ca0.8) (Mn O3)","","- Ca0.8 Ho0.2 Mn O3 -","- Ca0.8 Ho0.2 Mn O3 -","- Ca3.2 Ho0.8 Mn4 O12 -","4","1","","Zeiske, T.; Hagdorn, K.; Ritter, H.; Hohlwein, D.; Prandl, W.; Ihringer, J.","Structure and magnetism of Ho0.2 Ca0.8 Mn O3","Physik (Berlin)","2000","276","","624","625","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527037","8.743","","8.743","","6.625","","90","","90","","120","","438.569","","","","","","","","","","","","","2","P 63/m c m","-P 6c 2","193","","","","- Ge3 Nd5 -","- Ge3 Nd5 -","- Ge6 Nd10 -","2","0.0833333","","Zeng, L.-M.; Franzen, H.F.","Refinement of the crystal structure of Ge3 Nd5","Journal of Alloys Compd.","2000","313","","75","76","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1527043","10.4138","","10.4138","","10.4138","","90","","90","","90","","1129.35","","","","","","","","","","","","","5","F d -3 m :2","-F 4vw 2vw 3","227","","(Ca Nd) (Fe0.5 Nb1.5) O7","","- Ca Fe0.5 Nb1.5 Nd O7 -","- Ca Fe0.5 Nb1.5 Nd O7 -","- Ca8 Fe4 Nb12 Nd8 O56 -","8","0.0416667","","Zhao, X.H.; Ruan, S.K.; Du, J.; Liu, M.L.; Jia, Y.Q.; Jin, M.Z.; Li, X.-L.; Song, Y.W.; Xiong, H.","Synthesis, crystal structure, Mossbauer spectrum, and magnetic susceptibility of new pyrochlore compound Ca Nd Fe1/2 Nb3/2 O7","Journal of Solid State Chemistry","2000","154","","483","487","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527044","25.054","","25.054","","25.054","","90","","90","","90","","15726.5","","","","","","","","","","","","","5","F d -3 :2","-F 2uv 2vw 3","203","","Tl74.18 Na17.81 (Al92 Si100 O384)","","- Al91.9968 Na17.808 O384 Si100.003 Tl72.432 -","- Al91.9968 Na17.808 O384 Si100.003 Tl72.432 -","- Al91.9968 Na17.808 O384 Si100.003 Tl72.432 -","1","0.0104167","","Zhu, L.; Seff, K.","Rate of Tl(+) exchange into single crystals of zeolite X","Microporous and Mesoporous Materials","2000","39","","187","193","","","","","","","","","","","","","","","","","","","","","","has coordinates","148334","2020-10-21","18:00:00",""
"1527045","25.071","","25.071","","25.071","","90","","90","","90","","15758.5","","","","","","","","","","","","","5","F d -3 :2","-F 2uv 2vw 3","203","","Tl82.94 Na9.17 (Al92 Si100 O384)","","- Al92 Na9.17 O384 Si100 Tl82.94 -","- Al91.9968 Na3.6 O384 Si100.003 Tl82.944 -","- Al91.9968 Na3.6 O384 Si100.003 Tl82.944 -","1","0.0104167","","Zhu, L.; Seff, K.","Rate of Tl(+) exchange into single crystals of zeolite X","Microporous and Mesoporous Materials","2000","39","","187","193","","","","","","","","","","","","","","","","","","","","","","has coordinates","148335","2020-10-21","18:00:00",""
"1527047","9.42","","9.42","","18.61809","","90","","90","","90","","1652.1","","","","","","","","","","","","","4","I 41/a c d :2","-I 4bd 2c","142","","(Cu0.165 Mn6.835) Si O12","","- Cu0.165 Mn6.835 O12 Si -","- Cu0.165 Mn6.835 O12 Si -","- Cu1.32 Mn54.68 O96 Si8 -","8","0.25","","Zotov, N.; Boysen, H.; Miletich, R.; Tietze, H.; Kockelmann, W.","Copper substitution in (Cu, Mn)7 O12 braunite: a combined neutron and X-ray powder diffraction study","Materials Science Forum","2000","321","","791","795","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527048","9.4247","","9.4247","","18.66879","","90","","90","","90","","1658.26","","","","","","","","","","","","","4","I 41/a c d :2","-I 4bd 2c","142","","(Cu0.046 Mn6.954) Si O12","","- Cu0.046 Mn6.954 O12 Si -","- Cu0.046 Mn6.954 O12 Si -","- Cu0.368 Mn55.632 O96 Si8 -","8","0.25","","Zotov, N.; Miletich, R.; Kockelmann, W.; Boysen, H.; Tietze, H.","Copper substitution in (Cu, Mn)7 O12 braunite: a combined neutron and X-ray powder diffraction study","Materials Science Forum","2000","321","","791","795","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527051","7.767","","7.767","","7.767","","90","","90","","90","","468.554","","","","","","","","","","","","","13","P n -3 m :2","-P 4bc 2bc 3","224","","(Na0.475 Ca0.118 Ce0.19 La0.08 Nd0.04 Th0.01 Sr0.05 Pr0.01 Eu0.0075 Sm0.01) (Ti0.865 Nb0.135) O3","","- Ca0.118 Ce0.19 Eu0.0075 La0.08 Na0.475 Nb0.135 Nd0.04 O3 Pr0.01 Sm0.01 Sr0.05 Th0.01 Ti0.865 -","- Ca0.1175 Ce0.19 Eu0.0075 La0.08 Na0.475 Nb0.135 Nd0.04 O3 Pr0.01 Sm0.01 Sr0.05 Th0.01 Ti0.865 -","- Ca0.94 Ce1.52 Eu0.06 La0.64 Na3.8 Nb1.08 Nd0.32 O24 Pr0.08 Sm0.08 Sr0.4 Th0.08 Ti6.92 -","8","0.166667","","Zubkova, N.V.; Arakcheeva, A.V.; Pushcharovskii, D.Yu.; Semenov, E.I.; Atencio, D.","Crystal structure of loparite","Kristallografiya","2000","45","","242","246","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527573","5.4756","","5.4248","","7.731","","90","","90","","90","","229.642","","","","","","","","","","","","","3","P n n a","-P 2a 2bc","52","","Zr V2 D2.8","","- D2.8 V2 Zr -","- D2.8 V2 Zr -","- D11.2 V8 Zr4 -","4","0.5","","Irodova, A.V.; Bouree, F.; Andre, G.","Phase transition between hydrogen superstructures with k=(001) and k=0 via incommensurate phase in Zr V2 Dx (2.8 <x <3.9)","Journal of Alloys Compd.","2000","302","","159","168","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528962","3.89069","","3.89069","","7.4994","","90","","90","","90","","113.522","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Y Ba Co2 O5","","- Ba Co2 O5 Y -","- Ba Co2 O5 Y -","- Ba Co2 O5 Y -","1","0.0625","","Vogt, T.; Woodward, P.M.; Hunter, B.A.; Karen, P.; Henning, P.; Moodenbaugh, A.R.","Low to high spin-state transition induced by charge ordering in antiferromagnetic Y Ba Co2 O5","Physical Review Letters","2000","84","","2969","2972","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528963","7.8235","","3.8746","","7.4367","","90","","90","","90","","225.428","","","","","","","","","","","","","4","P m m a","-P 2a 2a","51","","Y Ba Co2 O5","","- Ba Co2 O5 Y -","- Ba Co2 O5 Y -","- Ba2 Co4 O10 Y2 -","2","0.25","","Vogt, T.; Karen, P.; Woodward, P.M.; Hunter, B.A.; Henning, P.; Moodenbaugh, A.R.","Low to high spin-state transition induced by charge ordering in antiferromagnetic Y Ba Co2 O5","Physical Review Letters","2000","84","","2969","2972","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1531083","17.7478","","17.191","","3.941","","90","","90","","90","","1202.41","","","","","","","","","","","","","4","C m m m","-C 2 2","65","","Cu1.264 Ta11 O26.19 F4.8","","- Cu1.264 F4.8 O26.19 Ta11 -","- Cu1.264 F4.805 O26.195 Ta11 -","- Cu2.528 F9.61 O52.39 Ta22 -","2","0.125","","Askeljung, C.; Lundberg, M.; Sundberg, M.","Cu1.1 Ta11 O26.2 F4.8: a tetragonal-tungsten-bronze-related structure with square planar coordination of copper","International Journal of Inorganic Materials","2000","2","","469","476","","","","","","","","","","","","","","","","","","","","","","has coordinates","156407","2020-10-21","18:00:00",""
"1531781","7.3087","","12.7246","","9.0913","","90","","119.01","","90","","739.414","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Na2 (Si3 O7) (H2 O)","","- H2 Na2 O8 Si3 -","- H2 Na2 O8 Si3 -","- H8 Na8 O32 Si12 -","4","1","","Matijasic, A.; Marler, B.; Patarin, J.","Synthesis and characterization of Mu-11: a porous sodium trisilicate Na2 Si3 O7 * (H2 O) with 10-membered ring openings","International Journal of Inorganic Materials","2000","2","","209","216","","","","","","","","","","","","","","","","","","","","","","has coordinates","157339","2020-10-21","18:00:00",""
"1532246","2.96","","2.96","","11.127","","90","","90","","120","","84.429","","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","Na0.66 (Li0.23 Ti0.77) O2","","- Li0.23 Na0.66 O2 Ti0.77 -","- Li0.23 Na0.651 O2 Ti0.77 -","- Li0.46 Na1.302 O4 Ti1.54 -","2","0.0833333","","Shilov, G.V.; Nalbandyan, V.B.; Volochaev, V.A.; Atovmyan, L.O.","Crystal growth and crystal structures of the layered ionic conductors - sodium lithium titanium oxides","International Journal of Inorganic Materials","2000","2","","443","449","","","","","","","","","","","","","","","","","","","","","","has coordinates","157926","2020-10-21","18:00:00",""
"1532248","2.993","","2.993","","16.045","","90","","90","","120","","124.475","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","(Na0.73 Li0.24) (Li0.32 Ti0.68) O2","","- Li0.56 Na0.73 O2 Ti0.68 -","- Li0.56 Na0.73 O2 Ti0.68 -","- Li1.68 Na2.19 O6 Ti2.04 -","3","0.0833333","","Shilov, G.V.; Nalbandyan, V.B.; Atovmyan, L.O.; Volochaev, V.A.","Crystal growth and crystal structures of the layered ionic conductors - sodium lithium titanium oxides","International Journal of Inorganic Materials","2000","2","","443","449","","","","","","","","","","","","","","","","","","","","","","has coordinates","157929","2020-10-21","18:00:00",""
"1532363","3.8578","","3.8803","","27.26","","90","","90","","90","","408.066","","","","","","","","","","","","","5","A m m m","-A 2 2","65","","(Y0.625 Nd0.375) Ba2 Cu4 O8","","- Ba2 Cu4 Nd0.375 O8 Y0.625 -","- Ba2 Cu4 Nd0.375 O8 Y0.625 -","- Ba4 Cu8 Nd0.75 O16 Y1.25 -","2","0.125","","Valo, J.; Leskela, M.; Hauback, B.C.; Fjellvag, H.; Koo, S.-M.; Rao, K.V.","Nd substitution effects in Y Ba2 Cu4 O8 prepared using a conversionreaction from Y1-x Ndx Ba2 Cu3 O7-d and Cu O","International Journal of Inorganic Materials","2000","2","","269","276","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1532365","3.8652","","3.884","","27.295","","90","","90","","90","","409.764","","","","","","","","","","","","","5","A m m m","-A 2 2","65","","(Y0.5 Nd0.5) Ba2 Cu4 O8","","- Ba2 Cu4 Nd0.5 O8 Y0.5 -","- Ba2 Cu4 Nd0.5 O8 Y0.5 -","- Ba4 Cu8 Nd O16 Y -","2","0.125","","Valo, J.; Leskela, M.; Koo, S.-M.; Fjellvag, H.; Hauback, B.C.; Rao, K.V.","Nd substitution effects in Y Ba2 Cu4 O8 prepared using a conversionreaction from Y1-x Ndx Ba2 Cu3 O7-d and Cu O","International Journal of Inorganic Materials","2000","2","","269","276","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1532367","3.8759","","3.8864","","27.308","","90","","90","","90","","411.349","","","","","","","","","","","","","5","A m m m","-A 2 2","65","","(Y0.375 Nd0.625) Ba2 Cu4 O8","","- Ba2 Cu4 Nd0.625 O8 Y0.375 -","- Ba2 Cu4 Nd0.625 O8 Y0.375 -","- Ba4 Cu8 Nd1.25 O16 Y0.75 -","2","0.125","","Valo, J.; Fjellvag, H.; Leskela, M.; Hauback, B.C.; Koo, S.-M.; Rao, K.V.","Nd substitution effects in Y Ba2 Cu4 O8 prepared using a conversionreaction from Y1-x Ndx Ba2 Cu3 O7-d and Cu O","International Journal of Inorganic Materials","2000","2","","269","276","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1532446","6.9782","","7.7578","","8.623","","106.354","","105.961","","82.471","","429.928","","","","","","","","","","","","","5","P -1","-P 1","2","","(N H4) Sm H (P3 O10)","","- H5 N O10 P3 Sm -","- H5 N O10 P3 Sm -","- H10 N2 O20 P6 Sm2 -","2","1","","Zouari, N.; Daoud, A.; Mhiri, T.; Lebraud, E.; Gravereau, P.","Crystal structure and Rietveld refinement using X-ray powder diffraction data of two potassium and ammonium - samarium condensed phosphates: K Sm H P3 O10 and N H4 Sm H P3 O10","International Journal of Inorganic Materials","2000","2","","379","387","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1534587","6.266","","6.266","","19.86","","90","","90","","120","","675.291","","","","","","","","","","","","","3","P 63/m c m","-P 6c 2","193","","U2 Ta6 O19","","- O19 Ta6 U2 -","- O19 Ta6 U2 -","- O38 Ta12 U4 -","2","0.0833333","","Schleifer, M.; Albert, B.; Busch, J.; Gruehn, R.","Darstellung und Struktur von U2 Ta6 O19, einer neuen Verbindung mit ""Jahnberg-Struktur, sowie Anmerkungen zu den ersten Oxidchloriden in den Systemen Th / Nb / O / Cl und Th / Zr(Hf) / Nb / O / Cl.","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","2299","2306","","","","","","","","","","","","","","","","","","","","","","has coordinates","161435","2020-10-21","18:00:00",""
"1535197","7.866","","7.866","","8.162","","90","","90","","120","","437.356","","","","","","","","","","","","","3","R -3 :H","-R 3","148","","Cs (Nb F6)","","- Cs F6 Nb -","- Cs F6 Nb -","- Cs3 F18 Nb3 -","3","0.166667","","Berg, R.W.; von Barner, J.H.; Christensen, E.; Nielsen, K.","Crystal Stucture and IR and Raman Spectra of alpha-CsNbF6","Progress in Molten Salt Chemistry 1, ISBN: 2-84299-249-0, Elsevier","2000","2000","","1","1","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1536095","27.627","","27.627","","20.613","","90","","90","","90","","15732.9","","","","","","","","","","","","","2","P 21 21 21","P 2ac 2ab","19","","","","- Ta97 Te60 -","- Ta97 Te60 -","- Ta388 Te240 -","4","1","","Conrad, M.; Harbrecht, B.","Ta97 Te60: a crystalline approximant of a tantalum telluride quasicrystal with twelvefold rotational symmetry","Chemistry - A European Journal","2000","8","","3094","3102","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1536797","16.157","","13.021","","27.879","","90","","90.67","","90","","5864.79","","","","","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","(C (N (C H3)2)3)2 ((C O)4 Fe In Cl3)","","- C18 H36 Cl3 Fe In N6 O4 -","- C18 H36 Cl3 Fe In N6 O4 -","- C144 H288 Cl24 Fe8 In8 N48 O32 -","8","1","","Esser, M.; Neumueller, B.; Petz, W.; Uddin, J.; Frenking, G.","Darstellung, Kristallstruktur und quantenchemische Berechnung von [C(NMe2)3]2[(CO)4FeInCl3]","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","915","920","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1539969","6.794","","8.621","","4.271","","90","","104.07","","90","","242.652","","","","","","","","","","","","","4","C 1 m 1","C -2y","8","","Mn2 P1.09 V0.91 O7","","- Mn2 O7 P1.09 V0.91 -","- Mn2 O7 P1.09 V0.91 -","- Mn4 O14 P2.18 V1.82 -","2","0.5","","Yakubovich, O.V.; Anan'eva, E.N.; Dimitrova, O.V.","Crystal structure of the solid solution Mn2 (Px V1-x) (Vy P1-y) O7","Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR))","2000","26","","586","591","","","","","","","","","","","","","","","","","","","","","","has coordinates","169080","2020-10-21","18:00:00",""
"1541586","8.578","","10.446","","11.276","","68.92","","87.34","","67.01","","862.676","","","","","","","","","","","","","6","P -1","-P 1","2","","Na2 (N H4)4 ((V V8 Mo) O28) (H2 O)10","","- H36 Mo N4 Na2 O38 V9 -","- H36 Mo1.02 N4 Na2 O38 V8.98 -","- H36 Mo1.02 N4 Na2 O38 V8.98 -","1","0.5","","Hu, C.; Duan, C.; Reng, X.; Lu, C.; Liu, Y.; Meng, Q.; Chen, Y.; Cao, M.","Synthesis, structure and the e.s.r. spectrum of the mixed-valence molybdovanadate Na2 (N H4)4 ((V(IV) V(V)8 Mo) O28) (H2 O)10","Transition Metal Chemistry","2000","25","","141","144","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1541684","9.127","","11.672","","17.492","","90","","90.64","","90","","1863.31","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Rh4 (C O)12","","- C12 O12 Rh4 -","- C12 O12 Rh4 -","- C48 O48 Rh16 -","4","1","","Farrugia, L.J.","Structural redetermination of Rh4 (C O)12 at 293 and 173K and analysis of the thermal motion in relation to the dynamical behaviour","Journal of Cluster Science","2000","11","","39","53","","","","","","","","","","","","","","","","","","","","","","has coordinates","173100","2020-10-21","18:00:00",""
"1541707","13.1182","","12.4078","","12.5694","","90","","96.328","","90","","2033.43","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(Re (H) (C O)4)6","","- C24 H6 O24 Re6 -","- C24 H6 O24 Re6 -","- C48 H12 O48 Re12 -","2","0.5","","Masciocchi, N.; Sironi, A.; Garavaglia, L.; d'Alfonso, G.","Complete structural characterization by ab initio x-ray powder diffraction of ((Re (mue-H) (C O)4)n) and ((Re (mue-H) (C O)4)6), inorganic analogues of polyethylene and cyclohexane","Angew. Chem. Int. ed.","2000","39","","4478","4480","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1541709","14.9733","","14.9733","","6.9984","","90","","90","","120","","1358.83","","","","","","","","","","","","","4","P 31","P 31","144","","(H (Re (C O)4))","","- C4 H O4 Re -","- C4 H O4 Re -","- C36 H9 O36 Re9 -","9","3","","Masciocchi, N.; Sironi, A.; d'Alfonso, G.; Garavaglia, L.","Complete structural characterization by ab initio x-ray powder diffraction of ((Re (mue-H) (C O)4)n) and ((Re (mue-H) (C O)4)6), inorganic analogues of polyethylene and cyclohexane","Angew. Chem. Int. ed.","2000","39","","4478","4480","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1541736","10.07","","11.603","","18.39","","90","","90","","90","","2148.73","","","","","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","(Cu (C (N H3)2 N (N H)2 N H2) Cl3) Cl (H2 O)","","- C H12 Cl4 Cu N6 O -","- C H12 Cl4 Cu N6 O -","- C8 H96 Cl32 Cu8 N48 O8 -","8","1","","Savel'eva, Z.A.; Romanenko, G.V.; Larionov, S.V.; Sheludyakova, L.A.","Synthesis and structure of a complex with the coordinated triaminoguanidinium(2+) ion, (Cu (TAG H2) Cl3) Cl . (H2 O)","Polyhedron","2000","19","","1737","1740","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1541845","7.3268","","7.4945","","9.3501","","79.709","","85.013","","71.713","","479.387","","","","","","","","","","","","","4","P -1","-P 1","2","","(Y (H2 O)2) (I O3)3","","- H4 I3 O11 Y -","- I3 O11 Y -","- I6 O22 Y2 -","2","1","","Hector, A.L.; Levason, W.; Webster, M.","Synthesis and properties of scandium, yttrium and lanthanum periodates. Crystal structures of Y (H2 O)3 (I O4 (O H)2) and Y (H2 O)2 (I O3)3","Inorganica Chimica Acta","2000","298","","43","49","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1541849","7.5743","","17.45329","","5.6353","","90","","90","","90","","744.967","","","","","","","","","","","","","5","A m a 2","A 2 -2a","40","","Mn (N (C N)2)2 (H2 O)","","- C4 H2 Mn N6 O -","- C4 Mn N6 O -","- C16 Mn4 N24 O4 -","4","0.5","","Jensen, P.; Price, D.J.; Batten, S.R.; Murray, K.S.; Moubaraki, B.","Self-penetration - a structural compromise between single networks and interpenetration: magnetic properties and crystal structures of (Mn (dca)2 (H2 O)) and (M (dca) (tcm)), M = Co, Ni, Cu, dca = dicyanamide, tcm = tricyanomethanide","Chemistry - A European Journal","2000","6","","3186","3195","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1541946","9.141","","8.114","","12.797","","90","","90.22","","90","","949.147","","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Ba4 (Co2 Cl10) Cl2","","- Ba4 Cl12 Co2 -","- Ba4 Cl12 Co2 -","- Ba8 Cl24 Co4 -","2","0.5","","Assoud, A.; Wickleder, C.; Meyer, G.","Ba2 Co Cl6: Synthese, Kristallstruktur und spektroskopische Eigenschaften","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","2103","2106","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1541996","7.4977","","10.2895","","9.4648","","90","","105.372","","90","","704.064","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(Y (H2 O)3) (I O4 (O H)2)","","- H8 I O9 Y -","- I O9 Y -","- I4 O36 Y4 -","4","1","","Hector, A.L.; Levason, W.; Webster, M.","Synthesis and properties of scandium, yttrium and lanthanum periodates. Crystal structures of Y (H2 O)3 (I O4 (O H)2) and Y (H2 O)2 (I O3)3","Inorganica Chimica Acta","2000","298","","43","49","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1542045","5.535","","10.661","","11.772","","90","","90","","90","","694.65","","","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","(Ni (N H3)2) (V O3)2","","- H6 N2 Ni O6 V2 -","- H6 N2 Ni O6 V2 -","- H24 N8 Ni4 O24 V8 -","4","0.5","","Lin, B.-Z.; Liu, S.-X.","Hydrothermal syntheses, structures and magnetic properties of coordination cation metavanadates, Cu (tn)2 (V O3)2 and Ni (N H3)2 (V O3)2","Polyhedron","2000","19","","2521","2527","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1544372","4.748","0.0003","10.273","0.0007","13.6894","0.0002","100.72","0.01","90","","90","","656.06","0.07","","","","","","","","","","","","8","P 21/b 1 1","-P 2xab","14","Mg9[SiO4]4(OH,F)2","","natural hydroxylclinohumite","- F0.16 Fe0.06 H1.86 Mg8.82 Mn0.01 O16.98 Si4 Ti0.05 -","- H2 Mg9 O18 Si4 -","- H4 Mg18 O36 Si8 -","2","0.5","","Ferraris, G.; Prencipe, M.; Sokoliva, E.V.; Gekimyants, V.M.; Spiridonov, E.M.","Hydroxylclinohumite, a new member of the humite group: twinning, crystal structure and crystal chemistry of the clinohumite subgroup","Z. Kristallogr.","2000","215","","169","173","","","","","","","","","","","","","","","","","","","","","","has coordinates","209174","2020-10-21","18:00:00",""
"1544435","5.7411","0.0006","5.7411","0.0006","7.044","0.0007","90","","90","","120","","201.07","0.04","","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","PbZn0.333Nb0.667O3","","","- Nb0.667 O3 Pb Zn0.333 -","- Nb0.6667 O3 Pb0.999 Zn0.3333 -","- Nb2.0001 O9 Pb2.997 Zn0.9999 -","3","0.166667","","Matsushima, Y.; Ishizawa, N.; Wakiya, N.; Mizutani, N.","Structural study of PbZn1/3Nb2/3O3 by single crystal X-ray diffraction an EXAFS","Journal of the Ceramic Society of Japan","2000","108","","617","622","","","","","","","","","","","","","","","","","","","","","","has coordinates","208816","2020-10-21","18:00:00",""
"1544886","4.9355","0.0015","5.2313","0.0013","7.2003","0.0006","90","","90","","90","","185.91","0.07","","","293.15","","","","","","","","","3","P b n m","-P 2c 2ab","62","ScAlO3","","ScAlO3 perovskite","- Al O3 Sc -","- Al O3 Sc -","- Al4 O12 Sc4 -","4","0.5","","Yamanaka, T.; Liebermann, R.C.; Prewitt, C.T.","Thermal expansion of alumnus perovskite ScAlO3 Sample: at 20 C","Journal of Mineralogical and Petrological Sciences","2000","95","","182","192","","","","","","","","","","","","","","","","","","","","","","has coordinates","190918","2020-10-21","18:00:00",""
"1544887","4.9535","0.0006","5.2436","0.0009","7.2157","0.0011","90","","90","","90","","187.42","0.05","","","713.15","","","","","","","","","3","P b n m","-P 2c 2ab","62","ScAlO3","","ScAlO3 perovskite at 440 C","- Al O3 Sc -","- Al O3 Sc -","- Al4 O12 Sc4 -","4","0.5","","Yamanaka, T.; Liebermann, R.C.; Prewitt, C.T.","Thermal expansion of alumnus perovskite ScAlO3 Sample: at 440 C","Journal of Mineralogical and Petrological Sciences","2000","95","","182","192","","","","","","","","","","","","","","","","","","","","","","has coordinates","190919","2020-10-21","18:00:00",""
"1544888","4.9691","0.0027","5.2525","0.0033","7.2273","0.0031","90","","90","","90","","188.63","0.18","","","976.15","","","","","","","","","3","P b n m","-P 2c 2ab","62","ScAlO3","","ScAlO3 perovskite at 703 C","- Al O3 Sc -","- Al O3 Sc -","- Al4 O12 Sc4 -","4","0.5","","Yamanaka, T.; Liebermann, R.C.; Prewitt, C.T.","Thermal expansion of alumnus perovskite ScAlO3 Sample: at 703 C","Journal of Mineralogical and Petrological Sciences","2000","95","","182","192","","","","","","","","","","","","","","","","","","","","","","has coordinates","190920","2020-10-21","18:00:00",""
"1545153","4.9425","0.002","5.2343","0.0036","7.2043","0.0036","90","","90","","90","","186.38","0.18","","","465.15","","","","","","","","","3","P b n m","-P 2c 2ab","62","ScAlO3","","ScAlO3 perovskite at 192 C","- Al O3 Sc -","- Al O3 Sc -","- Al4 O12 Sc4 -","4","0.5","","Yamanaka, T.; Liebermann, R.C.; Prewitt, C.T.","Thermal expansion of alumnus perovskite ScAlO3 Sample: at 192 C","Journal of Mineralogical and Petrological Sciences","2000","95","","182","192","","","","","","","","","","","","","","","","","","","","","","has coordinates","190921","2020-10-21","18:00:00",""
"1556099","11.179","0.001","13.411","0.002","14.382","0.001","84.26","0.01","83.38","0.02","85.51","0.01","2126.2","0.4","193","2","193","2","","","","","","","","3","P -1","-P 1","2","","","","- C49 H62 O7 -","- C49 H62 O7 -","- C98 H124 O14 -","2","1","","Stephan, ?; Gloe, ?; Paulus, ?; Saadioui, ?; Böhmer, V, ?","Calix Crowns Derived from para-Bridged Calix","Organic letters","2000","2","6","839","841","10.1021/ol005581b","","","0.71073","MoKα","","0.1416","0.0546","","","0.105","0.1303","","","","","","0.867","","","","has coordinates","243462","2020-10-21","18:00:00",""
"1558096","11.8194","0.0001","11.8194","0.0001","11.8194","0.0001","90","","90","","90","","1651.15","0.02","","","14","","","","100","","","","","3","P m -3 n","-P 4n 2 3","223","46H2O*7.34CO2","","CO2 clathrate hydrate sI","- C7.34 H92 O60.68 -","- C7.34 D184 O60.688 -","- C7.34 D184 O60.688 -","1","0.0208333","","Henning, R.W.; Schultz, A.J.; Thieu, V.; Halpern, Y.","Neutron diffraction studies of CO2 clathrate hydrate: Formation from deuterated ice","Journal of Physical Chemistry A","2000","104","","5066","5071","","","","","","","","","","","","","","","","","","","","","","has coordinates","252330","2020-10-21","18:00:00",""
"1566638","6.676","0.0003","6.676","0.0003","6.955","0.0004","90","","90","","90","","309.98","0.03","","","","","","","","","","","","2","P 41 21 2","P 4abw 2nw","92","ice III","","","- D2 O -","- D2 O -","- D24 O12 -","12","1.5","","Lobban, C.; Finney, J. L.; Kuhs, W. F.","The structure and ordering of ices III and V","The Journal of Chemical Physics","2000","112","","7169","","","","","","","","","","","","","","","","","","","","","","","has coordinates","273832","2022-03-20","04:18:35",""
"1566639","9.0926","0.0004","7.5409","0.0004","10.2547","0.0005","90","","109.144","0.004","90","","664.24","0.06","","","","","","","","","","","","2","A 1 2/a 1","-A 2ya","15","ice V","","","- D2 O -","- D2 O -","- D56 O28 -","28","3.5","","Lobban, C.; Finney, J. L.; Kuhs, W. F.","The structure and ordering of ices III and V","The Journal of Chemical Physics","2000","112","","7169","","","","","","","","","","","","","","","","","","","","","","","has coordinates","273833","2022-03-20","04:32:57",""
"1567200","5.817","0.002","16.812","0.006","11.892","0.007","90","","90","","90","","1163","0.9","","","295","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","catena(Ammonium fluoro-(mu!2!-fluoro)-isothiocyanato-tin(II))","","- C H4 N2 O S Sn -","- C H4 F2 N2 S Sn -","- C8 H32 F16 N16 S8 Sn8 -","8","1","","Kokunov, Yu. V.","Tin(II) Fluoride Compounds with Mixed Acidoligands: Synthesis and Crystal Structure of NH4[SnF2(NCS)]","Russian Journal of Coordination Chemistry","2000","26","12","857","860","10.1023/A:1026674808129","","x-ray","","MoKα","","","0.021","","","","0.022","","","","","","","","","","has coordinates","276452","2022-06-30","20:59:28",""
"2000023","31.2094","0.0002","13.1764","0.0002","29.4518","0.0005","90","","111.321","0.001","90","","11282.5","","","","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C104 H190 N2 P4 S8 W6 -","- C104 H190 N2 P4 S8 W6 -","- C416 H760 N8 P16 S32 W24 -","4","0.5","","Song Jin; D. Venkataraman; Francis J. DiSalvo","Ligand Substitution Reactions of W6S8L6 with Tricyclohexylphosphine (L = 4-tert-Butylpyridine or n-Butylamine): 31P NMR and Structural Studies of W6S8(PCy3)n(4-tert-butylpyridine)6-n (0 < n <= 6) Complexes","Inorganic Chemistry","2000","39","","2747","2757","10.1021/ic991426l","","","0.71073","MoKα","","0.0593","0.0365","","0.0704","0.0365","","","","1.146","1.204","1.204","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2000024","10.0667","0.0011","17.699","0.002","14.374","0.002","90","","105.171","0.002","90","","2471.77","","","","298","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C24 H66 N6 S8 W6 -","- C24 H66 N6 S8 W6 -","- C48 H132 N12 S16 W12 -","2","0.25","","Song Jin; D. Venkataraman; Francis J. DiSalvo","Ligand Substitution Reactions of W6S8L6 with Tricyclohexylphosphine (L = 4-tert-Butylpyridine or n-Butylamine): 31P NMR and Structural Studies of W6S8(PCy3)n(4-tert-butylpyridine)6-n (0 < n <= 6) Complexes","Inorganic Chemistry","2000","39","","2747","2757","10.1021/ic991426l","","","0.71073","MoKα","","0.154","0.0768","","0.2482","0.0768","","","","1.092","1.211","1.211","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000025","15.0729","0.0001","15.2558","0.0001","16.0623","0.0002","62.161","0.001","78.813","0.001","73.48","","3123.04","","","","165","2","","","","","","","","5","P -1","-P 1","2","","","","- C122 H230 P6 S8 W6 -","- C122 H230 P6 S8 W6 -","- C122 H230 P6 S8 W6 -","1","0.5","","Song Jin; D. Venkataraman; Francis J. DiSalvo","Ligand Substitution Reactions of W6S8L6 with Tricyclohexylphosphine (L = 4-tert-Butylpyridine or n-Butylamine): 31P NMR and Structural Studies of W6S8(PCy3)n(4-tert-butylpyridine)6-n (0 < n <= 6) Complexes","Inorganic Chemistry","2000","39","","2747","2757","10.1021/ic991426l","","","0.71073","MoKα","","0.0752","0.046","","0.1443","0.046","","","","0.946","0.976","0.976","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"2000072","10.32","0.008","12.39","0.004","11.219","0.002","90","","105.8","0.04","90","","1380.32","","","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C12 H10 Cl4 O2 -","- C12 H10 Cl4 O2 -","- C48 H40 Cl16 O8 -","4","1","","Coquerel, Yoann; Blanc, Aurélien; Deprés, Jean-Pierre; Greene, Andrew E.; Averbuch-Pouchot, Marie-Thérèse; Philouze, Christian; Durif, André","(1R,2s,3S,6R,9S)-5,5,10,10-Tetrachloro-2-methyltricyclo[7.2.0.03,6]undec-7-ene-4,11-dione","Acta Crystallographica, Section C: Crystal Structure Communications","2000","56","12","1480","1481","10.1107/s0108270100012361","","","","","","","0.05","","","0.05","","","","","","","","","","","has coordinates","199666","2020-10-21","18:00:00",""
"2010501","10.087","0.003","11.044","0.003","12.342","0.003","90","0.02","113.86","0.02","90","0.02","1257.4","0.6","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","nimonol","Nimonol","","- C28 H36 O5 -","- C28 H36 O5 -","- C56 H72 O10 -","2","1","BK1476","Kabaleeswaran, V.; Malathi, R.; Rajan, S.S.; Suresh, G.; Narashiman, N.S.","Nimonol and 6-oxonimonol","Acta Crystallographica Section C","2000","56","1","82","84","10.1107/S0108270199011609","","","1.5418","CuKα","","0.0645","0.0623","","","","0.1941","","","","","","1.153","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010502","10.805","0.001","12.71","0.002","17.538","0.002","90","0.01","90","0.01","90","0.01","2408.5","0.5","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","6-oxonimonol","6-oxonimonol","","- C28 H34 O5 -","- C28 H34 O5 -","- C112 H136 O20 -","4","1","BK1476","Kabaleeswaran, V.; Malathi, R.; Rajan, S.S.; Suresh, G.; Narashiman, N.S.","Nimonol and 6-oxonimonol","Acta Crystallographica Section C","2000","56","1","82","84","10.1107/S0108270199011609","","","1.5418","CuKα","","0.0492","0.0429","","","","0.1285","","","","","","0.8","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010503","9.728","0.002","8.414","0.002","11.674","0.002","90","","92.23","0.03","90","","954.8","0.3","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","α-haloketal, (1'R,4S,5S)-Dimethyl 2-(1'-bromoethyl)-2- (3"",4""-dimethoxyphenyl)-1,3-dioxolane-4,5-dicarboxylate","","- C17 H21 Br O8 -","- C17 H21 Br O8 -","- C34 H42 Br2 O16 -","2","1","BK1479","Ferri, Pedro H.; Lariucci, Carlito; Homar, Leon I. B.; Santos, Raquel F.; Maia, Elaine R.; Santos, Lourivaldo S.; Vencato, Ivo","α-Haloketal (1'<i>R</i>,4<i>S</i>,5<i>S</i>)-dimethyl 2-(1'-bromoethyl)-2-(3,4-dimethoxyphenyl)-1,3-dioxolane-4,5-dicarboxylate","Acta Crystallographica Section C","2000","56","1","118","120","10.1107/S0108270199012962","","","0.71073","MoKα","","0.0924","0.035","","","","0.086","","","","","","0.997","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010504","11.7643","0.0002","19.9965","0.0003","32.9889","0.0003","90","","90","","90","","7760.47","0.19","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","μ-(4,4'-Bipyridine)-N:N'-bis[bis(pyrrolidinedithiocarboxylato-S,S')zinc(II)]","","- C30 H40 N6 S8 Zn2 -","- C30 H40 N6 S8 Zn2 -","- C240 H320 N48 S64 Zn16 -","8","0.25","BK1483","Chen, Xiao-Feng; Liu, Shu-Hua; Zhu, Xu-Hui; Vittal, Jagadese J.; Tan, Goek-Kheng; You, Xiao-Zeng","μ-(4,4'-Bipyridine)-<i>N</i>:<i>N</i>'-bis[bis-(pyrrolidinedithiocarboxylato-<i>S</i>,<i>S</i>')zinc(II)]","Acta Crystallographica Section C","2000","56","1","42","43","10.1107/S0108270199012706","","","0.71073","MoKα","","0.061","0.046","","0.121","0.112","","","","1.078","1.12","1.12","","","","","has coordinates,has disorder","176760","2020-10-21","18:00:00",""
"2010505","13.6494","0.0002","12.8573","0.0002","18.4995","0.0003","90","","103.977","0.001","90","","3150.44","0.09","223","2","223","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[m-1,2(h^5^)-1,3-dicyclopentadienyl-1,1,3,3-tetramethyldisiloxanyl] bis[dichloro(h^5^-cyclopentadienyl)titanium] dichloromethane solvate","","- C25 H32 Cl6 O Si2 Ti2 -","- C25 H32 Cl6 O Si2 Ti2 -","- C100 H128 Cl24 O4 Si8 Ti8 -","4","1","BK1495","Grimmond, Brian J.; Corey, Joyce Y.; Rath, Nigam P.","[(η^5^-C~5~<i>R</i>~5~)TiCl~2~(η^5^-C~5~H~4~SiMe~2~)]~2~O·<i>n</i>CH~2~Cl~2~ (<i>R</i> = H, Me; <i>n</i> = 1, 0)","Acta Crystallographica Section C","2000","56","1","53","55","10.1107/S0108270199012718","","","0.71073","MoKα","","0.146","0.07","","","","0.179","","","","","","1.05","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010506","8.1319","0.0001","22.2503","0.0003","21.697","0.0003","90","","97.97","0.01","90","","3887.87","0.13","223","2","223","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[m-1,2(h^5^)-1,3-dicyclopentadienyl-1,1,3,3-tetramethyldisiloxanyl]bis [dichloro(h^5^-pentamethylcyclopentadienyl)titanium]","","- C34 H50 Cl4 O Si2 Ti2 -","- C34 H50 Cl4 O Si2 Ti2 -","- C136 H200 Cl16 O4 Si8 Ti8 -","4","1","BK1495","Grimmond, Brian J.; Corey, Joyce Y.; Rath, Nigam P.","[(η^5^-C~5~<i>R</i>~5~)TiCl~2~(η^5^-C~5~H~4~SiMe~2~)]~2~O·<i>n</i>CH~2~Cl~2~ (<i>R</i> = H, Me; <i>n</i> = 1, 0)","Acta Crystallographica Section C","2000","56","1","53","55","10.1107/S0108270199012718","","","0.71073","MoKα","","0.085","0.051","","","","0.122","","","","","","1.02","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010507","9.3991","0.0007","9.7733","0.0004","10.5899","0.0007","90.376","0.004","71.465","0.005","104.463","0.005","890.29","0.1","293","","293","","","","","","","","","2","P -1","-P 1","2","9-Phenyl-3,4,4a,9a-tetrahydrotriptycene","cis-9-Phenyl-3,4,4a,9,9a,10-hexahydro-9,10[1',2']benzenoanthracene","","- C26 H22 -","- C26 H22 -","- C52 H44 -","2","1","BK1498","Duan, Shaoming; Baker, Ronald J.; Masnovi, John","9-Phenyl-3,4,4a,9a-tetrahydrotriptycene and 9-phenyl-1,2,3,4,4a,9a-hexahydrotriptycene","Acta Crystallographica Section C","2000","56","1","99","101","10.1107/S0108270199012056","","","0.7093","MolybdenumKα","","0.042","0.042","","0.05","","0.05","","","","","","2.03","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2010508","9.2213","0.0006","9.8777","0.001","10.739","0.0008","90.738","0.008","107.829","0.006","104.052","0.007","899.28","0.14","293","","293","","","","","","","","","2","P -1","-P 1","2","9-phenyl-1,2,3,4,4a,9a-hexahydrotriptycene","cis-9-Phenyl-1,2,3,4,4a,9,9a,10-octahydro-9,10[1',2']benzenoanthracene","","- C26 H24 -","- C26 H24 -","- C52 H48 -","2","1","BK1498","Duan, Shaoming; Baker, Ronald J.; Masnovi, John","9-Phenyl-3,4,4a,9a-tetrahydrotriptycene and 9-phenyl-1,2,3,4,4a,9a-hexahydrotriptycene","Acta Crystallographica Section C","2000","56","1","99","101","10.1107/S0108270199012056","","","0.7093","MolybdenumKα","","0.042","0.041","","0.044","","0.044","","","","","","1.94","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2010509","11.165","0.002","7.605","0.002","14.167","0.003","90","","102.02","0.03","90","","1176.5","0.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C2 H10 N8 O6 S2 Zn -","- C2 H10 N8 O6 S2 Zn -","- C8 H40 N32 O24 S8 Zn4 -","4","0.5","BK1501","Tong, Ye-Xiang; Su, Cheng-Yong; Zhang, Ze-Fu; Kang, Bei-Sheng; Yu, Xiao-Lan; Chen, Xiao-Min","Bis(thiosemicarbazide-<i>S</i>,<i>N</i>)zinc(II) dinitrate","Acta Crystallographica Section C","2000","56","1","44","45","10.1107/S0108270199012974","","","0.71073","MoKα","","0.0364","0.0287","","","","0.0736","","","","","","1.083","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010510","11.377","0.0008","12.518","0.001","15.4837","0.0012","69.925","0.003","72.338","0.003","66.953","0.003","1869.1","0.3","143","2","143","2","","","","","","","","6","P -1","-P 1","2","","7-[Triphenylphosphine(diphenylphosphino)gold(I)-P]-8-methyl-7,8- dicarba-nido-undecaborate(-1) Dichloromethane hemisolvate","","- C33.5 H39 Au B9 Cl P2 -","- C33.5 H39 Au B9 Cl P2 -","- C67 H78 Au2 B18 Cl2 P4 -","2","1","BM1352","Crespo, Olga; Gimeno, M. Concepción; Jones, Peter G.; Laguna, Antonio","7-{Diphenyl[(triphenylphosphine)aurio]phosphine(1+)-<i>P</i>}-8-methyl-7,8-dicarba-<i>nido</i>-undecaborate(1‒) dichloromethane hemisolvate","Acta Crystallographica Section C","2000","56","1","46","47","10.1107/S0108270199014328","","","0.71073","MoKα","","0.023","0.02","","","","0.048","","","","","","0.99","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2010511","10.6943","0.0016","11.725","0.0018","16.374","0.003","90","","115.992","0.01","90","","1845.5","0.5","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(tetrahydrothiophene)gold(I) (ortho-benzodisulfonyl)amide","","- C14 H20 Au N O4 S4 -","- C14 H20 Au N O4 S4 -","- C56 H80 Au4 N4 O16 S16 -","4","0.5","BM1354","Friedrichs, Steffi; Jones, Peter G.","Polysulfonylamines. CXX. Bis(tetrahydrothiophene-<i>S</i>)gold(I) benzene-1,2-disulfonimidate","Acta Crystallographica Section C","2000","56","1","56","57","10.1107/S0108270199013086","","","0.71073","MoKα","","0.044","0.029","","","","0.044","","","","","","0.843","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010512","16.317","0.001","8.047","0.001","16.802","0.001","90","","96.97","0.01","90","","2189.8","0.3","298","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C13 H8 Cl4 N5 O6 P3 -","- C13 H8 Cl4 N5 O6 P3 -","- C52 H32 Cl16 N20 O24 P12 -","4","1","BM1373","Hökelek, Tuncer; Akduran, Nurcan; Yıldız, Mustafa; Dal, Hakan; Kılıç, Zeynel","2,4-[2,2'-Methylenebis(4-nitrophenoxy)]-2,4,6,6-tetrachlorocyclo-2λ^5^,4λ^5^,6λ^5^-triphosphazatriene (ansa)","Acta Crystallographica Section C","2000","56","1","90","92","10.1107/S0108270199012986","","","1.54184","CuKα","","","0.045","","","","0.052","","","","","","0.85","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010513","6.459","0.0013","15.662","0.003","12.276","0.003","90","","95.51","0.03","90","","1236.1","0.5","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H12 N2 O S -","- C13 H12 N2 O S -","- C52 H48 N8 O4 S4 -","4","1","BM1375","Nesterov, Vladimir N.; Antipin, Mikhail Yu.; Timofeeva, Tatiana V.; Clark, Ronald D.","<i>trans</i>,<i>trans</i>-2-Cyano-5-(4-methoxyphenyl)penta-2,4-dienethioamide","Acta Crystallographica Section C","2000","56","1","88","89","10.1107/S0108270199012998","","","0.71073","MoKα","","0.167","0.076","","0.306","","0.201","","","1.098","","","1.334","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010514","5.6325","0.0008","5.6325","0.0008","8.045","0.002","90","","90","","120","","221.04","0.07","293","2","293","2","","","","","","","","4","P -3 m 1","-P 3 2""","164","","","","- Al2 K2 O7 Sb2 -","- Al2 K2 O7 Sb2 -","- Al2 K2 O7 Sb2 -","1","0.0833333","","Hirschle, Christian; Röhr, Caroline","Potassium oxoaluminate antimonate(III), K~2~[Al~2~Sb~2~O~7~]","Acta Crystallographica, Section C","2000","56","","05","06","10.1107/S0108270199012184","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2010515","11.982","0.002","18.613","0.004","15.078","0.003","90","","102.79","0.03","90","","3279.3","1.1","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- Rb4 Te16 Zr3 -","- Rb4 Te16 Zr3 -","- Rb16 Te64 Zr12 -","4","0.5","","Anderson, Ashley B.; Wang, Ru-Ji; Li, Jing","Rb~4~Zr~3~Te~16~, a one-dimensional zirconium telluride synthesized from molten salt","Acta Crystallographica, Section C","2000","56","","02","04","10.1107/S0108270199011956","","","","","","","","","","","","","","","","","","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010516","13.864","0.001","13.339","0.001","16.464","0.001","90","","90","","90","","3044.7","0.4","198","2","198","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C15 H12 Mo N2 O4 -","- C15 H12 Mo N2 O4 -","- C120 H96 Mo8 N16 O32 -","8","1","DA1090","Nanty, Dominique; Laurent, Marc; Khan, Masood A.; Ashby, Michael T.","<i>fac</i>-Tricarbonyl[bis(2-pyridylmethyl) ether-<i>N</i>,<i>O</i>,<i>N</i>']molybdenum(0)","Acta Crystallographica Section C","2000","56","1","35","36","10.1107/S0108270199012123","","","0.71073","MoKα","","0.0342","0.0243","","0.0681","","0.0606","","","1.067","","","1.076","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010517","7.8148","0.0001","10.9332","0.0002","15.4893","0.0003","90","","99.002","0.001","90","","1307.12","0.04","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","trans-bis(1,2-Diaminobenzene-N)bis(1,1,1,5,5,5- hexafluoropentane-2,4-dionato-O,O')iron(II)","","- C22 H18 F12 Fe N4 O4 -","- C22 H18 F12 Fe N4 O4 -","- C44 H36 F24 Fe2 N8 O8 -","2","0.5","DA1091","Dickman, Michael H.","Bis(1,2-diaminobenzene-<i>N</i>)bis(1,1,1,5,5,5-hexafluoropentane-2,4-dionato-<i>O</i>,<i>O</i>')iron(II), -cobalt(II) and -nickel(II) at low temperature","Acta Crystallographica Section C","2000","56","1","58","60","10.1107/S0108270199013487","","","0.71073","MoKα","","0.045","0.04","","","","0.107","","","","","","1.002","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010518","7.769","","10.9013","0.0001","15.4431","0.0001","90","","99.288","0.001","90","","1290.76","0.015","158","2","158","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","trans-bis(1,2-Diaminobenzene-N)bis(1,1,1,5,5,5- hexafluoropentane-2,4-dionato-O,O')cobalt(II)","","- C22 H18 Co F12 N4 O4 -","- C22 H18 Co F12 N4 O4 -","- C44 H36 Co2 F24 N8 O8 -","2","0.5","DA1091","Dickman, Michael H.","Bis(1,2-diaminobenzene-<i>N</i>)bis(1,1,1,5,5,5-hexafluoropentane-2,4-dionato-<i>O</i>,<i>O</i>')iron(II), -cobalt(II) and -nickel(II) at low temperature","Acta Crystallographica Section C","2000","56","1","58","60","10.1107/S0108270199013487","","","0.71073","MoKα","","0.063","0.045","","","","0.137","","","","","","1.005","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010519","7.7597","0.0001","10.9286","0.0001","15.3948","0.0003","90","","98.813","0.001","90","","1290.11","0.03","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","trans-bis(1,2-Diaminobenzene-N)bis(1,1,1,5,5,5- hexafluoropentane-2,4-dionato-O,O')nickel(II)","","- C22 H18 F12 N4 Ni O4 -","- C22 H18 F12 N4 Ni O4 -","- C44 H36 F24 N8 Ni2 O8 -","2","0.5","DA1091","Dickman, Michael H.","Bis(1,2-diaminobenzene-<i>N</i>)bis(1,1,1,5,5,5-hexafluoropentane-2,4-dionato-<i>O</i>,<i>O</i>')iron(II), -cobalt(II) and -nickel(II) at low temperature","Acta Crystallographica Section C","2000","56","1","58","60","10.1107/S0108270199013487","","","0.71073","MoKα","","0.045","0.04","","","","0.112","","","","","","1.011","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010520","11.117","0.003","11.1824","0.0011","11.3444","0.001","70.906","0.008","83.953","0.012","67.355","0.012","1229.6","0.4","290","2","290","2","","","","","","","","3","P -1","-P 1","2","","","","- C29 H30 N6 -","- C29 H30 N6 -","- C58 H60 N12 -","2","1","FG1556","Govindasamy, L.; Velmurugan, D.; Raghukumar, V.; Il-Hawn Suh; Ramakrishnan, V.T.","5-Amino-4-(4-diethylaminophenyl)-2-phenyl-7-(pyrrolidin-1-yl)-1,6-naphthyridine-8-carbonitrile","Acta Crystallographica Section C","2000","56","1","80","81","10.1107/S0108270199009257","","","0.71069","MoKα","","0.105","0.06","","","","0.18","","","","","","1.022","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010521","9.366","0.003","19.875","0.001","8.204","0.009","90","","90","","90","","1527.2","1.7","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","(Z)-3-benzylidene-N-phenylisoindolin-1-one","(Z)-3-benzylidene-N-phenylisoindolin-1-one","","- C21 H15 N O -","- C21 H15 N O -","- C84 H60 N4 O4 -","4","1","FR1206","Mukherjee, Alok K.; Guha, Subhadra; Khan, M. Wahab; Kundu, Nitya G.; Helliwell, Madeleine","Two (<i>Z</i>)-<i>N</i>-aryl-3-benzylideneisoindolin-1-ones","Acta Crystallographica Section C","2000","56","1","85","87","10.1107/S0108270199012445","","","1.5418","CuKα","","0.0517","0.0436","","0.1105","","0.1058","","","1.086","","","1.116","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010522","8.577","0.006","10.542","0.004","18.272","0.004","90","","98.34","0.04","90","","1634.7","1.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","(Z)-N-(p-anisyl)-3-benzylidene isoindolin-1-one","(Z)-N-(p-anisyl)-3-benzylidene isoindolin-1-one","","- C22 H17 N O2 -","- C22 H17 N O2 -","- C88 H68 N4 O8 -","4","1","FR1206","Mukherjee, Alok K.; Guha, Subhadra; Khan, M. Wahab; Kundu, Nitya G.; Helliwell, Madeleine","Two (<i>Z</i>)-<i>N</i>-aryl-3-benzylideneisoindolin-1-ones","Acta Crystallographica Section C","2000","56","1","85","87","10.1107/S0108270199012445","","","1.5418","CuKα","","0.0664","0.0483","","0.1097","","0.1029","","","1.027","","","1.095","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010523","7.7564","0.0001","22.3441","0.0005","12.5552","0.0002","90","","97.766","0.001","90","","2155.98","0.07","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C23 H19 N3 O5 -","- C23 H19 N3 O5 -","- C92 H76 N12 O20 -","4","1","FR1219","Işık, Şamil; Öztürk, Sema; Fun, Hoong-Kun; Ag̃ar, Erbil; Şaşmaz, Selami","5'-Allyl-2'-benzoyloxy-3'-methoxy-4-nitroazobenzene","Acta Crystallographica Section C","2000","56","1","95","96","10.1107/S0108270199012457","","","0.71073","MoKα","","0.1922","0.0655","","","","0.1971","","","","","","0.958","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010524","8.177","0.004","8.517","0.004","10.297","0.004","105.84","0.03","104.42","0.03","111.16","0.03","593.1","0.5","296","","296","","","","","","","","","7","P -1","-P 1","2","","","","- C6 H13 Cl2 N O2 Pt S -","- C6 H13 Cl2 N O2 Pt S -","- C12 H26 Cl4 N2 O4 Pt2 S2 -","2","1","FR1238","Dyksterhouse, R. Max; Howell, Bob A.; Squattrito, Philip J.","<i>cis</i>- and <i>trans</i>-Dichloro(3,6-dihydro-1,2-oxazine-<i>N</i>)(dimethyl sulfoxide-<i>S</i>)-platinum(II)","Acta Crystallographica Section C","2000","56","1","64","66","10.1107/S0108270199013803","","","0.7107","MoKα","","","0.026","","","","0.059","","","","","","2.23","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2010525","16.532","0.003","13.868","0.002","10.182","0.004","90","","90","","90","","2334.4","1.1","296","","296","","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C6 H13 Cl2 N O2 Pt S -","- C6 H13 Cl2 N O2 Pt S -","- C48 H104 Cl16 N8 O16 Pt8 S8 -","8","1","FR1238","Dyksterhouse, R. Max; Howell, Bob A.; Squattrito, Philip J.","<i>cis</i>- and <i>trans</i>-Dichloro(3,6-dihydro-1,2-oxazine-<i>N</i>)(dimethyl sulfoxide-<i>S</i>)-platinum(II)","Acta Crystallographica Section C","2000","56","1","64","66","10.1107/S0108270199013803","","","0.7107","MoKα","","","0.032","","","","0.074","","","","","","1.71","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2010526","12.5745","0.0001","12.8844","0.0001","13.0438","0.0001","73.967","0.001","66.242","0.001","62.598","0.001","1706.43","0.03","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","(Lactato-O,O')bis(triphenylphosphine-P)silver(I)","","- C39 H35 Ag O3 P2 -","- C39 H35 Ag O3 P2 -","- C78 H70 Ag2 O6 P4 -","2","1","GD1054","Hanna, John V.; Ng, Seik Weng","Disorder in the lactato group of (lactato-<i>O</i>,<i>O</i>')bis(triphenylphosphine-<i>P</i>)silver(I) corroborated by ^31^P two-dimensional CPCOSY NMR","Acta Crystallographica Section C","2000","56","1","24","25","10.1107/S0108270199012202","","","0.71073","MoKα","","0.039","0.035","","","","0.107","","","","","","1.091","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2010527","7.9436","0.0006","15.144","0.0011","16.3075","0.0011","90","","102.208","0.0013","90","","1917.4","0.2","193","2","193","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Isopropyl 1,4-dihydro-2,6-dimethyl-3-nitro-4- (6-methyl-2-pyridyl)-5-pyridinecarboxylate","","- C20 H24 N3 O4 -","- C20 H24 N3 O4 -","- C80 H96 N12 O16 -","4","1","GD1058","Parrish, Jonathan C.; Shan, Rudong; Knaus, Edward E.; James, Michael N. G.","Racemic isopropyl 1,4-dihydro-2,6-dimethyl-4-(6-methyl-2-pyridyl)-3-nitropyridine-5-carboxylate hemibenzene solvate","Acta Crystallographica Section C","2000","56","1","107","109","10.1107/S0108270199013049","","","0.71073","MoKα","","0.0726","0.045","","","","0.126","","","","","","1.003","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010528","13.245","0.01","21.984","0.01","30.732","0.01","90","","90","","90","","8948","8","122","0.2","122","0.2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Putidin","S-β-hydroxydecanoyl-D-Leu-D-Asp-D-allo-Thr-D-Leu-D-Leu-D-Ser-L-Leu- D-Gln-L-Leu-L-Ile-L-Glu:ethylacetate:dihydrate","","- C71 H127 N12 O24 -","- C71 H127 N12 O24 -","- C284 H508 N48 O96 -","4","1","GD1059","Henriksen, Anette; Anthoni, Uffe; Nielsen, Tommy H.; Sørensen, Jan; Christophersen, Carsten; Gajhede, Michael","Cyclic lipoundecapeptide tensin from <i>Pseudomonas fluorescens</i> strain 96.578","Acta Crystallographica Section C","2000","56","1","113","115","10.1107/S0108270199013414","","","1.5418","CuKα","","0.0975","0.0704","","","","0.205","","","","","","1.035","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2010529","13.014","0.0009","16.399","0.0015","20.726","0.003","90","0.008","90","0.01","90","0.009","4423.3","0.8","173","2","173","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","trans-[hydrotetrakis(trimethylphosphine)Rhodiumchloride/bromide] [(tetrabromobenzene-1,2-diolato)borate] dichloromethane solvate","","- C25 H39 B Br8.27 Cl2.73 O4 P4 Rh -","- C25 H39 B Br8.26 Cl2.74 O4 P4 Rh -","- C100 H156 B4 Br33.04 Cl10.96 O16 P16 Rh4 -","4","1","GD1060","Norman, Nicholas C.; Orpen, A. Guy; Quayle, Michael J.; Robins, Edward G.","Compositional disorder in <i>trans</i>-[RhBr~0.26~Cl~0.74~H(PMe~3~)~4~][B(1,2-O~2~C~6~Br~4~)]·CH~2~Cl~2~","Acta Crystallographica Section C","2000","56","1","50","52","10.1107/S0108270199013554","","","0.71073","MoKα","","0.0703","0.0486","","0.1184","","0.1126","","","1.031","","","1.154","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2010530","12.38","0.002","12.38","","12.018","0.003","90","","90","","90","","1841.9","0.5","295","","295","","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","","","","- C14 H32 Al2 N2 -","- C14 H32 Al2 N2 -","- C56 H128 Al8 N8 -","4","0.5","GD1061","Craig, Fiona J.; Kennedy, Alan R.; Mulvey, Robert E.","Bis[(μ-cyclopentylamino-<i>N</i>:<i>N</i>)dimethylaluminium(III)]","Acta Crystallographica Section C","2000","56","1","31","32","10.1107/S0108270199012639","","","0.71069","MoKα","","0.124","0.046","","0.0548","0.046","","","","","1.408","1.408","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2010531","16.613","0.003","10.557","0.002","11.259","0.002","90","","90","","90","","1974.6","0.6","293","2","293","2","","","","","","","","3","P c c n","-P 2ab 2ac","56","","","","- C23 H28 O2 -","- C23 H28 O2 -","- C92 H112 O8 -","4","0.5","GD1069","Ejsmont, Krzysztof; Kyzioł, Janusz; Nowakowska, Ewa; Zaleski, Jacek","4,4,4',4',7,7'-Hexamethyl-2,2'-spirobichroman","Acta Crystallographica Section C","2000","56","1","93","94","10.1107/S0108270199013190","","","0.71073","MoKα","","0.075","0.046","","","","0.131","","","","","","1.156","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010532","9.343","0.004","21.922","0.008","6.447","0.003","90","","90","","90","","1320.5","1","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","5-Ethyl-4'-thio-2'-deoxyuridine sulfoxide monohydrate","","- C11 H18 N2 O6 S -","- C11 H18 N2 O6 S -","- C44 H72 N8 O24 S4 -","4","1","HA1268","Sun, Ming; Macculloch, Alasdair C.; Hamor, Thomas A.; Walker, Richard T.","5-Ethyl-2'-deoxy-4'-thiouridine (<i>R</i>)-<i>S</i>-oxide monohydrate","Acta Crystallographica Section C","2000","56","1","116","117","10.1107/S0108270199012548","","","0.71073","MoKα","","0.032","0.031","","0.078","","0.077","","","1.072","","","1.062","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010533","9.5684","0.0002","11.7898","0.0002","24.294","0.001","90","","90.684","0.001","90","","2740.4","0.13","180","2","180","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(4,11-dibenzyl-1,4,8,11-tetraazabicyclo[6.6.2]hexadecane-κ^4^N)copper(I) hexafluorophosphate","","- C26 H38 Cu F6 N4 P -","- C26 H38 Cu F6 N4 P -","- C104 H152 Cu4 F24 N16 P4 -","4","1","HA1270","Hubin, Timothy J.; Alcock, Nathaniel W.; Busch, Daryle H.","Copper(I) and copper(II) complexes of an ethylene cross-bridged cyclam","Acta Crystallographica Section C","2000","56","1","37","39","10.1107/S010827019901255X","","","0.71073","MoKα","","0.038","0.03","","","","0.078","","","","","","1.023","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010534","9.9695","0.0004","10.561","0.0005","17.7607","0.0008","101.236","0.001","101.105","0.001","109.157","0.001","1664.83","0.13","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","[acetonitrile(4,11-dibenzyl-1,4,8,11- tetraazabicyclo[6.6.2]hexadecane-κ^4^N)]copper(II) bis(hexafluorophosphate)","","- C28 H41 Cu F12 N5 P2 -","- C28 H41 Cu F12 N5 P2 -","- C56 H82 Cu2 F24 N10 P4 -","2","1","HA1270","Hubin, Timothy J.; Alcock, Nathaniel W.; Busch, Daryle H.","Copper(I) and copper(II) complexes of an ethylene cross-bridged cyclam","Acta Crystallographica Section C","2000","56","1","37","39","10.1107/S010827019901255X","","","0.71073","MoKα","","0.064","0.055","","","","0.146","","","","","","1.051","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2010535","13.9929","0.0011","19.6661","0.0011","24.89","0.003","90","","90","","90","","6849.4","1.1","200","1","200","1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C26 H50 Cd Cl N5 O12 -","- C26 H50 Cd Cl N5 O12 -","- C208 H400 Cd8 Cl8 N40 O96 -","8","2","JA1006","Davies, Philip. J.; Lincoln, Stephen F.; Smith, Christopher B.; Taylor, Max R.; Wainwright, Kevin P.; Wallwork, Kia S.","{Δ-1,4,7,10-Tetrakis[(<i>S</i>)-2-hydroxypropyl-κ<i>O</i>]-1,4,7,10-tetraazacyclododecane-κ^4^<i>N</i>}cadmium(II) 4-nitrophenolate perchlorate hydrate","Acta Crystallographica Section C","2000","56","1","28","30","10.1107/S0108270199012391","","","0.71073","Mo_Kα","","0.073","0.041","","0.077","","0.07","","","1.471","1.403","1.403","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2010536","25.7526","0.0017","4.2348","0.0003","11.2966","0.0007","90","","90","","90","","1231.97","0.14","293","2","293","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","11-Methylpyrido[2,3-b]acridine-5,12-dione","","- C17 H10 N2 O2 -","- C17 H10 N2 O2 -","- C68 H40 N8 O8 -","4","1","JA1007","Copp, Brent R.; Lindsay, Brent S.; Oliver, Allen G.; Rickard, Clifton E. F.","11-Methylpyrido[2,3-<i>b</i>]acridine-5,12-dione","Acta Crystallographica Section C","2000","56","1","102","103","10.1107/S0108270199013578","","","0.71073","MoKα","","0.061","0.054","","","","0.141","","","","","","1.016","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010537","15.856","0.002","15.856","0.002","29.753","0.005","90","","90","","90","","7480.3","1.8","200","2","200","2","","","","","","","","6","I 41/a :2","-I 4ad","88","Oxovanadiumacetate","tetraphenylphosphonium μ~4~-nitrato-κ^4^O-cyclo- tetrakis(μ-acetato-κO:κO')tetra-μ-oxo-tetrakis[oxovanadium(V)]","","- C32 H32 N O19 P V4 -","- C32 H32 N O19 P V4 -","- C256 H256 N8 O152 P8 V32 -","8","0.5","JZ1345","Wulff-Molder, Dirk; Meisel, Manfred","The cyclic vanadylacetate (C~24~H~20~P)[V~4~O~8~(C~2~H~3~O~2~)~4~(NO~3~)]","Acta Crystallographica Section C","2000","56","1","33","34","10.1107/S0108270199012214","","","0.71073","MoKα","","0.064","0.042","","0.112","0.1","","","","1.015","1.126","1.126","","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010538","8.9875","0.0001","15.4363","0.0001","20.0845","0.0002","90","","90","","90","","2786.4","0.05","173","2","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Bis(η^5^-isopropyl-tetramethyl-cyclopentadienyl)- (tetrahydroborato-κ^3^H,H',H'')-(tetrahydrofuran)-samarium(III)","","- C28 H50 B O Sm -","- C28 H50 B O Sm -","- C112 H200 B4 O4 Sm4 -","4","1","JZ1369","Schumann, Herbert; Keitsch, Markus R.; Mühle, Stefan H.","Bis(η^5^-isopropyltetramethylcyclopentadienyl)(tetrahydroborato-κ^3^<i>H</i>,<i>H</i>',<i>H</i>'')(tetrahydrofuran-<i>O</i>)-samarium(III): a lanthanidocene complex with a tridentate tetrahydroborato ligand","Acta Crystallographica Section C","2000","56","1","48","49","10.1107/S0108270199013001","","","0.71073","MoKα","","0.039","0.0309","","","","0.0503","","","","","","1.005","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010539","17.4144","0.0016","10.6767","0.001","15.2187","0.0014","90","","90","","90","","2829.6","0.5","168","2","168","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","2,2'-bis(4,4-diphenyl-2,5-cyclohexadienone)diselenide","2,2'-Diselenobis(4,4-diphenylcyclohexa-2,5-dienone)","","- C36 H26 O2 Se2 -","- C36 H26 O2 Se2 -","- C144 H104 O8 Se8 -","4","0.5","JZ1370","Senthil Kumar, V. S.; Nangia, Ashwini; 2,2'-Diselenobis(4,4-diphenylcyclohexa-2,5-dienone)","2,2'-Diselenobis(4,4-diphenylcyclohexa-2,5-dienone)","Acta Crystallographica Section C","2000","56","1","123","124","10.1107/S0108270199012743","","","0.71073","MoKα","","0.038","0.031","","0.086","0.081","","","","1.06","1.093","1.093","","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010540","9.239","0.002","15.643","0.003","13.859","0.003","90","","102.37","0.02","90","","1956.5","0.7","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis[bis(2-amino-1,3-benzothiazole-N^3^)(μ-succinato-O,O',O'',O''')copper(II)]","","- C36 H32 Cu2 N8 O8 S4 -","- C36 H32 Cu2 N8 O8 S4 -","- C72 H64 Cu4 N16 O16 S8 -","2","0.5","KA1341","Sieroń, Lesław; Bukowska-Strzyżewska, Maria","Bis(μ-succinato-<i>O</i>,<i>O</i>':<i>O</i>'',<i>O</i>''')bis[bis(2-amino-1,3-benzothiazole-<i>N</i>^3^)copper(II)]","Acta Crystallographica Section C","2000","56","1","19","21","10.1107/S0108270199013013","","","0.71073","MoKα","","0.067","0.041","","","","0.09","","","","","","1.033","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010541","10.031","0.003","8.2799","0.0017","10.968","0.002","90","","99.274","0.002","90","","899","0.4","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Ammonium hydrogen squarate‒water (3/2)","","- C4 H6.33 N O4.67 -","- C4 H6.33333 N O4.66667 -","- C24 H38 N6 O28 -","6","1.5","LN1082","Kolev, Tsonko; Glavcheva, Zornitza; Petrova, Rosica; Angelova, Olyana","Ammonium hydrogen squarate‒water (3/2)","Acta Crystallographica Section C","2000","56","1","110","112","10.1107/S0108270199009415","","","0.71073","MoKα","","0.089","0.053","","","","0.146","","","","","","1.009","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010542","6.398","0.0004","9.7142","0.0005","35.119","0.004","90","","90","","90","","2182.7","0.3","293","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","3β-acetoxy-5α,6β-dihydroxy-bisnorcholanic acid 22\ρigtharrow16 lactone","","- C24 H36 O6 -","- C24 H36 O6 -","- C96 H144 O24 -","4","1","LN1086","Novoa de Armas, Héctor; Peeters, Oswald M.; Blaton, Norbert M.; De Ranter, Camiel J.; Pomés Hernández, Ramón; Mola, José L.; Serafín Pérez, Carlos; Suárez García, Leticia; Iglesias, Martín A.; Coll Manchado, Francisco","3β-Acetoxy-5α,6β-dihydroxybisnorcholanic acid 22→16 lactone","Acta Crystallographica Section C","2000","56","1","78","79","10.1107/S0108270199011300","","","1.54184","CuKα","","0.0485","0.0457","","0.1329","","0.1329","","","1.051","","","1.051","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010543","5.1813","0.0011","9.2173","0.0018","10.6278","0.0017","87.878","0.014","74.948","0.016","86.653","0.017","489.18","0.17","293","2","293","2","","","","","","","","5","P 1","P 1","1","","L-argininium fluoride hydrogen fluoride","","- C6 H16 F2 N4 O2 -","- C6 H16 F2 N4 O2 -","- C12 H32 F4 N8 O4 -","2","2","LN1087","Ramos Silva, M.; Paixão, J. A.; Matos Beja, A.; Alte da Veiga, L.","Very short F—H···F hydrogen bond in <small>L</small>-argininium fluoride hydrogen fluoride","Acta Crystallographica Section C","2000","56","1","104","106","10.1107/S0108270199011981","","","0.71073","MoKα","","0.049","0.034","","","","0.094","","","","","","1.093","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010544","8.571","0.0007","6.4665","0.0003","9.8502","0.0008","90","","106.783","0.003","90","","522.69","0.07","291","1","291","1","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C10 H20 O2 -","- C10 H20 O2 -","- C20 H40 O4 -","2","1","NA1422","Körner, Ferdinand; Schürmann, Markus; Preut, Hans; Kreiser, Wolfgang","({-})-(1<i>R</i>,2<i>S</i>,2'<i>R</i>,5<i>R</i>)-2-(1-Hydroxyprop-2-yl)-5-methylcyclohexanol","Acta Crystallographica Section C","2000","56","1","74","75","10.1107/S0108270199014122","","","0.71069","MoKα","","0.085","0.05","","","","0.187","","","","","","0.721","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010545","7.5296","0.0011","13.7209","0.0019","11.7587","0.0016","90","","90","","90","","1214.8","0.3","293","2","293","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","bis[chloro(1,3-imidazolium-2-thiolato-S)]mercury(II)","","- C6 H8 Cl2 Hg N4 S2 -","- C6 H8 Cl2 Hg N4 S2 -","- C24 H32 Cl8 Hg4 N16 S8 -","4","1","NA1432","Pavlović, Gordana; Popović, Zora; Soldin, Željka; Matković-Čalogović, Dubravka","A 1:2 complex of mercury(II) chloride with 1,3-imidazole-2-thione","Acta Crystallographica Section C","2000","56","1","61","63","10.1107/S0108270199013736","","","0.71073","MoKα","","0.079","0.03","","","","0.064","","","","","","0.897","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010546","8.3695","0.0011","8.5208","0.0011","11.7567","0.0016","101.532","0.002","97.517","0.002","109.958","0.003","753.91","0.17","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","","","- C13 H12 Cl2 Fe N3 O3 -","- C13 H12 Cl2 Fe N3 O3 -","- C26 H24 Cl4 Fe2 N6 O6 -","2","1","OA1093","Kajiwara, Takashi; Ito, Tasuku","[Fe(C~12~H~8~N~3~O~2~)Cl~2~(<i>R</i>OH)], with <i>R</i> = Me and Et","Acta Crystallographica Section C","2000","56","1","22","23","10.1107/S010827019901272X","","","0.71073","MoKα","","0.048","0.035","","","","0.09","","","","","","0.99","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010547","8.5609","0.0006","8.5998","0.0006","12.0245","0.0009","99.744","0.001","99.944","0.001","110.483","0.001","791.13","0.1","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H14 Cl2 Fe N3 O3 -","- C14 H14 Cl2 Fe N3 O3 -","- C28 H28 Cl4 Fe2 N6 O6 -","2","1","OA1093","Kajiwara, Takashi; Ito, Tasuku","[Fe(C~12~H~8~N~3~O~2~)Cl~2~(<i>R</i>OH)], with <i>R</i> = Me and Et","Acta Crystallographica Section C","2000","56","1","22","23","10.1107/S010827019901272X","","","0.71073","MoKα","","0.033","0.028","","","","0.075","","","","","","1.027","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010548","10.765","0.002","10.923","0.002","9.82","0.001","105.43","0.01","106.5","0.01","88.43","0.01","1065.8","0.3","299","","","","","","","","","","","4","P -1","-P 1","2","","tetrakis(μ-3,3-dimethylbutyrato-O:O')di(ethanol-O)dicopper(II) diethanol solvate","","- C32 H68 Cu2 O12 -","- C32 H56 Cu2 O12 -","- C32 H56 Cu2 O12 -","1","0.5","OA1094","Goto, Masato; Kani, Yoshiyuki; Tsuchimoto, Masanobu; Ohba, Shigeru; Matsushima, Hideaki; Tokii, Tadashi","Dimeric copper(II) 3,3-dimethylbutyrate adducts with ethanol, 2-methylpyridine, 3-methylpyridine, 4-methylpyridine and 3,3-dimethylbutyric acid","Acta Crystallographica, Section C: Crystal Structure Communications","2000","56","1","7","11","10.1107/s0108270199012172","","","0.71073","MoKα","","","0.076","","","","0.077","","","","","","1.44","","","","has coordinates","210928","2020-10-21","18:00:00",""
"2010549","10.04","0.002","18.468","0.001","11.649","0.001","90","","109.16","0.01","90","","2040.3","0.4","299","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C36 H58 Cu2 N2 O8 -","- C36 H58 Cu2 N2 O8 -","- C72 H116 Cu4 N4 O16 -","2","0.5","","Goto, Masato; Kani, Yoshiyuki; Tsuchimoto, Masanobu; Ohba, Shigeru; Matsushima, Hideaki; Tokii, Tadashi","Dimeric copper(II) 3,3-dimethylbutyrate adducts with ethanol, 2-methylpyridine, 3-methylpyridine, 4-methylpyridine and 3,3-dimethylbutyric acid","Acta Crystallographica, Section C: Crystal Structure Communications","2000","56","1","7","11","10.1107/s0108270199012172","","","","","","","","","","","","","","","","","","","","","has coordinates","210928","2020-10-21","18:00:00",""
"2010550","10.603","0.002","11.216","0.002","10.289","0.001","105.8","0.01","101.01","0.01","63.11","0.01","1046.7","0.3","299","","","","","","","","","","","5","P -1","-P 1","2","","","","- C36 H58 Cu2 N2 O8 -","- C36 H58 Cu2 N2 O8 -","- C36 H58 Cu2 N2 O8 -","1","0.5","","Goto, Masato; Kani, Yoshiyuki; Tsuchimoto, Masanobu; Ohba, Shigeru; Matsushima, Hideaki; Tokii, Tadashi","Dimeric copper(II) 3,3-dimethylbutyrate adducts with ethanol, 2-methylpyridine, 3-methylpyridine, 4-methylpyridine and 3,3-dimethylbutyric acid","Acta Crystallographica, Section C: Crystal Structure Communications","2000","56","1","7","11","10.1107/s0108270199012172","","","","","","","","","","","","","","","","","","","","","has coordinates","210928","2020-10-21","18:00:00",""
"2010551","11.346","0.002","18.584","0.003","10.606","0.002","90.44","0.01","101.4","0.01","74.8","0.01","2113.2","0.6","297","","","","","","","","","","","5","P -1","-P 1","2","","","","- C36 H58 Cu2 N2 O8 -","- C36 H58 Cu2 N2 O8 -","- C72 H116 Cu4 N4 O16 -","2","1","","Goto, Masato; Kani, Yoshiyuki; Tsuchimoto, Masanobu; Ohba, Shigeru; Matsushima, Hideaki; Tokii, Tadashi","Dimeric copper(II) 3,3-dimethylbutyrate adducts with ethanol, 2-methylpyridine, 3-methylpyridine, 4-methylpyridine and 3,3-dimethylbutyric acid","Acta Crystallographica, Section C: Crystal Structure Communications","2000","56","1","7","11","10.1107/s0108270199012172","","","","","","","","","","","","","","","","","","","","","has coordinates","210928","2020-10-21","18:00:00",""
"2010552","10.89","0.002","18.211","0.002","11.787","0.001","90","","103.98","0.01","90","","2268.2","0.5","297","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C36 H68 Cu2 O12 -","- C36 H68 Cu2 O12 -","- C72 H136 Cu4 O24 -","2","0.5","","Goto, Masato; Kani, Yoshiyuki; Tsuchimoto, Masanobu; Ohba, Shigeru; Matsushima, Hideaki; Tokii, Tadashi","Dimeric copper(II) 3,3-dimethylbutyrate adducts with ethanol, 2-methylpyridine, 3-methylpyridine, 4-methylpyridine and 3,3-dimethylbutyric acid","Acta Crystallographica, Section C: Crystal Structure Communications","2000","56","1","7","11","10.1107/s0108270199012172","","","","","","","","","","","","","","","","","","","","","has coordinates","210928","2020-10-21","18:00:00",""
"2010553","11.392","0.001","18.508","0.002","10.851","0.001","91.87","0.01","102.79","0.01","76.82","0.01","2171.9","0.4","299","","","","","","","","","","","6","P -1","-P 1","2","","tetrakis(μ-trimethylsilylacetato-O:O')di(pyridine-N)dicopper(II)","","- C30 H54 Cu2 N2 O8 Si4 -","- C30 H54 Cu2 N2 O8 Si4 -","- C60 H108 Cu4 N4 O16 Si8 -","2","1","OA1095","Nakagawa, Hiroo; Kani, Yoshiyuki; Tsuchimoto, Masanobu; Ohba, Shigeru; Matsushima, Hideaki; Tokii, Tadashi","Dimeric copper(II) trimethylsilylacetate adducts with pyridine, 2-methylpyridine, 3-methylpyridine and quinoline, and a polymeric copper(II) trimethylsilylacetate","Acta Crystallographica Section C","2000","56","1","12","16","10.1107/S0108270199012147","","","0.71073","MoKα","","","0.068","","","","0.053","","","","","","1.34","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010554","10.874","0.002","11.508","0.002","10.33","0.002","104.26","0.02","109.1","0.02","74.91","0.02","1160.9","0.4","298","","298","","","","","","","","","6","P -1","-P 1","2","","tetrakis(μ-trimethylsilylacetato-O:O')di(2-methylpyridine-N)dicopper(II)","","- C32 H58 Cu2 N2 O8 Si4 -","- C32 H58 Cu2 N2 O8 Si4 -","- C32 H58 Cu2 N2 O8 Si4 -","1","0.5","OA1095","Nakagawa, Hiroo; Kani, Yoshiyuki; Tsuchimoto, Masanobu; Ohba, Shigeru; Matsushima, Hideaki; Tokii, Tadashi","Dimeric copper(II) trimethylsilylacetate adducts with pyridine, 2-methylpyridine, 3-methylpyridine and quinoline, and a polymeric copper(II) trimethylsilylacetate","Acta Crystallographica Section C","2000","56","1","12","16","10.1107/S0108270199012147","","","0.71073","MoKα","","","0.051","","","","0.079","","","","","","1.39","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2010555","11.148","0.003","11.755","0.001","10.563","0.003","110.91","0.01","117.7","0.02","84.23","0.02","1141.3","0.5","297","","","","","","","","","","","6","P -1","-P 1","2","","tetrakis(μ-trimethylsilylacetato-O:O')di(3-methylpyridine-N)dicopper(II)","","- C32 H58 Cu2 N2 O8 Si4 -","- C32 H58 Cu2 N2 O8 Si4 -","- C32 H58 Cu2 N2 O8 Si4 -","1","0.5","OA1095","Nakagawa, Hiroo; Kani, Yoshiyuki; Tsuchimoto, Masanobu; Ohba, Shigeru; Matsushima, Hideaki; Tokii, Tadashi","Dimeric copper(II) trimethylsilylacetate adducts with pyridine, 2-methylpyridine, 3-methylpyridine and quinoline, and a polymeric copper(II) trimethylsilylacetate","Acta Crystallographica Section C","2000","56","1","12","16","10.1107/S0108270199012147","","","0.71073","MoKα","","","0.064","","","","0.054","","","","","","1.23","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010556","11.298","0.002","11.495","0.003","10.261","0.003","104.03","0.02","110.1","0.02","76.99","0.02","1199.3","0.5","298","","298","","","","","","","","","6","P -1","-P 1","2","","tetrakis(μ-trimethylsilylacetato-O:O')di(quinoline-N)dicopper(II)","","- C38 H58 Cu2 N2 O8 Si4 -","- C38 H58 Cu2 N2 O8 Si4 -","- C38 H58 Cu2 N2 O8 Si4 -","1","0.5","OA1095","Nakagawa, Hiroo; Kani, Yoshiyuki; Tsuchimoto, Masanobu; Ohba, Shigeru; Matsushima, Hideaki; Tokii, Tadashi","Dimeric copper(II) trimethylsilylacetate adducts with pyridine, 2-methylpyridine, 3-methylpyridine and quinoline, and a polymeric copper(II) trimethylsilylacetate","Acta Crystallographica Section C","2000","56","1","12","16","10.1107/S0108270199012147","","","0.71073","MoKα","","","0.048","","","","0.069","","","","","","1.18","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2010557","10.288","0.006","24.692","0.005","13.116","0.005","90","","97.71","0.04","90","","3302","2","298","","298","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","catena-poly[tetrakis(μ-trimethylsilylacetato-O:O')dicopper(II)]","","- C20 H44 Cu2 O8 Si4 -","- C20 H44 Cu2 O8 Si4 -","- C80 H176 Cu8 O32 Si16 -","4","1","OA1095","Nakagawa, Hiroo; Kani, Yoshiyuki; Tsuchimoto, Masanobu; Ohba, Shigeru; Matsushima, Hideaki; Tokii, Tadashi","Dimeric copper(II) trimethylsilylacetate adducts with pyridine, 2-methylpyridine, 3-methylpyridine and quinoline, and a polymeric copper(II) trimethylsilylacetate","Acta Crystallographica Section C","2000","56","1","12","16","10.1107/S0108270199012147","","","0.71073","MoKα","","","0.068","","","","0.0999","","","","","","1.484","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2010558","9.105","0.002","35.679","0.007","6.784","0.0014","90","","99.28","0.03","90","","2175","0.8","193","2","193","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","9-(Dodecylthio)phenanthrene","","- C26 H34 S -","- C26 H34 S -","- C104 H136 S4 -","4","1","OS1072","Kansikas, Jarno; Sipilä, Kaija","Two 9-alkylthiophenanthrenes at 193K (alkyl = dodecyl and tetradecyl)","Acta Crystallographica Section C","2000","56","1","69","71","10.1107/S0108270199012871","","","1.5418","CuKα","","0.0655","0.0493","","0.1444","","0.1183","","","1.102","","","1.136","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010559","9.1","0.0014","38.696","0.002","6.804","0.008","90","0.03","99.67","0.03","90","0.03","2362","3","193","2","193","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C28 H38 S -","- C28 H38 S -","- C112 H152 S4 -","4","1","OS1072","Kansikas, Jarno; Sipilä, Kaija","Two 9-alkylthiophenanthrenes at 193K (alkyl = dodecyl and tetradecyl)","Acta Crystallographica Section C","2000","56","1","69","71","10.1107/S0108270199012871","","","1.5418","CuKα","","0.1601","0.0687","","0.1829","","0.1416","","","1.038","","","1.177","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010560","8.833","0.0018","16.833","0.003","14.335","0.003","90","","102.65","0.03","90","","2079.7","0.8","193","2","193","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Di-9-anthryl disulfide","","- C28 H18 S2 -","- C28 H18 S2 -","- C112 H72 S8 -","4","1","OS1075","Kansikas, Jarno; Sipilä, Kaija","Di-9-anthryl disulfide at 193K","Acta Crystallographica Section C","2000","56","1","72","73","10.1107/S0108270199012846","","","1.5418","CuKα","","0.071","0.055","","","","0.156","","","","","","1.027","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010561","22.9235","0.0007","9.9309","0.0005","12.8363","0.0007","90","0.01","101.078","0.003","90","0.01","2867.7","0.2","298","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C33 H38 N4 O2 -","- C33 H38 N4 O2 -","- C132 H152 N16 O8 -","4","1","QA0187","Baouid, A.; Hasnaoui, H.; Benharref, A.; Aatif, A.; Essaber, M.; Lavergne, J. P.; Pierrot, M.","3,3'-Dimesityl-7-methyl-9a-phenyl-4,4',5,5',6,8,9,9a-octahydro-7<i>H</i>-1,2,4-oxadiazolo[4,5-<i>d</i>][1,4]diazepine-8-spiro-5'-isoxazole","Acta Crystallographica Section C","2000","56","1","e25","e26","10.1107/S0108270199016091","","","0.71073","MoKα","","","0.073","","","","0.083","","","","","","1.575","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010562","13.9224","0.0004","9.959","0.0002","25.6952","0.0006","90","","104.518","0.0014","90","","3448.96","0.15","150","0.1","150","0.1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","tetra(neophyl)tin","tetrakis(2-methyl-2-phenylpropyl)stannane","","- C40 H52 Sn -","- C40 H52 Sn -","- C160 H208 Sn4 -","4","1","QA0190","Low, John Nicolson; Wardell, J. L","Tetrakis(2-methyl-2-phenylpropyl)stannane at 150K","Acta Crystallographica Section C","2000","56","1","e3","e3","10.1107/S010827019901598X","","","0.71073","MoKα","","0.075","0.038","","","","0.088","","","","","","0.989","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010563","8.999","0.002","10.456","0.004","10.622","0.004","69.218","0.012","79.2","0.02","67.07","0.02","859.2","0.5","123","1","123","1","","","","","","","","2","P -1","-P 1","2","Hexabenyzlbenzene","","","- C48 H42 -","- C48 H42 -","- C48 H42 -","1","0.5","QA0192","Frampton, Christopher S.; Gall, James H.; MacNicol, David D.","Hexabenzylbenzene","Acta Crystallographica Section C","2000","56","1","e22","e22","10.1107/S0108270199016005","","","0.71073","MoKα","","0.043","0.038","","","","0.111","","","","","","1.008","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010564","7.9739","0.0001","14.1721","0.0002","20.3772","0.0002","90","","90","","90","","2302.76","0.05","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","Bis(2-Bromobenzaldehyde S-methyl dithiocabazate)Pt(II)","Bis(2-Bromobenzaldehyde S-methyl dithiocabazate)Pt(II)","","- C18 H16 Br2 N4 Pt S4 -","- C18 H16 Br2 N4 Pt S4 -","- C72 H64 Br8 N16 Pt4 S16 -","4","0.5","QA0193","Shanmuga Sundara Raj, S.; Fun, Hoong-Kun; Zhu, Xu-Hui; Xu, Yan; Chen, Xiao-Feng; You, Xiao-Zeng","Bis[<i>S</i>-methyl 3-(2-bromobenzylidene)dithiocabazato-<i>N</i>^3^,<i>S</i>]platinum(II)","Acta Crystallographica Section C","2000","56","1","e6","e7","10.1107/S010827019901611X","","","0.71073","MoKα","","0.044","0.03","","","","0.084","","","","","","1.071","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010565","9.1857","0.0018","9.6334","0.0019","10.379","0.002","72.44","0.03","88.5","0.03","68.19","0.03","809.1","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Trans-dichlorobis(triphenylphosphine-P)platinum(II)","","","- C36 H30 Cl2 P2 Pt -","- C36 H30 Cl2 P2 Pt -","- C36 H30 Cl2 P2 Pt -","1","0.5","","Johansson, Maria H.; Otto, Stefanus","trans-Dichlorobis(triphenylphosphine-P)platinum(II)","Acta Crystallographica, Section C","2000","56","","e12","e15","10.1107/S010827019901608X","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2010566","9.1857","0.0018","9.6334","0.0019","10.379","0.002","72.44","0.03","88.5","0.03","68.19","0.03","809.1","0.3","293","2","","","","","","","","","","5","P -1","-P 1","2","","","","- C36 H30 Cl2 P2 Pt -","- C36 H30 Cl2 P2 Pt -","- C36 H30 Cl2 P2 Pt -","1","0.5","","Johansson, Maria H.; Otto, Stefanus","trans-Dichlorobis(triphenylphosphine-P)platinum(II)","Acta Crystallographica, Section C","2000","56","","e12","e15","10.1107/S010827019901608X","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2010567","11.903","0.001","10.895","0.002","10.343","0.001","90","","109.76","0.01","90","","1262.3","0.3","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","6-Cyano-2,3-dihydro-2-(tertiobutyloxy)methyl-5H-oxazolo[3,2-a]pyrimidin-5-one,","","- C12 H15 N3 O3 -","- C12 H15 N3 O3 -","- C48 H60 N12 O12 -","4","1","QA0195","Chaimbault, Corinne; Leger, Jean Michel; Bosc, Jean-Jacques; Jarry, Christian","2-<i>tert</i>-Butyloxymethyl-6-cyano-2,3-dihydro-5<i>H</i>-oxazolo[3,2-<i>a</i>]pyrimidin-5-one","Acta Crystallographica Section C","2000","56","1","e29","e30","10.1107/S0108270199016285","","","1.54178","CuKα","","0.104","0.057","","0.16","","0.1312","","","1.033","","","1.12","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010568","7.355","0.002","8.291","0.003","14.374","0.005","95.78","0.04","98.68","0.04","98.51","0.04","850.1","0.5","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","Morpholinium-dimorpholidodithiophosphate","","- C12 H26 N3 O3 P S2 -","- C12 H26 N3 O3 P S2 -","- C24 H52 N6 O6 P2 S4 -","2","1","QA0196","Ziemer, Burkhard; Rabis, Annegrit","Morpholinium dimorpholinidodithiophosphate","Acta Crystallographica Section C","2000","56","1","e33","e33","10.1107/S010827019901639X","","","0.71073","MoKα","","0.096","0.057","","0.153","","0.137","","","0.903","","","1.04","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010569","9.552","0.003","11.853","0.007","15.615","0.004","90","","96.47","0.02","90","","1756.7","1.3","294","","294","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H30 N O3 P -","- C14 H30 N O3 P -","- C56 H120 N4 O12 P4 -","4","1","QA0197","Amedjkouh, Mohamed; Grimaldi, Jacques; Reboul, Jean-Pierre; Siri, Didier","Diethyl [(2<i>RS</i>,5<i>RS</i>)-5-isopropyl-2,3,3-trimethylpyrrolidin-2-yl]phosphonate","Acta Crystallographica Section C","2000","56","1","e31","e32","10.1107/S0108270199016303","","","0.71073","MoKα","","0.107","0.049","","","","0.069","","","","","","1.167","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2010570","9.855","0.002","17.306","0.003","10.607","0.002","90","","114.29","0.01","90","","1648.9","0.6","296","2","296","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","none","2,11,13,21,29,31-hexamethyl-5,16,24-triaza-8,19,27-triazoniaheptacyclo- [10.10.6.1^1,3^.1^5,8^.1^10,14^.1^16,19^.1^24,27^]tritriaconta- 1,3(29),6,8(30),10,12,14(31),17,19(32),21,25,27(33)-dodecene tribromide dihydrate","","- C33 H43 Br3 N6 O2 -","- C33 H43 Br3 N6 O2 -","- C66 H86 Br6 N12 O4 -","2","0.5","QA0198","Yuan, Yi; Zhou, Haibing; Jiang, Zhonlin; Yan, Jiaming; Xie, Rugang","A new tribridged imidazolium cyclophane","Acta Crystallographica Section C","2000","56","1","e34","e35","10.1107/S0108270199016406","","","0.71073","MoKα","","0.06","0.034","","","","0.073","","","","","","0.884","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010571","7.67","0.003","19.766","0.005","13.759","0.003","90","","90.63","0.03","90","","2085.8","1.1","100","","100","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-nitro-N,N-bis(2-nitrophenylthio)benzenesulfonamide","","- C18 H12 N4 O8 S3 -","- C18 H12 N4 O8 S3 -","- C72 H48 N16 O32 S12 -","4","1","QB0136","Oguz, Umut; McLaughlin, Mark L.; Fronczek, Frank R.","2-Nitro-<i>N,N</i>-bis(2-nitrophenylthio)benzenesulfonamide","Acta Crystallographica Section C","2000","56","1","e27","e28","10.1107/S0108270199016121","","","0.71073","Mo-Kα","","0.062","0.038","","0.081","","0.04","","","1.32","","","1.483","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010572","9.717","0.002","9.495","0.001","17.542","0.003","90","","97.13","0.01","90","","1606","0.5","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(1R,2R)-N,N-bis(8-quinoline sulfonylamino)-1,2-diphenylethylenediamine acetone (1\1)","","- C35 H32 N4 O5 S2 -","- C35 H26.006 N4 O5 S2 -","- C70 H52.012 N8 O10 S4 -","2","1","QB0144","Dong, Chune; Zhang, Junlong; Zhang, Liangfu; Yu, Zuolong","(1<i>R</i>,2<i>R</i>)-1,2-Diphenyl-1,2-bis(8-quinolinesulfonylamino)ethylenediamine‒acetone (1/1)","Acta Crystallographica Section C","2000","56","1","e21","e21","10.1107/S0108270199015991","","","0.71073","MoKα","","0.0415","0.0319","","","","0.0742","","","","","","0.944","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010573","6.9804","0.0008","19.256","0.002","26.131","0.003","90","","90","","90","","3512.4","0.7","293","2","293","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C7 H11 Br N2 -","- C7 H11 Br N2 -","- C112 H176 Br16 N32 -","16","0.5","QB0146","Mayr-Stein, Ralf; Bolte, Michael","4-Dimethylaminopyridinium bromide","Acta Crystallographica Section C","2000","56","1","e19","e20","10.1107/S0108270199016133","","","0.71073","MoKα","","0.064","0.036","","","","0.1","","","","","","1.018","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2010574","10.8971","0.0001","17.7367","0.0001","16.7252","0.0002","90","","94.793","0.001","90","","3221.32","0.05","203","2","203","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[bis(diphenylphosphino)methane](pentane-2,4-dithionato-S,S')nickel(II) hexafluorophosphate","","- C30 H29 F6 Ni P3 S2 -","- C30 H29 F6 Ni P3 S2 -","- C120 H116 F24 Ni4 P12 S8 -","4","1","QB0153","Boyd, Peter D. W.; Rickard, Clifton E. F.; Cavell, Kingsley J.","[Bis(diphenylphosphino)alkane](pentane-2,4-dithionato) complexes of nickel(II)","Acta Crystallographica Section C","2000","56","1","e16","e18","10.1107/S0108270199016078","","","0.71073","MoKα","","0.037","0.03","","","","0.083","","","","","","1.014","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010575","11.0458","0.0002","13.485","0.0002","14.5828","0.0001","67.386","0.001","76.105","0.001","72.088","0.001","1889.5","0.05","203","2","203","2","","","","","","","","6","P -1","-P 1","2","","Pentane-2,4-dithione[bis(diphenylphosphino)ethane]nickel(II) hexafluorophosphate.","","- C31 H31 F6 Ni P3 S2 -","- C31 H31 F6 Ni P3 S2 -","- C62 H62 F12 Ni2 P6 S4 -","2","1","QB0153","Boyd, Peter D. W.; Rickard, Clifton E. F.; Cavell, Kingsley J.","[Bis(diphenylphosphino)alkane](pentane-2,4-dithionato) complexes of nickel(II)","Acta Crystallographica Section C","2000","56","1","e16","e18","10.1107/S0108270199016078","","","0.71073","MoKα","","0.052","0.039","","","","0.104","","","","","","1.038","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010576","10.0345","0.0002","15.8632","0.0002","10.8058","0.0002","90","","94.14","","90","","1715.57","0.05","203","2","203","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","Pentane-2,4-dithione[bis(diphenylphosphino)propane]nickel(II) hexafluorophosphate.","","- C32 H33 F6 Ni P3 S2 -","- C32 H33 F6 Ni P3 S2 -","- C64 H66 F12 Ni2 P6 S4 -","2","0.5","QB0153","Boyd, Peter D. W.; Rickard, Clifton E. F.; Cavell, Kingsley J.","[Bis(diphenylphosphino)alkane](pentane-2,4-dithionato) complexes of nickel(II)","Acta Crystallographica Section C","2000","56","1","e16","e18","10.1107/S0108270199016078","","","0.71073","MoKα","","0.0505","0.0346","","","","0.0952","","","","","","0.998","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010577","8.6967","0.0017","4.2205","0.0008","10.574","0.002","90","","90","","90","","388.11","0.13","293","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","Bismuth Selenide Iodide","Bismuth Selenide Iodide","","- Bi I Se -","- Bi I Se -","- Bi4 I4 Se4 -","4","0.5","QB0155","Braun, Thomas P.; DiSalvo, Francis J.","Bismuth selenide iodide","Acta Crystallographica Section C","2000","56","1","e1","e2","10.1107/S0108270199016017","","","0.71073","MoKα","","0.049","0.047","","","","0.123","","","","","","1.198","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010578","5.2729","0.0001","11.6565","0.0003","7.8383","0.0002","90","","94.011","0.001","90","","480.59","0.02","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","taurine","2-amino-ethanesulfonic acid","","- C2 H7 N O3 S -","- C2 H7 N O3 S -","- C8 H28 N4 O12 S4 -","4","1","QB0156","Görbitz, Carl Henrik; Prydz, Kristian; Ugland, Sigurd","Taurine","Acta Crystallographica Section C","2000","56","1","e23","e24","10.1107/S0108270199016029","","","0.71073","MoKα","","0.028","0.026","","","","0.075","","","","","","1.126","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010579","16.935","0.003","9.0806","0.0007","14.987","0.003","90","","90","","90","","2304.7","0.6","190","2","190","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C20 H16 N7 Nd O9 -","- C20 H16 N7 Nd O9 -","- C80 H64 N28 Nd4 O36 -","4","0.5","QB0157","Bower, John F.; Cotton, Simon A.; Fawcett, John; Russell, David R.","Bis(2,2'-bipyridyl-<i>N</i>,<i>N</i>')tris(nitrato-<i>O</i>,<i>O</i>')neodymium","Acta Crystallographica Section C","2000","56","1","e8","e9","10.1107/S0108270199016157","","","0.71073","MoKα","","0.068","0.047","","","","0.129","","","","","","2.23","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010580","7.3152","0.0003","7.5917","0.0004","12.3024","0.0006","86.661","0.003","73.172","0.003","81.79","0.03","647.15","0.07","150","0.1","150","0.1","","","","","","","","5","P -1","-P 1","2","","Hexaaquomagnesium(II) di[N-(6-amino-3,4-dihydro-3-methyl-5-nitroso-4-oxo- pyrimidin-2-yl)glycinate] dihydrate","","- C14 H32 Mg N10 O16 -","- C14 H32 Mg N10 O16 -","- C14 H32 Mg N10 O16 -","1","0.5","QB0158","Arranz Mascarós, P.; Cobo Domingo, Justo; Godino Salido, M.; Gutiérrez Valero, M. D.; López Garzón, R.; Low, John Nicolson","Hexaaquamagnesium(II) bis[<i>N</i>-(6-amino-3,4-dihydro-3-methyl-5-nitroso-4-oxopyrimidin-2-yl)glycinate] dihydrate","Acta Crystallographica Section C","2000","56","1","e4","e5","10.1107/S0108270199016145","","","0.71073","MoKα","","0.0498","0.0384","","","","0.1099","","","","","","1.061","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010581","18.359","0.004","6.898","0.001","18.256","0.004","90","","110.62","0.02","90","","2163.8","0.8","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","[Bis-(salicylaldeneamino-3- propanolato)manganese(III)] perchlorate","","- C20 H24 Cl Mn N2 O8 -","- C20 H24 Cl Mn N2 O8 -","- C80 H96 Cl4 Mn4 N8 O32 -","4","0.5","QB0160","Zhang, Cungen; Wu, Dan; Sun, Jie; Kong, Xiangfu","Bis[3-(salicylideneamino-<i>O</i>,<i>N</i>)propanolato]manganese(III) perchlorate","Acta Crystallographica Section C","2000","56","1","e10","e11","10.1107/S0108270199016273","","","0.7107","MoKα","","","0.039","","","","0.048","","","","","","1.52","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2010582","6.292","0.001","7.735","0.001","6.745","0.003","90","","90.8","0.01","90","","328.24","0.16","157","","157","1","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","chlorotrimethylsilane","","- C3 H9 Cl Si -","- C3 H9 Cl Si -","- C6 H18 Cl2 Si2 -","2","0.5","SK1303","Buschmann, Jürgen; Lentz, Dieter; Luger, Peter; Röttger, Matthias","Chlorotrimethylsilane","Acta Crystallographica Section C","2000","56","1","121","122","10.1107/S0108270199012470","","","0.7107","MoKα","","0.066","0.037","","","","0.096","","","","","","1.122","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010583","6.2171","0.0006","12.5197","0.0009","12.2224","0.0009","90","","97.225","0.005","90","","943.79","0.13","291","1","291","1","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C20 H28 O4 -","- C20 H28 O4 -","- C40 H56 O8 -","2","1","SK1308","Körner, Ferdinand; Schürmann, Markus; Preut, Hans; Kreiser, Wolfgang","(1<i>R</i>,2<i>R</i>)-2-(4-Methylenecyclohex-2-enyl)propyl (1<i>R</i>,4<i>S</i>)-camphanate","Acta Crystallographica Section C","2000","56","1","76","77","10.1107/S0108270199012561","","","0.71069","MoKα","","0.0477","0.0336","","","","0.086","","","","","","0.997","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010584","9.7666","0.0019","5.7576","0.0012","19.754","0.003","90","","94.905","0.014","90","","1106.7","0.4","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Folpet","2-[(trichloromethyl)thio]-1H-isoindole-1,3(2H)-dione","","- C9 H4 Cl3 N O2 S -","- C9 H4 Cl3 N O2 S -","- C36 H16 Cl12 N4 O8 S4 -","4","1","SX1096","Carle, A. Björn; Krause Bauer, Jeanette A.; Wilson, R. Marshall","2-Trichloromethylthio-1<i>H</i>-isoindole-1,3(2<i>H</i>)-dione (Folpet)","Acta Crystallographica Section C","2000","56","1","97","98","10.1107/S0108270199013074","","","0.71073","MoKα","","0.15","0.061","","","","0.157","","","","","","1.1","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010585","8.428","0.001","16.863","0.001","11.869","0.001","90","","98.86","0.01","90","","1666.7","0.3","295","2","295","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Potassium Bis(ethylenediamine)copper(II) Ferricyanide","","- C10 H16 Cu Fe K N10 -","- C10 H16 Cu Fe K N10 -","- C40 H64 Cu4 Fe4 K4 N40 -","4","0.5","TA1254","Kang, Bei-Sheng; Tong, Ye-Xiang; Yu, Kai-Bei; Su, Cheng-Yong; Zhang, Hua-Xin","Potassium bis(ethylenediamine)copper(II) ferricyanide","Acta Crystallographica Section C","2000","56","1","40","41","10.1107/S0108270199010173","","","0.71073","MoKα","","0.034","0.027","","","","0.068","","","","","","0.966","","","","has coordinates,has disorder","176760","2020-10-21","18:00:00",""
"2010586","6.843","0.004","12.553","0.007","8.076","0.005","90","0.008","111.37","0.008","90","","646","0.7","158","2","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C4 H14 Br2 Co N2 O4 -","- C4 H14 Br2 Co N2 O4 -","- C8 H28 Br4 Co2 N4 O8 -","2","0.5","TA1257","Depree, Craig V.; Ainscough, Eric W.; Brodie, Andrew M.; Gainsford, Graeme J.; Lensink, Cornelis","H···Br hydrogen bonding in <i>trans</i>-bis(acetonitrile-<i>N</i>)tetraaquacobalt(II) dibromide","Acta Crystallographica Section C","2000","56","1","17","18","10.1107/S0108270199012159","","","0.71073","MoKα","","0.0615","0.0384","","","","0.0869","","","","","","0.904","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2010587","9.6119","0.0001","13.4954","0.0001","18.514","0.003","90","","90","","90","","2401.6","0.4","203","2","203","2","","","","","","","","8","P n m a","-P 2ac 2n","62","","Bis(N,N'-dimethylimidazol-2-ylidene)mercury(II) Chlorotriiodomercurate(II) Dimethylsulphoxide solvate.","","- C12 H22 Cl Hg2 I3 N4 O S -","- C12 H22 Cl Hg2 I3 N4 O S -","- C48 H88 Cl4 Hg8 I12 N16 O4 S4 -","4","0.5","TA1265","Clark, Alex M.; Oliver, Allen G.; Rickard, Clifton E. F.; Wright, L. James; Roper, Warren R.","Bis(<i>N,N</i>'-dimethylimidazol-2-ylidene)mercury chlorotriiodomercury dimethyl sulfoxide solvate","Acta Crystallographica Section C","2000","56","1","26","27","10.1107/S0108270199012640","","","0.71073","MoKα","","0.0537","0.0383","","","","0.1099","","","","","","1.05","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010588","8.0507","0.0008","12.0791","0.0012","10.2946","0.0008","90","","97.954","0.008","90","","991.47","0.16","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","(-)-sparteine copper(II) diacetate","{1,3,4,7,7a,8,9,10,11,13,14,14a-dodecahydro-7,14-methano- 2H,6H-dipyrido[1,2-a:1',2'-e][1,5]diazocine-N,N'}bis(acetato- O,O')copper(II)","","- C19 H32 Cu N2 O4 -","- C19 H32 Cu N2 O4 -","- C38 H64 Cu2 N4 O8 -","2","1","TA1266","Lee, Yong-Min; Chung, Geewon; Kwon, Mi-A; Choi, Sung-Nak","({-})-Sparteine copper(II) diacetate","Acta Crystallographica Section C","2000","56","1","67","68","10.1107/S0108270199012160","","","0.71069","MoKα","","0.054","0.042","","","","0.101","","","","","","1.315","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010589","8.22","0.002","7.295","0.001","17.47","0.004","90","","100.97","0.02","90","","1028.4","0.4","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","1-(2,4,6-trimethylphenyl)tetrazole","1-(2,4,6-trimethylphenyl)tetrazole","","- C10 H12 N4 -","- C10 H12 N4 -","- C40 H48 N16 -","4","1","AV1031","Lyakhov, Alexander S.; Ivashkevich, Dmitri O.; Gaponik, Pavel N.; Grigoriev, Yuri V.; Ivashkevich, Ludmila S.","1-(2,4,6-Trimethylphenyl)-1<i>H</i>-1,2,3,4-tetrazole","Acta Crystallographica Section C","2000","56","2","256","257","10.1107/S0108270199014742","","","0.71069","MoKα","","0.0907","0.0528","","","","0.1901","","","","","","1.059","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010590","8.818","0.001","8.377","0.001","8.174","0.001","90","","108.51","0.01","90","","572.56","0.12","153","2","153","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,2,4,5-tetrakis(cyanomethyl)benzene","","- C14 H10 N4 -","- C14 H10 N4 -","- C28 H20 N8 -","2","0.5","BK1493","Jene, Paul G.; Ibers, James A.","Model porphyrin precursors: 1,2,4,5-tetrakis(cyanomethyl)benzene, methyl 3,4,5-triacetoxybenzoate and 2-(<i>N</i>-phthalimidomethyl)benzoic acid","Acta Crystallographica Section C","2000","56","2","246","249","10.1107/S0108270199014663","","","0.71073","MoKα","","0.079","0.044","","","","0.098","","","","","","1","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010591","9.2233","0.0007","11.747","0.001","13.936","0.001","90","","90.451","0.001","90","","1509.9","0.2","153","2","153","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","methyl 3,4,5-triacetoxybenzenoate","","- C14 H14 O8 -","- C14 H14 O8 -","- C56 H56 O32 -","4","1","BK1493","Jene, Paul G.; Ibers, James A.","Model porphyrin precursors: 1,2,4,5-tetrakis(cyanomethyl)benzene, methyl 3,4,5-triacetoxybenzoate and 2-(<i>N</i>-phthalimidomethyl)benzoic acid","Acta Crystallographica Section C","2000","56","2","246","249","10.1107/S0108270199014663","","","0.71073","MoKα","","0.05","0.043","","","","0.116","","","","","","1.84","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010592","12.125","0.001","13.72","0.001","7.7247","0.0008","90","","96.722","0.002","90","","1276.21","0.19","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H11 N O4 -","- C16 H11 N O4 -","- C64 H44 N4 O16 -","4","1","BK1493","Jene, Paul G.; Ibers, James A.","Model porphyrin precursors: 1,2,4,5-tetrakis(cyanomethyl)benzene, methyl 3,4,5-triacetoxybenzoate and 2-(<i>N</i>-phthalimidomethyl)benzoic acid","Acta Crystallographica Section C","2000","56","2","246","249","10.1107/S0108270199014663","","","0.71073","MoKα","","0.0539","0.036","","","","0.089","","","","","","1.102","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010593","13.344","0.005","14.393","0.004","11.683","0.002","93.51","0.03","110","0.02","64.19","0.02","1888","1","170","2","170","2","","","","","","","","5","P -1","-P 1","2","Tetrabutylbis(N-phthaloylglycinato)distannoxane dimer","octabutyl-1k^2^C,2k^2^C,3k^2^C,4k^2^C-bis-m~3~oxo- 1:2:3k^3^O;1:3:4k^3^O-tetrakis(m-phthalimidoacetato)- 1:2k^2^O;2:3k^2^O:O';3:4k^2^O;1:4k^2^O:O'-tetratin(IV)","","- C72 H96 N4 O18 Sn4 -","- C72 H96 N4 O18 Sn4 -","- C72 H96 N4 O18 Sn4 -","1","0.5","BK1497","Parvez, Masood; Anwar, Saeed; Badshah, Amin; Ahmad, Bashir; Majeed, Abdul; Ashfaq, Muhammad","Tetrabutylbis(<i>N</i>-phthaloylglycinato)distannoxane dimer","Acta Crystallographica Section C","2000","56","2","159","160","10.1107/S0108270199013591","","","0.7107","MoKα","","0.093","0.032","","","","0.082","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2010594","7.804","0.013","12.931","0.006","7.49","0.04","91.59","0.16","112.9","0.2","88.12","0.08","696","4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","4-Chloro-N-(4-cyano-2-nitrophenyl)-3-nitrobenzamide","","- C14 H7 Cl N4 O5 -","- C14 H7 Cl N4 O5 -","- C28 H14 Cl2 N8 O10 -","2","1","BM1358","Cronin, Leroy; Adams, Dave A.; Nightingale, David J.; Clark, James H.","4-Chloro-<i>N</i>-(4-cyano-2-nitrophenyl)-3-nitrobenzamide","Acta Crystallographica Section C","2000","56","2","244","245","10.1107/S0108270199014651","","","0.71069","MoKα","","0.088","0.046","","0.145","0.115","","","","1.053","1.092","1.092","","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010595","7.943","0.002","14.448","0.003","15.336","0.003","99.01","0.03","96.19","0.03","91.54","0.03","1726.4","0.7","150","","150","","","","","","","","","6","P -1","-P 1","2","","(1,2-benzisothiazol-3(2H)-one-1,1-dioxide)aquabis(1,10-phenanthroline) manganese(II)1,2-benzisothiazol-3(2H)-one-1,1-dioxide","","- C38 H26 Mn N6 O7 S2 -","- C38 H26 Mn N6 O7 S2 -","- C76 H52 Mn2 N12 O14 S4 -","2","1","BM1359","Deng, Robert M. K.; Bilton, Clair; Dillon, Keith B.; Howard, Judith A. K.","Two saccharinate complexes: [Mn(phen)~2~(sac)(H~2~O)]^+^·sac^{‒^} and [Co(bipy)~2~(sac)(H~2~O)]^+^·sac^{‒^}","Acta Crystallographica Section C","2000","56","2","142","145","10.1107/S0108270199012664","","","0.71073","MoKα","","0.069","0.04","","0.107","","0.095","","","","","","1.008","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010596","7.6982","0.0001","31.3359","0.0005","13.2179","0.0002","90","","93.272","0.001","90","","3183.36","0.08","150","","150","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(1,2-benzisothiazol-3(2H)-one-1,1-dioxide)aquabis(2,2'-bipyridine) cobalt(II)1,2-benzisothiazol-3(2H)-one-1,1-dioxide","","- C34 H26 Co N6 O7 S2 -","- C34 H26 Co N6 O7 S2 -","- C136 H104 Co4 N24 O28 S8 -","4","1","BM1359","Deng, Robert M. K.; Bilton, Clair; Dillon, Keith B.; Howard, Judith A. K.","Two saccharinate complexes: [Mn(phen)~2~(sac)(H~2~O)]^+^·sac^{‒^} and [Co(bipy)~2~(sac)(H~2~O)]^+^·sac^{‒^}","Acta Crystallographica Section C","2000","56","2","142","145","10.1107/S0108270199012664","","","0.71073","MoKα","","0.043","0.033","","0.073","","0.079","","","","","","1.147","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010597","7.162","0.002","8.2217","0.0015","13.807","0.004","98.1","0.02","99.4","0.02","102.51","0.02","769.8","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H14 N2 O4 -","- C19 H14 N2 O4 -","- C38 H28 N4 O8 -","2","1","BM1366","Kovalevsky, A. Yu.; Ponomarev, I. I.","A series of three bis[2-(methyl/trifluoromethyl)-4<i>H</i>-3,1-benzoxazin-4-one] compounds","Acta Crystallographica Section C","2000","56","2","260","262","10.1107/S0108270199014213","","","0.71073","MoKα","","0.096","0.037","","0.125","","0.098","","","0.905","","","1.189","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010598","25.643","0.017","5.206","0.002","16.211","0.01","90","","126.35","0.04","90","","1743","1.9","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C19 H8 F6 N2 O4 -","- C19 H8 F6 N2 O4 -","- C76 H32 F24 N8 O16 -","4","0.5","BM1366","Kovalevsky, A. Yu.; Ponomarev, I. I.","A series of three bis[2-(methyl/trifluoromethyl)-4<i>H</i>-3,1-benzoxazin-4-one] compounds","Acta Crystallographica Section C","2000","56","2","260","262","10.1107/S0108270199014213","","","0.71073","MoKα","","0.167","0.081","","0.471","","0.209","","","1.052","","","1.157","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010599","10.509","0.002","5.0144","0.0007","15.397","0.003","90","","95.35","0.02","90","","807.8","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H6 F6 N2 O4 -","- C18 H6 F6 N2 O4 -","- C36 H12 F12 N4 O8 -","2","0.5","BM1366","Kovalevsky, A. Yu.; Ponomarev, I. I.","A series of three bis[2-(methyl/trifluoromethyl)-4<i>H</i>-3,1-benzoxazin-4-one] compounds","Acta Crystallographica Section C","2000","56","2","260","262","10.1107/S0108270199014213","","","0.71073","MoKα","","0.077","0.049","","0.174","","0.146","","","1.075","","","1.248","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010600","7.067","0.004","9.783","0.005","11.44","0.006","90","","103.43","0.03","90","","769.3","0.7","220","2","220","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C5 H11 N3 S -","- C5 H11 N3 S -","- C20 H44 N12 S4 -","4","1","BM1372","Parsons, Simon; Smith, Andrew G.; Tasker, Peter A.; White, David J.","Acetone-4-methylthiosemicarbazone at 220K","Acta Crystallographica Section C","2000","56","2","237","238","10.1107/S0108270199014559","","","1.54178","CuKα","","0.0495","0.0431","","","","0.1221","","","","","","1.055","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010601","8.242","0.002","21.782","0.006","12.557","0.003","90","","119.292","0.014","90","","1966.1","0.9","150","","150","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Diaquatris(pentane-2,4-dionato-O,O')holmium(III) monohydrate","","- C15 H27 Ho O9 -","- C15 H27 Ho O9 -","- C60 H108 Ho4 O36 -","4","1","BM1374","Kooijman, Huub; Nijsen, Frank; Spek, Anthony L.; Schip, Fred van het","Diaquatris(pentane-2,4-dionato-<i>O</i>,<i>O</i>')holmium(III) monohydrate and diaquatris(pentane-2,4-dionato-<i>O</i>,<i>O</i>')holmium(III) 4-hydroxypentan-2-one solvate dihydrate","Acta Crystallographica Section C","2000","56","2","156","158","10.1107/S0108270199013566","","","0.71073","MoKα","","0.056","0.042","","","","0.099","","","","","","1.151","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010602","11.4903","0.0011","11.0242","0.0006","20.5442","0.0015","90","","93.44","0.007","90","","2597.7","0.3","293","","150","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","diaquatris(pentane-2,4-dionato-O,O')holmium(III) 4-hydroxypentan-2-one solvate dihydrate","","- C20 H37 Ho O12 -","- C20 H37 Ho O12 -","- C80 H148 Ho4 O48 -","4","1","BM1374","Kooijman, Huub; Nijsen, Frank; Spek, Anthony L.; Schip, Fred van het","Diaquatris(pentane-2,4-dionato-<i>O</i>,<i>O</i>')holmium(III) monohydrate and diaquatris(pentane-2,4-dionato-<i>O</i>,<i>O</i>')holmium(III) 4-hydroxypentan-2-one solvate dihydrate","Acta Crystallographica Section C","2000","56","2","156","158","10.1107/S0108270199013566","","","0.71073","MoKα","","0.043","0.032","","","","0.069","","","","","","1.173","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010603","15.5849","0.0011","11.6404","0.0006","8.115","0.0007","90","","113.738","0.003","90","","1347.63","0.17","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2,6-Bis-(3-{trifluoromethyl}pyrazol-1-yl)pyridine","","- C13 H7 F6 N5 -","- C13 H7 F6 N5 -","- C52 H28 F24 N20 -","4","0.5","BM1377","Halcrow, Malcolm A.; Kilner, Colin A.; Thornton-Pett, Mark","2,6-Bis-(3-trifluoromethylpyrazol-1-yl)pyridine","Acta Crystallographica Section C","2000","56","2","213","214","10.1107/S0108270199013852","","","0.71073","MoKα","","0.0693","0.0473","","","","0.1391","","","","","","1.061","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010604","24.928","0.003","7.8409","0.0006","11.5716","0.0012","90","","92.256","0.008","90","","2260","0.4","173","2","173","2","","","","","","","","2","C 1 2/c 1","-C 2yc","15","","chiral bis([2.2]paracyclophan-4-yl)methane","","- C33 H32 -","- C33 H32 -","- C132 H128 -","4","0.5","BM1382","Jones, Peter G.; Ernst, Ludger; Dix, Ina; Wittkowski, Lars","Chiral and <i>meso</i>-bis([2.2]paracyclophan-4-yl)methane and <i>meso</i>-bis([2.2]paracyclophan-4-yl) sulfide","Acta Crystallographica Section C","2000","56","2","239","241","10.1107/S0108270199014560","","","0.71073","MoKα","","0.0631","0.0452","","0.1306","0.1207","","","","1.024","1.128","1.128","","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010605","25.969","0.003","7.72","0.001","23.329","0.003","90","","94.044","0.006","90","","4665.4","1","173","2","173","2","","","","","","","","2","C 1 2/c 1","-C 2yc","15","","meso-bis([2.2]paracyclophan-4-yl)methane","","- C33 H32 -","- C33 H32 -","- C264 H256 -","8","1","BM1382","Jones, Peter G.; Ernst, Ludger; Dix, Ina; Wittkowski, Lars","Chiral and <i>meso</i>-bis([2.2]paracyclophan-4-yl)methane and <i>meso</i>-bis([2.2]paracyclophan-4-yl) sulfide","Acta Crystallographica Section C","2000","56","2","239","241","10.1107/S0108270199014560","","","0.71073","MoKα","","0.0541","0.0416","","0.1164","0.1097","","","","1.037","1.116","1.116","","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010606","8.1084","0.0012","12.334","0.002","12.826","0.002","94.525","0.012","105.516","0.012","105.779","0.008","1173.4","0.3","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","meso-bis([2.2]paracyclophan-4-yl)sulfide","","- C32 H30 S -","- C32 H30 S -","- C64 H60 S2 -","2","1","BM1382","Jones, Peter G.; Ernst, Ludger; Dix, Ina; Wittkowski, Lars","Chiral and <i>meso</i>-bis([2.2]paracyclophan-4-yl)methane and <i>meso</i>-bis([2.2]paracyclophan-4-yl) sulfide","Acta Crystallographica Section C","2000","56","2","239","241","10.1107/S0108270199014560","","","0.71073","MoKα","","0.0785","0.0401","","0.0897","0.0813","","","","0.817","0.994","0.994","","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010607","15.0766","0.0009","15.0766","0.0009","15.0766","0.0009","90","","90","","90","","3427","0.4","293","2","293","2","","","","","","","","6","P a -3","-P 2ac 2ab 3","205","","poly[Bis((2-aminomethyl)methylamine)(μ-hexathiocyanato) triccadmium(II) 1.0 water solvate","","- C16 H32 Cd3 N12 O S6 -","- C16.0002 H32.001 Cd3 N12 O1.0002 S6 -","- C64.0008 H128.004 Cd12 N48 O4.0008 S24 -","4","0.166667","BR1256","Mostafa, Golam; Mondal, Arunendu; Laskar, Inamur R.; Welch, A. J.; Chaudhuri, N. Ray","A three-dimensional network of cadmium","Acta Crystallographica Section C","2000","56","2","146","148","10.1107/S010827019901269X","","","0.71073","MoKα","","0.054","0.044","","","","0.129","","","","","","1.037","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010608","6.773","0.002","6.776","0.003","10.122","0.003","71.72","0.03","79.48","0.02","66.64","0.02","404","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","tetrarubidiumtetraoxatin(IV)","","- O4 Rb4 Sn -","- O4 Rb4 Sn -","- O8 Rb8 Sn2 -","2","1","BR1266","Hoch, Constantin; Röhr, Caroline","Rubidium stannate(IV), Rb~4~SnO~4~","Acta Crystallographica Section C","2000","56","2","136","137","10.1107/S0108270199013700","","","0.7107","MoKα","","0.087","0.056","","","","0.15","","","","","","1.101","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2010609","11.86","0.01","12.6","0.01","13.02","0.02","74.3","0.1","79.6","0.1","66","0.1","1706","4","298","","","","","","","","","","","6","P -1","-P 1","2","","","","- C4 H68 N2 Na10 O74 W12 -","- C4 N2 Na10 O74 W12 -","- C4 N2 Na10 O74 W12 -","1","0.5","BR1268","Haruo Naruke; Norio Fukuda; Toshihiro Yamase","Na~10~(glycine)~2~[H~2~W~12~O~42~]·28H~2~O","Acta Crystallographica Section C","2000","56","2","177","178","10.1107/S0108270199014419","","","0.7107","MoKα","","","0.0514","","","","0.0629","","","","","","1.98","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2010610","12.864","0.003","14.422","0.003","9.083","0.0018","90","","134.83","0.03","90","","1195.1","0.8","295","2","295","2","","","","","","","","2","C 1 c 1","C -2yc","9","","Lanthanum diarsenide","","- As2 La -","- As2 La -","- As32 La16 -","16","4","BR1274","Wang, Meitian; Mar, Arthur","High-temperature LaAs~2~","Acta Crystallographica Section C","2000","56","2","138","139","10.1107/S0108270199015553","","","0.71073","MoKα","","0.0604","0.0477","","","","0.1036","","","","","","1.01","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010611","19.657","0.012","17.066","0.003","17.67","0.005","90","","90","","90","","5928","4","150","0.1","150","0.1","","","","","","","","5","P b c n","-P 2n 2ab","60","","Bis(tetra-n-butylammonium) Bis[μ-2-hydroxy-2-phenyl- ethanoato(2-)]-bis[oxomonoperoxovanadate(V)]","","- C56 H92 N2 O15 V2 -","- C56 H92 N2 O15 V2 -","- C224 H368 N8 O60 V8 -","4","0.5","CF1306","Kutá Smatanová, Ivana; Marek, Jaromír; Švančárek, Peter; Schwendt, Peter","Bis(tetra-<i>n</i>-butylammonium) bis[(mandelato)oxo(peroxo)vanadate(V)] mandelic acid solvate","Acta Crystallographica Section C","2000","56","2","154","155","10.1107/S0108270199013475","","","0.71073","MoKα","","0.098","0.052","","","","0.168","","","","","","1.034","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2010612","9.1198","0.0013","9.96","0.002","19.483","0.003","90","","92.176","0.012","90","","1768.4","0.5","203","2","203","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(iodobromo)triphenylarsenic","","- C18 H15 As Br I -","- C18 H15 As Br I -","- C72 H60 As4 Br4 I4 -","4","1","CF1314","Cross, Wendy I.; Dahalan, Mohjat Z.; Godfrey, Stephen M.; Jaiboon, Nongnuch; McAuliffe, Charles A.; Pritchard, Robin G.; Thompson, Graeme M.","(Triphenylarsine)iodinemonobromine: a charge-transfer adduct in which arsenic selectively bonds to iodine","Acta Crystallographica Section C","2000","56","2","140","141","10.1107/S0108270199012111","","","0.71073","MoKα","","0.053","0.036","","","","0.089","","","","","","1.023","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010613","6.1333","0.0008","24.365","0.003","8.0681","0.0006","90","","108.496","0.008","90","","1143.4","0.2","293","1","293","1","","","","","","","","4","P 1 21 1","P 2yb","4","Cyclomicrobuxine","3β-(Dimethylamino)-16α-hydroxy-14-methyl-4-methylene-9,19-cyclo-5α- pregnan-20-one monohydrate","","- C25 H41 N O3 -","- C25 H41 N O3 -","- C50 H82 N2 O6 -","2","1","DA1099","Parvez, Masood; Atta-ur-Rahman; Choudhary, M. Iqbal; Parveen, Shehnaz; Ayatollahi, Syed Abdul Majid","Cyclomicrobuxine monohydrate","Acta Crystallographica Section C","2000","56","2","233","234","10.1107/S0108270199014420","","","0.71069","MoKα","","0.1373","0.0585","","","","0.2554","","","","","","1.071","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010614","6.5156","0.0007","8.2006","0.0011","20.6704","0.0014","90","","90","","90","","1104.5","0.2","123","2","123","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","2,2-dimethyl-1-picrylhydrazine","2,2-dimethyl-1-(2,4,6-trinitro)phenylhydrazine","","- C8 H9 N5 O6 -","- C8 H9 N5 O6 -","- C32 H36 N20 O24 -","4","1","DA1101","Quail, J. Wilson; Weil, John A.; Singh, Malvinder P.","2,2-Dimethyl-1-(2,4,6-trinitrophenyl)hydrazine","Acta Crystallographica Section C","2000","56","2","235","236","10.1107/S0108270199014547","","","0.71073","MoKα","","0.0478","0.0384","","","","0.0999","","","","","","1.046","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010615","7.448","0.003","8.514","0.003","9.786","0.003","107.57","0.03","100.99","0.03","94.57","0.03","574.5","0.4","125","","","","","","","","","","","4","P -1","-P 1","2","","3-methylthio-4-propargylthioquinoline","","- C13 H11 N S2 -","- C13 H11 N S2 -","- C26 H22 N2 S4 -","2","1","DE1124","Boryczka, Stanisław; Schreurs, Antoine M. M.; Kroon, Jan; Steiner, Thomas","C[tripleC—H···N hydrogen bonding in 3-methylthio-4-propargylthioquinoline","Acta Crystallographica Section C","2000","56","2","263","264","10.1107/S0108270199016297","","","0.71073","MoKα","","0.0624","0.053","","","","0.1271","","","","","","1.098","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010616","8.905","0.003","5.301","0.001","12.035","0.003","90","","95.4","0.03","90","","565.6","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H6 N2 O4 S2 -","- C10 H6 N2 O4 S2 -","- C20 H12 N4 O8 S4 -","2","0.5","FG1563","Brisse, François; Atfani, Mohamed; Bergeron, Jean-Yves; Bélanger-Gariépy, Francine; Armand, Michel","<i>N</i>,<i>N</i>'-Dimethyl-1,4-dithiine-1,2:4,5-tetracarboximide and <i>N</i>,<i>N</i>'-dimethyl-1,4-diselenine-1,2:4,5-tetracarboximide","Acta Crystallographica Section C","2000","56","2","190","192","10.1107/S0108270199010100","","","1.54056","CuKα","","0.033","0.03","","0.09","","0.088","","","1.093","","","1.14","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010617","9.173","0.002","5.302","0.001","12.239","0.004","90","","93.69","0.02","90","","594","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H6 N2 O4 Se2 -","- C10 H6 N2 O4 Se2 -","- C20 H12 N4 O8 Se4 -","2","0.5","FG1563","Brisse, François; Atfani, Mohamed; Bergeron, Jean-Yves; Bélanger-Gariépy, Francine; Armand, Michel","<i>N</i>,<i>N</i>'-Dimethyl-1,4-dithiine-1,2:4,5-tetracarboximide and <i>N</i>,<i>N</i>'-dimethyl-1,4-diselenine-1,2:4,5-tetracarboximide","Acta Crystallographica Section C","2000","56","2","190","192","10.1107/S0108270199010100","","","1.54056","CuKα","","0.033","0.026","","0.075","","0.073","","","1.077","","","1.181","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010618","10.273","0.002","15.238","0.002","11.976","0.002","90","","95.63","0.01","90","","1865.7","0.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[2-acetylpyridine-(4-phenylthiosemicarbazonoato)- N,N,S)]-chloro-transdimethyl-tin(IV),","","- C16 H19 Cl N4 S Sn -","- C16 H19 Cl N4 S Sn -","- C64 H76 Cl4 N16 S4 Sn4 -","4","1","FR1234","Francisco, Regina H. P.; Gambardella, M. Teresa do P.; Sousa, Gerimário F. de; Abras, Anuar","(2-Acetylpyridine-κ<i>N</i> 4-phenylthiosemicarbazonato-κ^2^<i>N</i>^1^,<i>S</i>)halogeno-<i>trans</i>-dimethyltin(IV) (halogeno = chloro and bromo)","Acta Crystallographica Section C","2000","56","2","187","189","10.1107/S0108270199015450","","","0.71073","MoKα","","0.052","0.033","","","","0.102","","","","","","1.072","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010619","10.1858","0.0009","15.3819","0.0018","12.0726","0.0007","90","","97.56","0.006","90","","1875.1","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[2-acetylpyridine-(4-phenylthiosemicarbazonoato)- N,N,S)]-bromo-transdimethyl-tin(IV),","","- C16 H19 Br N4 S Sn -","- C16 H19 Br N4 S Sn -","- C64 H76 Br4 N16 S4 Sn4 -","4","1","FR1234","Francisco, Regina H. P.; Gambardella, M. Teresa do P.; Sousa, Gerimário F. de; Abras, Anuar","(2-Acetylpyridine-κ<i>N</i> 4-phenylthiosemicarbazonato-κ^2^<i>N</i>^1^,<i>S</i>)halogeno-<i>trans</i>-dimethyltin(IV) (halogeno = chloro and bromo)","Acta Crystallographica Section C","2000","56","2","187","189","10.1107/S0108270199015450","","","0.71073","MoKα","","0.12","0.04","","","","0.106","","","","","","1.054","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010620","8.481","0.001","14.206","0.001","18.273","0.001","90","","90.538","0.004","90","","2201.5","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","methyl N-[4-methoxyphenyl-(3,4,5-trimethoxyphenyl)-methyl]pyroglutamate","","- C23 H27 N O7 -","- C23 H27 N O7 -","- C92 H108 N4 O28 -","4","1","GS1054","Camus, Fabrice; Norberg, Bernadette; Legrand, Anne; Rigo, Benoit; Durant, François; Wouters, Johan","Structural analysis of pyrrolidinones","Acta Crystallographica Section C","2000","56","2","193","196","10.1107/S0108270199013037","","","1.54178","CuKα","","0.0456","0.0424","","","","0.1221","","","","","","1.058","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010621","9.19","0.001","11.333","0.001","14.756","0.001","89.292","0.007","73.923","0.005","66.722","0.007","1348.3","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","methyl N-[naphtyl-(3,4,5-trimethoxyphenyl)-methyl]pyroglutamate","","- C28 H30 N O8 -","- C28 H30 N O8 -","- C56 H60 N2 O16 -","2","1","GS1054","Camus, Fabrice; Norberg, Bernadette; Legrand, Anne; Rigo, Benoit; Durant, François; Wouters, Johan","Structural analysis of pyrrolidinones","Acta Crystallographica Section C","2000","56","2","193","196","10.1107/S0108270199013037","","","1.54178","CuKα","","0.0669","0.0652","","","","0.2098","","","","","","1.002","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2010622","9.909","0.001","8.519","0.001","23.793","0.001","90","","98.104","0.004","90","","1988.4","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-(3,4,5-trimethoxyphenyl)-1,2,3,5-tetrahydro-11a-naphto[1,8-f,g] indolizine-3-one","","- C24 H23 N O4 -","- C24 H23 N O4 -","- C96 H92 N4 O16 -","4","1","GS1054","Camus, Fabrice; Norberg, Bernadette; Legrand, Anne; Rigo, Benoit; Durant, François; Wouters, Johan","Structural analysis of pyrrolidinones","Acta Crystallographica Section C","2000","56","2","193","196","10.1107/S0108270199013037","","","1.54178","CuKα","","0.0437","0.0423","","","","0.1207","","","","","","1.076","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010623","10.868","0.001","12.937","0.001","15.049","0.001","90","","96.009","0.004","90","","2104.3","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-(3,4,5-trimethoxyphenyl)-1,2,3,5,12,12a-hexahydronaphto[1,2-f] indolizine-3,12-dione","","- C25 H23 N O5 -","- C25 H23 N O5 -","- C100 H92 N4 O20 -","4","1","GS1054","Camus, Fabrice; Norberg, Bernadette; Legrand, Anne; Rigo, Benoit; Durant, François; Wouters, Johan","Structural analysis of pyrrolidinones","Acta Crystallographica Section C","2000","56","2","193","196","10.1107/S0108270199013037","","","1.54178","CuKα","","0.0491","0.0399","","","","0.1182","","","","","","1.051","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010624","9.5567","0.0019","20.491","0.004","27.169","0.005","90","","90","","90","","5320.4","1.8","123","2","123","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Leurosine methiodide-methanol-water (1/3/2)","","","- C50 H75 I N4 O14 -","- C50 H75 I0.996 N4 O14 -","- C200 H300 I3.984 N16 O56 -","4","1","GS1056","Hardouin, Christophe; Doris, Eric; Rousseau, Bernard; Mioskowski, Charles; Nierlich, Martine","Leurosine methiodide‒methanol‒water (1/3/2)","Acta Crystallographica Section C","2000","56","2","225","226","10.1107/S0108270199014055","","","0.71073","MoKα","","0.106","0.073","","","","0.211","","","","","","0.965","","","","has coordinates,has disorder,has Fobs","194542","2020-10-21","18:00:00",""
"2010625","9.709","0.002","13.748","0.002","7.128","0.001","90","","90","","90","","951.4","0.3","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","Mercury(II) polyphosphate","","- Hg O6 P2 -","- Hg O6 P2 -","- Hg8 O48 P16 -","8","1","GS1057","Weil, Matthias; Glaum, Robert","Mercury(II) polyphosphate, Hg(PO~3~)~2~","Acta Crystallographica Section C","2000","56","2","133","135","10.1107/S0108270199014067","","","0.71073","MoKα","","0.039","0.034","","","","0.093","","","","","","1.108","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010626","6.0272","0.0002","18.6624","0.0008","7.3642","0.0003","90","","98.148","0.001","90","","819.98","0.06","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(1R,2S)-(2-N-methyl-N-4-toluenesulfonyl)amino-1-phenyl-1-propanol","","- C17 H21 N O3 S -","- C17 H21 N O3 S -","- C34 H42 N2 O6 S2 -","2","1","HA1248","Chinnakali, Kandasamy; Shanmuga Sundara Raj, S.; Fun, Hoong-Kun; Sriraghavan, Kamaraj; Ramakrishnan, Vayalakkavoor T.","(1<i>R</i>,2<i>S</i>)-2-[<i>N</i>-Methyl-<i>N</i>-(4-toluenesulfonyl)amino]-1-phenylpropan-1-ol","Acta Crystallographica Section C","2000","56","2","227","228","10.1107/S0108270198017429","","","0.71073","MoKα","","0.048","0.041","","","","0.104","","","","","","1.06","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2010627","7.854","0.001","9.384","0.001","13.23","0.002","101.563","0.002","103.699","0.002","90.184","0.002","926.8","0.2","300","","293","","","","","","","","","3","P 1","P 1","1","","","","- C21 H20 O8 -","- C21 H20 O8 -","- C42 H40 O16 -","2","2","JA1004","Du Boulay, Douglas; Shaari, Khozirah; Skelton, Brian W.; Waterman, Peter G.; White, Allan H.","2β-Hydroxy-4'-demethyldesoxypodophyllotoxin","Acta Crystallographica Section C","2000","56","2","199","200","10.1107/S010827019901358X","","","0.71073","MoKα","","0.09","0.04","","0.044","","0.044","","","1.07","","","1.07","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010628","7.5821","0.0016","7.613","0.002","22.27","0.003","99.469","0.016","96.999","0.012","94.79","0.02","1251.5","0.5","293","","293","","","","","","","","","4","P -1","-P 1","2","","4-cyano-N-(4-methoxybenzylidene)phenylamine N-oxide","","- C15 H12 N2 O2 -","- C15 H12 N2 O2 -","- C60 H48 N8 O8 -","4","2","JA1009","Kang, Jun-Gill; Hong, Jung-Pyo; Suh, Il-Hwan","<i>N</i>-(4-Cyanophenyl)-α-(4-methoxyphenyl)nitrone","Acta Crystallographica Section C","2000","56","2","231","232","10.1107/S0108270199014596","","","0.71069","MoKα","","0.103","0.056","","","","0.177","","","","","","1.009","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010629","15.151","0.003","12.739","0.003","10.5509","0.0013","90","","97.888","0.013","90","","2017.1","0.7","291","","291","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H16 N4 O8 S4 -","- C14 H16 N4 O8 S4 -","- C56 H64 N16 O32 S16 -","4","0.5","JA1010","Cho, Nam Sook; Hong, Soon Il; Kim, Jin-Gyu; Suh, Il-Hwan","4,17,25,26-Tetraaza-6,9,12,15-tetraoxa-2,19,21,24-tetrathiatricyclo[18.4.1^1,4^.1^17,20^]hexacosa-1(25),20(26)-diene-3,5,16,18-tetraone","Acta Crystallographica Section C","2000","56","2","229","230","10.1107/S0108270199014353","","","0.71069","MoKα","","0.0984","0.0442","","","","0.0915","","","","","","1.018","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010630","11.415","0.004","11.415","0.004","8.0552","0.0008","90","","90","","120","","909","0.5","293","2","291","2","","","","","","","","7","P 3","P 3","143","","","","- C12 H60 Cl7 Co2 N12 Na O6 -","- C12 H48 Cl7 Co2 N12 Na O6 -","- C12 H48 Cl7 Co2 N12 Na O6 -","1","0.333333","KA1333","Farrugia, Louis J.; Peacock, Robert D.; Stewart, Brian","Redetermination of the double salt Λ-[tris(ethylenediamine)cobalt(III) trichloride]‒sodium chloride‒water (2/1/6)","Acta Crystallographica Section C","2000","56","2","149","151","10.1107/S0108270199013116","","","0.71073","MoKα","","0.047","0.047","","","","0.144","","","","","","1.198","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010631","13.238","0.0011","5.9089","0.0004","16.3148","0.0015","90","","111.335","0.009","90","","1188.72","0.18","150","2","150","2","","","","","","","","5","P 1 21 1","P 2yb","4","(R)-(-)-4-(3,4-dichlorophenyl)-4-(2-pyridyl)butanoic acid . L-(-)-ephedrine","(R)-(-)-4-(3,4-dichlorophenyl)-4-(2-pyridyl)butanoic acid L-(-)-ephedrine","","- C25 H28 Cl2 N2 O3 -","- C25 H28 Cl2 N2 O3 -","- C50 H56 Cl4 N4 O6 -","2","1","KA1342","Manfred Zabel; Josef Breu; Franz Rau; Klaus-Jürgen Range; Volker Krey; Anka Uffrecht; Armin Buschauer","Absolute configuration of ({-})-4-(3,4-dichlorophenyl)-4-(2-pyridyl)butanoic acid: essential information to determine crucial steric features of arpromidine-type histamine H~2~ receptor agonists","Acta Crystallographica Section C","2000","56","2","250","251","10.1107/S0108270199014699","","","0.71069","MoKα","","0.0769","0.0398","","","","0.0718","","","","","","0.721","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010632","5.4741","0.0009","7.3018","0.0007","26.791","0.003","90","","90","","90","","1070.9","0.2","134","2","134","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1'-deoxy-1'-(4-fluorophenyl)-β-D-ribofuranose","","- C11 H13 F O4 -","- C11 H13 F O4 -","- C44 H52 F4 O16 -","4","1","KA1343","Bats, Jan W.; Parsch, Jörg; Engels, Joachim W.","1-Deoxy-1-(4-fluorophenyl)-β-<small>D</small>-ribofuranose, its hemihydrate, and 1-deoxy-1-(2,4-difluorophenyl)-β-<small>D</small>-ribofuranose: structural evidence for intermolecular C—H···F—C interactions","Acta Crystallographica Section C","2000","56","2","201","205","10.1107/S010827019901361X","","","0.71073","MoKα","","0.04","0.037","","","","0.111","","","","","","1.393","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010633","6.7109","0.0014","6.7653","0.0007","22.846","0.003","90","","90","","90","","1037.2","0.3","135","2","135","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1'-deoxy-1'-(4-fluorophenyl)-β-D-ribofuranose","","- C11 H13 F O4 -","- C11 H13 F O4 -","- C44 H52 F4 O16 -","4","1","KA1343","Bats, Jan W.; Parsch, Jörg; Engels, Joachim W.","1-Deoxy-1-(4-fluorophenyl)-β-<small>D</small>-ribofuranose, its hemihydrate, and 1-deoxy-1-(2,4-difluorophenyl)-β-<small>D</small>-ribofuranose: structural evidence for intermolecular C—H···F—C interactions","Acta Crystallographica Section C","2000","56","2","201","205","10.1107/S010827019901361X","","","0.71073","MoKα","","0.053","0.039","","","","0.09","","","","","","1.114","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010634","29.356","0.006","5.3068","0.0007","7.353","0.0011","90","","93.215","0.01","90","","1143.7","0.3","154","2","154","2","","","","","","","","4","C 1 2 1","C 2y","5","","1'-deoxy-1'-(4-fluorophenyl)-β-D-ribofuranose hemihydrate","","- C11 H14 F O4.5 -","- C11 H14 F O4.5 -","- C44 H56 F4 O18 -","4","1","KA1343","Bats, Jan W.; Parsch, Jörg; Engels, Joachim W.","1-Deoxy-1-(4-fluorophenyl)-β-<small>D</small>-ribofuranose, its hemihydrate, and 1-deoxy-1-(2,4-difluorophenyl)-β-<small>D</small>-ribofuranose: structural evidence for intermolecular C—H···F—C interactions","Acta Crystallographica Section C","2000","56","2","201","205","10.1107/S010827019901361X","","","0.71073","MoKα","","0.036","0.034","","","","0.1","","","","","","1.486","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010635","14.684","0.002","4.6609","0.0006","15.772","0.002","90","","99.476","0.011","90","","1064.7","0.2","134","2","134","2","","","","","","","","4","C 1 2 1","C 2y","5","","1'-deoxy-1'-(2,4-difluorophenyl)-β-D-ribofuranose","","- C11 H12 F2 O4 -","- C11 H12 F2 O4 -","- C44 H48 F8 O16 -","4","1","KA1343","Bats, Jan W.; Parsch, Jörg; Engels, Joachim W.","1-Deoxy-1-(4-fluorophenyl)-β-<small>D</small>-ribofuranose, its hemihydrate, and 1-deoxy-1-(2,4-difluorophenyl)-β-<small>D</small>-ribofuranose: structural evidence for intermolecular C—H···F—C interactions","Acta Crystallographica Section C","2000","56","2","201","205","10.1107/S010827019901361X","","","0.71073","MoKα","","0.052","0.046","","","","0.122","","","","","","1.4","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010636","9.342","0.001","9.106","0.001","16.208","0.001","90","","92.58","0.01","90","","1377.4","0.2","295","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H12 N4 O S -","- C15 H12 N4 O S -","- C60 H48 N16 O4 S4 -","4","1","KA1344","Özbey, Süheyla; Ulusoy, Nuray; Kendi, Engin","3-(2-Furyl)-6-(4-methylphenyl)-7<i>H</i>-1,2,4-triazolo[3,4-<i>b</i>][1,3,4]thiadiazine and its 6-phenyl analogue","Acta Crystallographica Section C","2000","56","2","222","224","10.1107/S0108270199014079","","","0.71073","MoKα","","","0.038","","","","0.043","","","","","","0.7","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2010637","8.799","0.002","9.302","0.001","15.5437","0.0001","90","","97.4","0.01","90","","1261.6","0.3","295","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H10 N4 O S -","- C14 H10 N4 O S -","- C56 H40 N16 O4 S4 -","4","1","KA1344","Özbey, Süheyla; Ulusoy, Nuray; Kendi, Engin","3-(2-Furyl)-6-(4-methylphenyl)-7<i>H</i>-1,2,4-triazolo[3,4-<i>b</i>][1,3,4]thiadiazine and its 6-phenyl analogue","Acta Crystallographica Section C","2000","56","2","222","224","10.1107/S0108270199014079","","","0.71073","MoKα","","","0.037","","","","0.042","","","","","","0.74","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2010638","6.9997","0.0012","7.4134","0.0014","12.348","0.002","105.627","0.003","90.456","0.004","95.905","0.003","613.37","0.19","133","2","133","2","","","","","","","","6","P -1","-P 1","2","p-Nitrocatechol sulfate","2-Hydroxy-5-nitrophenyl sulfate","","- C6 H7 K2 N O9 S -","- C6 H7 K2 N O9 S -","- C12 H14 K4 N2 O18 S2 -","2","1","KA1345","von Bülow, Rixa; Usón, Isabel","The dipotassium salt of <i>p</i>-nitrocatechol sulfate","Acta Crystallographica Section C","2000","56","2","152","153","10.1107/S0108270199013426","","","0.71073","MoKα","","0.0454","0.0351","","","","0.0973","","","","","","1.075","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010639","18.944","0.003","18.944","0.003","6.3326","0.0011","90","","90","","90","","2272.6","0.6","293","2","293","2","","","","","","","","4","P -4 21 c","P -4 2n","114","","Sodium diphenylacetate","","- C14 H11 Na O2 -","- C14 H11 Na O2 -","- C112 H88 Na8 O16 -","8","1","LN1088","Paixão, J. A.; Nascimento, F. V.; Matos Beja, A.; Ramos Silva, M.","Sodium diphenylacetate, an infinite columnar structure","Acta Crystallographica Section C","2000","56","2","168","170","10.1107/S0108270199014080","","","0.71073","MoKα","","0.078","0.038","","","","0.106","","","","","","1.076","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010640","6.221","0.001","22.263","0.001","9.411","0.001","90","","97.3","0.02","90","","1292.8","0.3","293","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1:1 Complex of 4-nitrobenzoic acid and 4-nitropyridine N-oxide","","- C12 H9 N3 O7 -","- C12 H9 N3 O7 -","- C48 H36 N12 O28 -","4","1","NA1431","Moreno-Fuquen, Rodolfo; Ribeiro de Castro, Eustaquio Vinicius; Moreno, Margarita; De Almeida Santos, Regina Helena; Montaño, Angela Marcela","1:1 Complex of 4-nitrobenzoic acid and 4-nitropyridine <i>N</i>-oxide","Acta Crystallographica Section C","2000","56","2","206","207","10.1107/S0108270199013724","","","0.71073","MoKα","","0.094","0.044","","0.132","0.094","","","","1.077","1.033","1.033","","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010641","10.5062","0.0005","8.594","0.0004","6.3562","0.0003","90","","90","","90","","573.9","0.05","293","","293","","","","","","","","","4","P n a m","-P 2c 2n","62","","1-methyl-3-nitro-pyrazole","","- C4 H5 N3 O2 -","- C4 H5 N3 O2 -","- C16 H20 N12 O8 -","4","0.5","NA1434","Foces-Foces, C.; Jagerovic, N.; Elguero, J.","Weak C‒H···O and C‒H···N interactions in nitropyrazoles","Acta Crystallographica Section C","2000","56","2","215","218","10.1107/S0108270199013876","","","1.54178","CuKα","","0.043","0.043","","0.045","","0.045","","","1.016","","","1.016","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2010642","7.4197","0.0008","10.1803","0.0015","8.3529","0.001","90","","112.924","0.008","90","","581.1","0.13","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-methyl-4-nitropyrazole","","- C4 H5 N3 O2 -","- C4 H5 N3 O2 -","- C16 H20 N12 O8 -","4","1","NA1434","Foces-Foces, C.; Jagerovic, N.; Elguero, J.","Weak C‒H···O and C‒H···N interactions in nitropyrazoles","Acta Crystallographica Section C","2000","56","2","215","218","10.1107/S0108270199013876","","","1.54178","CuKα","","0.081","0.071","","0.087","","0.08","","","0.998","","","1.005","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010643","91.116","0.017","4.932","0.004","8.997","0.01","90","","93.01","0.04","90","","4038","6","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","γ-form of n-Eicosanol","","- C20 H42 O -","- C20 H42 O -","- C160 H336 O8 -","8","1","NA1435","Michaud, François; Ventolà, Lourdes; Calvet, M. Teresa; Cuevas-Diarte, Miquel Angel; Solans, Xavier; Font-Bardía, Mercé","The γ-form of <i>n</i>-eicosanol","Acta Crystallographica Section C","2000","56","2","219","221","10.1107/S010827019901392X","","","0.71069","MoKα","","0.07","0.041","","","","0.159","","","","","","0.978","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010644","8.867","0.001","4.8579","0.0002","29.39","0.002","90","","96.05","0.01","90","","1258.92","0.18","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","morpholine β-iodophenylacetylene complex (1:1)","","- C12 H14 I N O -","- C12 H14 I N O -","- C48 H56 I4 N4 O4 -","4","1","NA1436","Batsanov, Andrei S.; Howard, Judith A. K.","Morpholine‒β-iodophenylacetylene (1/1) revisited: an exceptionally short I···N contact","Acta Crystallographica Section C","2000","56","2","252","253","10.1107/S0108270199014705","","","0.71073","MoKα","","0.032","0.0286","","","","0.0583","","","","","","1.295","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010645","14.134","0.002","12.491","0.002","12.063","0.002","90","","119.483","0.01","90","","1853.9","0.5","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4-[(4-Hydroxybenzylidene)amino]-1,2,4-triazole Hemihydrate","","- C9 H9 N4 O1.5 -","- C9 H9 N4 O1.5 -","- C72 H72 N32 O12 -","8","1","NA1438","Zhu, Dun-Ru; Xu, Yan; Liu, Yong-Jiang; Song, You; Zhang, Yong; You, Xiao-Zeng","4-(4-Hydroxybenzylideneamino)-4<i>H</i>-1,2,4-triazole hemihydrate","Acta Crystallographica Section C","2000","56","2","242","243","10.1107/S0108270199014572","","","0.71073","MoKα","","0.0874","0.0567","","0.1847","","0.1554","","","1.102","","","1.166","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010646","5.787","0.001","29.089","0.003","11.881","0.001","90","","100.49","0.01","90","","1966.6","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(E)-5-[(4-Nitrophenylhydrazono)phenylacetyl]-3-phenylisoxazole","","- C23 H16 N4 O4 -","- C23 H16 N4 O4 -","- C92 H64 N16 O16 -","4","1","NA1439","Bruno, Giuseppe; Nicoló, Francesco; Panzalorto, Manuela; Gattuso, Mario; La Torre, G. Loredana","(<i>E</i>)-5-[(4-Nitrophenylhydrazono)phenylacetyl]-3-phenylisoxazole","Acta Crystallographica Section C","2000","56","2","254","255","10.1107/S0108270199014675","","","0.71073","MoKα","","0.069","0.034","","0.079","0.072","","","","0.835","0.835","0.835","","","","","has coordinates,has disorder,has Fobs","201957","2020-10-21","18:00:00",""
"2010647","16.983","0.004","8.863","0.002","9.784","0.004","90","","103.67","0.03","90","","1431","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","8-Chloro-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,5]benzodiazepin-5(6H)-one","","- C16 H11 Cl N4 O -","- C16 H11 Cl N4 O -","- C64 H44 Cl4 N16 O4 -","4","1","NA1441","Alberto Borassi; Maria M. Carnasciali; Angelo Mugnoli; Giorgio Roma","8-Chloro-6-phenyl-4<i>H</i>-[1,2,4]triazolo[4,3-<i>a</i>][1,5]benzodiazepin-5(6<i>H</i>)-one","Acta Crystallographica Section C","2000","56","2","258","259","10.1107/S0108270199014754","","","0.7107","MoKα","","","0.04","","","","0.1098","","","","","","1.038","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010648","14.923","0.002","9.9557","0.001","15.728","0.002","90","","95.088","0.01","90","","2327.5","0.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(Dicyclohexyldithiophosphinato-S,S')-[2-(2-pyridyl-N)phenyl]mercury(II)","","- C23 H30 Hg N P S2 -","- C23 H30 Hg N P S2 -","- C92 H120 Hg4 N4 P4 S8 -","4","1","NA1445","Casas, José S.; Castellano, Eduardo E.; García Tasende, M.S.; Sánchez, Agustín; Sordo, José; Vázquez-López, Ezequiel M.; Zukerman-Schpector, Julio","(Dicyclohexyldithiophosphinato-<i>S</i>,<i>S</i>')[2-(2-pyridyl-<i>N</i>)phenyl]mercury(II)","Acta Crystallographica Section C","2000","56","2","182","183","10.1107/S0108270199015048","","","0.71073","MoKα","","0.119","0.039","","","","0.103","","","","","","0.961","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010649","9.731","0.002","9.638","0.001","13.772","0.001","90","","107.66","0.01","90","","1230.8","0.3","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Octacarbonyl-bis(μ-4-methoxyphenyl-sulphido)-dirhenium","","- C22 H14 O10 Re2 S2 -","- C22 H14 O10 Re2 S2 -","- C44 H28 O20 Re4 S4 -","2","0.5","NA1446","Flörke, Ulrich; Egold, Hans; Schwarze, Detlev","Sulfido-bridged rhenium‒carbonyl complexes with planar and folded Re~2~S~2~ cores","Acta Crystallographica Section C","2000","56","2","184","186","10.1107/S0108270199015152","","","0.71073","MoKα","","0.0339","0.0262","","","","0.0627","","","","","","1.049","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010650","24.561","0.003","9.378","0.003","23.722","0.003","90","","112.63","0.01","90","","5043.3","1.9","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Hexacarbonyl-bis(dicyclohexylphosphane)-bis(μ-naphthyl- sulfido)-dirhenium","","- C50 H60 O6 P2 Re2 S2 -","- C50 H60 O6 P2 Re2 S2 -","- C200 H240 O24 P8 Re8 S8 -","4","0.5","NA1446","Flörke, Ulrich; Egold, Hans; Schwarze, Detlev","Sulfido-bridged rhenium‒carbonyl complexes with planar and folded Re~2~S~2~ cores","Acta Crystallographica Section C","2000","56","2","184","186","10.1107/S0108270199015152","","","0.71073","MoKα","","0.1351","0.0469","","","","0.1174","","","","","","1.021","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010651","9.505","0.002","11.2518","0.0009","9.464","0.002","103.1","0.01","110.52","0.01","87.93","0.01","922.2","0.3","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H22 N6 O6 Pt -","- C14 H22 N6 O6 Pt -","- C28 H44 N12 O12 Pt2 -","2","1","OA1096","Noguchi, Kishie; Tamura, Takashi; Yuge, Hidetaka; Miyamoto, Takeshi Ken","Linkage isomerism of organoplatinum(II) compounds coordinated by two 1,3-dimethylbarbiturate anions","Acta Crystallographica Section C","2000","56","2","171","173","10.1107/S0108270199014109","","","0.71069","MoKα","","0.0381","0.0263","","","","0.061","","","","","","1.028","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010652","12.84","0.002","10.7834","0.0009","14.727","0.002","90","","107.051","0.009","90","","1949.5","0.4","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H26 N6 O8 Pt -","- C14 H26 N6 O8 Pt -","- C56 H104 N24 O32 Pt4 -","4","1","OA1096","Noguchi, Kishie; Tamura, Takashi; Yuge, Hidetaka; Miyamoto, Takeshi Ken","Linkage isomerism of organoplatinum(II) compounds coordinated by two 1,3-dimethylbarbiturate anions","Acta Crystallographica Section C","2000","56","2","171","173","10.1107/S0108270199014109","","","0.71069","MoKα","","0.0479","0.0271","","","","0.0653","","","","","","1.016","","","","has coordinates,has disorder","176760","2020-10-21","18:00:00",""
"2010653","8.7942","0.0011","12.3337","0.0015","17.291","0.002","90","","101.201","0.002","90","","1839.7","0.4","298","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Hexaaquabis(dimethylsulphoxide)yttrium(III) Chloride","Hexaaquabis(dimethylsulphoxide)yttrium(III) Chloride","","- C4 H24 Cl3 O8 S2 Y -","- C4 H24 Cl3 O8 S2 Y -","- C16 H96 Cl12 O32 S8 Y4 -","4","1","OS1077","Kristiansson, Olof; Lindqvist-Reis, Patric","Hexaaquabis(dimethyl sulfoxide)yttrium(III) trichloride","Acta Crystallographica Section C","2000","56","2","163","164","10.1107/S0108270199014092","","","0.71073","MoKα","","0.094","0.0442","","","","0.0986","","","","","","0.941","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2010654","7.2661","0.001","12.2749","0.0018","14.803","0.002","90","","95.084","0.002","90","","1315.1","0.3","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Bis(4-aminopyridine)silver(I)nitrate","Bis(4-aminopyridine)silver(I)nitrate","","- C10 H12 Ag N5 O3 -","- C10 H12 Ag N5 O3 -","- C40 H48 Ag4 N20 O12 -","4","0.5","OS1082","Kristiansson, Olof","Bis(4-aminopyridine)silver(I) nitrate and tris(2,6-diaminopyridine)silver(I) nitrate","Acta Crystallographica Section C","2000","56","2","165","167","10.1107/S0108270199014432","","","0.71073","MoKα","","0.0419","0.0331","","","","0.0941","","","","","","0.977","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010655","8.9276","0.0007","11.1291","0.0009","19.7562","0.0015","90","","90","","90","","1962.9","0.3","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Tris(2,6-diaminopyridine)silver(I)nitrate ?","","- C15 H21 Ag N10 O3 -","- C15 H21 Ag N10 O3 -","- C60 H84 Ag4 N40 O12 -","4","1","OS1082","Kristiansson, Olof","Bis(4-aminopyridine)silver(I) nitrate and tris(2,6-diaminopyridine)silver(I) nitrate","Acta Crystallographica Section C","2000","56","2","165","167","10.1107/S0108270199014432","","","0.71073","MoKα","","0.0311","0.024","","","","0.0545","","","","","","0.937","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010656","11.374","0.002","11.374","","22.939","0.003","90","","90","","90","","2967.6","0.7","298.2","","298.2","","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","","4-(4-methylsulfonylphenyl)-3-phenyl-2,5-dihydro-2-furanone","","- C17 H14 O4 S -","- C17 H14 O4 S -","- C136 H112 O32 S8 -","8","1","QA0199","Shashi Rekha, K.; Vyas, K.; Haricharan Raju, C. M.; Chandrashekar, B.; Om Reddy, G.","Viox, a COX-II inhibitor","Acta Crystallographica Section C","2000","56","2","e68","e68","10.1107/S0108270100001062","","","1.5418","CuKα","","0.042","0.042","","0.059","","0.059","","","1.74","","","1.74","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010657","9.9277","0.0002","16.4556","0.0003","12.4895","0.0002","90","","97.594","0.001","90","","2022.47","0.06","150","2","150","2","","","","","","","","5","P 1 21 1","P 2yb","4","","L-Methionyl-L-alanine 2-propanol solvate","","- C14 H32 N2 O5 S -","- C14 H32 N2 O5 S -","- C56 H128 N8 O20 S4 -","4","2","QA0200","Görbitz, Carl Henrik","<small>L</small>-Methionyl-<small>L</small>-alanine‒2-propanol (1/2)","Acta Crystallographica Section C","2000","56","2","e64","e65","10.1107/S0108270100000548","","","0.71073","MoKα","","0.117","0.078","","","","0.202","","","","","","1.01","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2010658","11.0306","0.0019","15.111","0.003","17.554","0.003","84.38","0.02","80.36","0.02","85.82","0.02","2866","0.9","180","2","180","2","","","","","","","","3","P -1","-P 1","2","","Triphenylphoshine","","- C18 H15 P -","- C18 H15 P -","- C144 H120 P8 -","8","4","QA0201","Ziemer, Burkhard; Rabis, Annegrit; Hans-Uwe Steinberger","Triclinic polymorphs of triphenylphosphine and triphenylphosphine sulfide","Acta Crystallographica Section C","2000","56","2","e58","e59","10.1107/S0108270100000433","","","0.71073","MoKα","","0.0646","0.0422","","","","0.1114","","","","","","0.919","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010659","9.542","0.003","11.207","0.003","14.537","0.004","88.89","0.04","80.39","0.04","78.28","0.03","1500.6","0.8","180","2","180","2","","","","","","","","4","P -1","-P 1","2","","Triphenylphosphinsulfide","","- C18 H15 P S -","- C18 H15 P S -","- C72 H60 P4 S4 -","4","2","QA0201","Ziemer, Burkhard; Rabis, Annegrit; Hans-Uwe Steinberger","Triclinic polymorphs of triphenylphosphine and triphenylphosphine sulfide","Acta Crystallographica Section C","2000","56","2","e58","e59","10.1107/S0108270100000433","","","0.71073","MoKα","","0.0387","0.0293","","","","0.0786","","","","","","0.974","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010660","16.645","0.002","25.768","0.002","7.066","0.003","90","","90","","90","","3030.7","1.4","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","Oleana-12(13), 15(16)-diene-3α, 28 diol diacetate","","- C34 H52 O4 -","- C34 H52 O4 -","- C136 H208 O16 -","4","1","QA0202","Bhattacharyya, Kinkini; Kar, Tanusree; Dutta, Pradeep Kumar; Achari, Basudeb; Bocelli, Gabriele; Righi, Lara","Oleana-12(13),15(16)-diene-3α,28-diyl diacetate","Acta Crystallographica Section C","2000","56","2","e60","e61","10.1107/S0108270100000445","","","1.54178","CuKα","","0.0502","0.0463","","0.141","","0.1367","","","1.123","","","1.162","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010661","6.4976","0.0004","12.729","0.001","14.741","0.001","73.4","0.01","81.98","0.01","74.61","0.01","1123.81","0.16","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","bis(ethylenediamine)pyrimidinyl-2-carboxylato Co(3+) trifluoromethanesulfonate dihydrate","","- C11 H23 Co F6 N6 O10 S2 -","- C11 H23 Co F6 N6 O10 S2 -","- C22 H46 Co2 F12 N12 O20 S4 -","2","1","QA0203","Antolić, Snježana; Kojić-Prodić, Biserka; Lovrić, Jasna","Bis(ethylenediamine-<i>N</i>,<i>N</i>')(pyrimidine-2-carboxylato-<i>N</i>^1^,<i>O</i>)cobalt(III) bis(trifluoromethanesulfonate) dihydrate","Acta Crystallographica Section C","2000","56","2","e51","e52","10.1107/S0108270100000561","","","0.71073","MoKα","","0.0815","0.037","","","","0.0989","","","","","","0.949","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010662","6.1467","0.0012","8.075","0.003","5.77","0.002","101.93","0.03","108.27","0.02","76.65","0.02","261.79","0.15","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C6 H18 Cl2 N2 -","- C6 H18 Cl2 N2 -","- C6 H18 Cl2 N2 -","1","0.5","QA0205","Kabak, Mehmet; Elerman, Yalçin; Ünalerog̋lu, Canan; Mert, Yüksel; Durlu, T.Nuri","<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-Tetramethylethylenediammonium dichloride","Acta Crystallographica Section C","2000","56","2","e66","e67","10.1107/S0108270100001050","","","0.71069","MoKα","","0.053","0.046","","","","0.127","","","","","","1.355","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010663","10.868","0.0014","12.5889","0.0016","13.835","0.002","114.432","0.013","109.881","0.013","95.87","0.014","1554","0.5","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","Di-μ-chloro-bis{1,2-bis(diphenylphosphino)ethane}dipalladium(II) bis(tetrafluoroborate).2CDCl~3~","","- C54 H48 B2 Cl8 D2 F8 P4 Pd2 -","- C54 H50 B2 Cl8 F8 P4 Pd2 -","- C54 H50 B2 Cl8 F8 P4 Pd2 -","1","0.5","QA0208","Abu-Surrah, Adnan S.; Klinga, Martti; Repo, Timo; Leskelä, Markku; Debaerdemaeker, Tony; Rieger, Bernhard","Inhibition of a palladium(II) catalyst upon formation of a di-μ-chloro complex: di-μ-chloro-bis[1,2-bis(diphenylphosphino)ethane-<i>P</i>,<i>P</i>']dipalladium(II) bis(tetrafluoroborate) bis(deuterochloroform) solvate","Acta Crystallographica Section C","2000","56","2","e44","e45","10.1107/S0108270100000639","","","0.71073","MoKα","","0.056","0.042","","","","0.114","","","","","","1.001","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010664","7.4055","0.0002","10.3008","0.0004","13.6543","0.0005","79.896","0.001","79.283","0.002","85.338","0.002","1006.27","0.06","291","1","291","1","","","","","","","","5","P -1","-P 1","2","","","","- C23 H19 N2 O3 P -","- C23 H19 N2 O3 P -","- C46 H38 N4 O6 P2 -","2","1","QA0211","Reeske, Gregor; Schürmann, Markus; Preut, Hans; Mitchell, Terence Nigel","4-(Diphenylphosphinoyl)-3-methyl-<i>N</i>-phenyl-1,2-isoxazole-5-carboxamide","Acta Crystallographica Section C","2000","56","2","e72","e72","10.1107/S0108270100001098","","","0.71069","MoKα","","0.051","0.035","","","","0.096","","","","","","0.998","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010665","7.64","0.002","12.7121","0.0014","10.2205","0.0007","90","","91.668","0.011","90","","992.2","0.3","294","1","294","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,3,3a,4,5a,6,7,8-Octahydro-5a-methyl-6,9-methano-1H,9H-5-oxa-4-azacyclo- penta[c]indene","","- C12 H15 N O -","- C12 H15 N O -","- C48 H60 N4 O4 -","4","1","QA0212","Tam, William; Handerson, Sean; Ferguson, George","2,3,3a,4,5a,6,7,8-Octahydro-5a-methyl-6,9-methano-1<i>H</i>,9<i>H</i>-5-oxa-4-azacyclopenta[<i>c</i>]indene","Acta Crystallographica Section C","2000","56","2","e71","e71","10.1107/S0108270100001086","","","0.7107","MoKα","","0.0668","0.0442","","","","0.109","","","","","","1.044","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010666","10.652","0.001","7.002","0.001","16.427","0.001","90","","93.36","0.01","90","","1223.1","0.2","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C7 H15 Br2 N O Sn -","- C7 H15 Br2 N O Sn -","- C28 H60 Br8 N4 O4 Sn4 -","4","1","QA0215","König, Uwe-Christoph; Berkei, Michael; Neikes, Frank; Preut, Hans; Mitchell, Terence Nigel","A 1:1 adduct between dimethyltin dibromide and <i>N</i>-methylpyrrolidinone (NMP)","Acta Crystallographica Section C","2000","56","2","e53","e54","10.1107/S0108270100001104","","","0.71069","MoKα","","0.029","0.024","","","","0.059","","","","","","1.049","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010667","10.3136","0.0003","12.124","0.001","27.139","0.003","100.346","0.009","93.422","0.007","97.605","0.007","3296.8","0.5","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","iso-Propylxanthatotriphenyltin","","- C22 H22 O S2 Sn -","- C22 H22 O S2 Sn -","- C132 H132 O6 S12 Sn6 -","6","3","QB0127","Ng, Seik Weng; Rae, A. David","A pseudosymmetric triclinic modification of triphenyltin isopropylxanthate","Acta Crystallographica Section C","2000","56","2","e47","e48","10.1107/S0108270100000457","","","0.71073","MoKα","","0.085","0.05","","","","0.09","","","","","","1.45","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010668","12.26","0.003","15.025","0.002","16.347","0.003","90","","99","0.02","90","","2974.2","1","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Dimethyl[1,3-bis(diphenylphosphino)propane]palladium(II) hemitoluene","","- C32.5 H36 P2 Pd -","- C32.5 H36 P2 Pd -","- C130 H144 P8 Pd4 -","4","1","QB0151","Abu-Surrah, Adnan S.; Debaerdemaeker, Tony; Huhn, Wolfgang; Rieger, Bernhard; Klinga, Martti; Repo, Timo; Leskelä, Markku","An alkyl‒palladium(II) complex with a bidentate phosphine ligand: [1,3-bis(diphenylphosphino)propane-<i>P</i>,<i>P</i>']dimethylpalladium(II) toluene hemisolvate","Acta Crystallographica Section C","2000","56","2","e42","e43","10.1107/S0108270100000391","","","0.71073","MoKα","","0.03","0.023","","","","0.062","","","","","","1.036","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2010669","6.8709","0.0001","6.8709","0.0001","29.0432","0.0002","90","","90","","90","","1371.11","0.03","293","2","293","2","","","","","","","","4","I 41/a m d :2","-I 4bd 2","141","","Zirconium dihydroxide chromate","","- Cr H2 O6 Zr -","- Cr O6 Zr -","- Cr12 O72 Zr12 -","12","0.375","QB0152","Casari, Barbara M.; Langer, Vratislav","Zirconium dihydroxide chromate","Acta Crystallographica Section C","2000","56","2","e36","e37","10.1107/S0108270100000421","","","0.71073","MoKα","","0.031","0.025","","","","0.07","","","","","","1.04","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010670","11.953","0.002","18.433","0.004","11.954","0.002","90","","114.86","0.03","90","","2389.8","1","150","0.1","150","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4,5-bis(ferrocenylmethylthio)-1,3-dithiole-2-one","","- C25 H22 Fe2 O S4 -","- C25 H22 Fe2 O S4 -","- C100 H88 Fe8 O4 S16 -","4","1","QB0159","Chohan, Zahid, H.; Howie, R. Alan; Wardell, James L.; Low, John Nicolson","4,5-Bis(ferrocenylmethylthio)-1,3-dithiol-2-one","Acta Crystallographica Section C","2000","56","2","e46","e46","10.1107/S0108270100000408","","","0.71073","MoKα","","0.155","0.056","","","","0.148","","","","","","0.947","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010671","24.225","0.003","8.307","0.003","25.396","0.002","90","","113.505","0.005","90","","4686.6","1.8","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H33 N6 O11.5 Pd -","- C14 H33 N6 O11.5 Pd -","- C112 H264 N48 O92 Pd8 -","8","1","QB0161","Noguchi, Kishie; Yuge, Hidetaka; Miyamoto, Takeshi Ken","An organopalladium(II) compound including enolate oxygen- and <i>sp</i>^3^-carbon-bound 1,3-dimethylbarbiturate ligands: (1,2-diaminoethane)bis(1,3-dimethylbarbiturato)palladium(II) 5.5-hydrate","Acta Crystallographica Section C","2000","56","2","e40","e41","10.1107/S010827010000041X","","","0.71069","MoKα","","0.068","0.032","","","","0.08","","","","","","1.016","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010672","18.3948","0.0013","7.4649","0.0014","13.2477","0.0016","90","","124.752","0.004","90","","1494.6","0.4","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C8 H18 Cl2 Ir N5 O4 -","- C8 H18 Cl2 Ir N5 O4 -","- C32 H72 Cl8 Ir4 N20 O16 -","4","0.5","QB0165","Ohashi, Masataka; Kajiyama, Kazumasa; Yuge, Hidetaka; Miyamoto, Takeshi Ken","Ammonium dichlorobis(dimethylglyoximato-<i>N</i>,<i>N</i>')iridate(III)","Acta Crystallographica Section C","2000","56","2","e38","e39","10.1107/S010827010000038X","","","0.71069","MoKα","","0.0251","0.0139","","","","0.0345","","","","","","1.049","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010673","10.758","0.002","15.879","0.003","11.04","0.002","90","","112.74","0.01","90","","1739.3","0.6","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","none","3-Ethoxy-4-[(1'R,2'S)-(2'-hydroxy-1',2'-diphenyl)ethylamino]-3-cyclobutene- 1,2-dione","","- C20 H19 N O4 -","- C20 H19 N O4 -","- C80 H76 N4 O16 -","4","2","QB0166","Zhou, Haibing; Yuan, Yi; Chan, Albert S. C.; Yang, Teng-Kuei; Xie, Rugang","The new chiral ligand 3-ethoxy-4-[(1<i>R</i>,2<i>S</i>)-(2-hydroxy-1,2-diphenylethyl)amino]-3-cyclobutene-1,2-dione","Acta Crystallographica Section C","2000","56","2","e57","e57","10.1107/S0108270100000378","","","0.71073","MoKα","","0.07","0.038","","","","0.073","","","","","","0.846","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010674","34.497","0.007","7.796","0.002","7.503","0.002","90","","95.12","0.03","90","","2009.8","0.9","150","0.1","150","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Dodecyl 2-nitrophenyl disulphide","","- C18 H29 N O2 S2 -","- C18 H29 N O2 S2 -","- C72 H116 N4 O8 S8 -","4","1","QB0167","Low, John Nicolson; Wardell, James L.","Dodecyl 2-nitrophenyl disulphide","Acta Crystallographica Section C","2000","56","2","e62","e62","10.1107/S0108270100000470","","","0.71073","MoKα","","0.143","0.07","","","","0.21","","","","","","1.025","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010675","10.0818","0.0003","16.122","0.0007","13.7747","0.0006","90","","90","","90","","2238.92","0.15","150","0.1","150","0.1","","","","","","","","6","P b c a","-P 2ac 2ab","61","","2-aminoethoxybis(2-thienyl)boron","","- C10 H12 B N O S2 -","- C10 H12 B N O S2 -","- C80 H96 B8 N8 O8 S16 -","8","1","QB0168","Low, John Nicolson; Musgrave, Oliver, C.; Wardell, James, L.","(2-Aminoethoxy)bis(2-thienyl)boron","Acta Crystallographica Section C","2000","56","2","e63","e63","10.1107/S0108270100000482","","","0.71073","MoKα","","0.074","0.046","","","","0.122","","","","","","1.063","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010676","7.488","0.003","12.475","0.005","18.176","0.006","90","","97.15","0.03","90","","1684.7","1.1","193","2","193","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","{2-[(3-aminopropyl)aminopropyliminomethyl]imidazolato-N, N', N'', N'''}- (methanol-O)copper(II) perchlorate.","","- C11 H22 Cl Cu N5 O5 -","- C11 H22 Cl Cu N5 O5 -","- C44 H88 Cl4 Cu4 N20 O20 -","4","1","QB0169","Pajunen, Aarne; Cámara, Fernando; Dominques-Vera, Jose M.; Colacio, Enrique","{2-[(3-Aminopropyl)aminopropyliminomethyl]imidazolato-<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>'''}(methanol-<i>O</i>)copper(II) perchlorate","Acta Crystallographica Section C","2000","56","2","e49","e50","10.1107/S0108270100000494","","","0.71073","MoKα","","0.047","0.041","","","","0.111","","","","","","1.089","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010677","13.8148","0.0016","13.8148","0.0016","13.8148","0.0016","90","","90","","90","","2636.5","0.5","293","2","293","2","","","","","","","","5","F m -3 m","-F 4 2 3","225","","Bis(tetramethylammonium)Nonadecaoxohexamolybdenum(VI) Solvate Hydrate","","- C8 H24 Mo6 N2 O20 -","- C8 H24 Mo6 N2 O20 -","- C32 H96 Mo24 N8 O80 -","4","0.0208333","QB0170","Wu, Dingming; Wang, Sheng; Lin, Xiang; Lu, Canzhong; Zhuang, Honghui","Bis(tetramethylammonium) nonadecaoxohexamolybdenum(VI) monohydrate","Acta Crystallographica Section C","2000","56","2","e55","e56","10.1107/S0108270100001116","","","0.71073","MoKα","","0.039","0.034","","","","0.095","","","","","","1.326","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010678","7.199","0.001","12.896","0.001","25.077","0.003","90","","90","","90","","2328.1","0.5","296","2","296","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","1:1 Complex of 4-Nitrophenol and 4-Methyl-Pyridine","","- C12 H12 N2 O3 -","- C12 H12 N2 O3 -","- C96 H96 N16 O24 -","8","1","QB0172","Jin, Zhi Min; Pan, Yuan Jiang; Xu, Duan Jun; Xu, Yuan Zhi","The 1:1 complex of 4-nitrophenol and 4-methylpyridine","Acta Crystallographica Section C","2000","56","2","e69","e70","10.1107/S0108270100001074","","","0.71073","MoKα","","0.118","0.037","","","","0.077","","","","","","0.81","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010679","6.877","0.001","9.787","0.001","15.547","0.002","90","","96.91","0.02","90","","1038.8","0.2","173","","173","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H9 Cl N2 -","- C12 H9 Cl N2 -","- C48 H36 Cl4 N8 -","4","1","SK1328","Hensen, Karl; Spangenberg, Björn; Bolte, Michael","Two phenanthroline hydrochlorides","Acta Crystallographica Section C","2000","56","2","208","210","10.1107/S0108270199013815","","","0.71073","MoKα","","0.1377","0.0679","","0.1498","0.1247","0.1498","","","1.05","","","1.05","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010680","26.017","0.003","7.222","0.001","19.461","0.002","90","","90.77","0.01","90","","3656.3","0.8","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C37 H29 Cl7 N6 -","- C37 H29 Cl7 N6 -","- C148 H116 Cl28 N24 -","4","1","SK1328","Hensen, Karl; Spangenberg, Björn; Bolte, Michael","Two phenanthroline hydrochlorides","Acta Crystallographica Section C","2000","56","2","208","210","10.1107/S0108270199013815","","","0.71073","MoKα","","0.0855","0.0431","","","","0.0898","","","","","","1.054","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010681","9.8185","0.0004","10.5191","0.0004","10.8556","0.0005","61.474","0.001","76.764","0.001","70.973","0.001","927.62","0.07","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Hexakis(imidazole)nickel(II) di(p-methoxybenzoate), [Ni(Im)~6~(mB)~2~] (Im = imidazole, mB = p-methoxybenzoate)","","- C34 H38 N12 Ni O6 -","- C34 H38 N12 Ni O6 -","- C34 H38 N12 Ni O6 -","1","0.5","SK1338","Zuoxiang Wang; Yurong Zhang; Ibrahim Abdul Razak; S.Shanmuga Sundara Raj; Hoong-Kun Fun; Fengsheng Li; Hongchang Song","Hexakis(imidazole-<i>N</i>^3^)nickel(II) bis(4-methoxybenzoate)","Acta Crystallographica Section C","2000","56","2","161","162","10.1107/S0108270199013827","","","0.71073","MoKα","","0.06","0.052","","","","0.14","","","","","","1","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010682","7.3969","0.0004","26.703","0.0009","6.0594","0.0003","90","","90","","90","","1196.85","0.1","293","","295","3","","","","","","","","4","C c c 2","C 2 -2c","37","","4,4'-dibromobenzophenone","","- C13 H8 Br2 O -","- C13 H8 Br2 O -","- C52 H32 Br8 O4 -","4","0.5","SK1339","Perić, Berislav; Kojić-Prodić, Biserka","4,4'-Dibromobenzophenone at 293 and 103K","Acta Crystallographica Section C","2000","56","2","211","212","10.1107/S0108270199013839","","","1.54184","CuKα","","0.0342","0.0223","","","","0.0658","","","","","","1.052","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010683","7.2242","0.0002","26.5957","0.0009","6.0118","0.0002","90","","90","","90","","1155.06","0.06","103","3","103","3","","","","","","","","4","C c c 2","C 2 -2c","37","","4,4'-dibromobenzophenone","","- C13 H8 Br2 O -","- C13 H8 Br2 O -","- C52 H32 Br8 O4 -","4","0.5","SK1339","Perić, Berislav; Kojić-Prodić, Biserka","4,4'-Dibromobenzophenone at 293 and 103K","Acta Crystallographica Section C","2000","56","2","211","212","10.1107/S0108270199013839","","","1.54184","CuKα","","0.0204","0.0191","","","","0.0533","","","","","","1.157","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010684","10.8397","0.0006","8.7317","0.0006","12.867","0.0009","90","","102.16","0.004","90","","1190.52","0.14","100","1","100","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(4-hydroxybenzoato)(1,4,8,11-tetraazacyclotetradecane)nickel(II)","","- C24 H34 N4 Ni O6 -","- C24 H34 N4 Ni O6 -","- C48 H68 N8 Ni2 O12 -","2","0.5","SK1344","Glidewell, Christopher; Ferguson, George; Gregson, Richard M.; Lough, Alan J.","Bis(4-hydroxybenzoato-<i>O</i>)(1,4,8,11-tetraazacyclotetradecane-κ^4^<i>N</i>)nickel(II): a three-dimensional framework built from O—H···O and N—H···O hydrogen bonds","Acta Crystallographica Section C","2000","56","2","174","176","10.1107/S0108270199014249","","","0.71073","MoKα","","0.0577","0.0385","","","","0.0891","","","","","","1.027","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010685","22.813","0.004","29.024","0.006","17.113","0.004","90","","90","","90","","11331","4","293","2","293","2","","","","","","","","7","F d d 2","F 2 -2d","43","","Bis[chlorobis(1,10-phenanthroline-N,N')(thiourea-S)nickel(II)]chloride nitrate diethanol solvate","","- C54 H52 Cl3 N13 Ni2 O5 S2 -","- C54 H52 Cl3 N13 Ni2 O5 S2 -","- C432 H416 Cl24 N104 Ni16 O40 S16 -","8","0.5","SX1095","Leopoldo Suescun; Alvaro W. Mombrú; Raúl A. Mariezcurrena; Helena Pardo; Silvia Russi; Ricardo Baggio","Bis[chlorobis(1,10-phenanthroline-<i>N</i>,<i>N</i>')(thiourea-<i>S</i>)nickel(II)] chloride nitrate diethanol solvate","Acta Crystallographica Section C","2000","56","2","179","181","10.1107/S0108270199014833","","","0.71069","MoKα","","0.078","0.066","","","","0.209","","","","","","1.096","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010686","5.393","0.001","9.13","0.002","11.963","0.002","92.67","0.03","95.02","0.03","100.45","0.03","575.9","0.2","293","2","293","2","","","","","","","","4","P 1","P 1","1","tylophorine-B benzene solvate","2,3,6 trimethoxy phenanthro [9,10:6',7'] indolizedine","","- C29 H31 N O3 -","- C29 H31 N O3 -","- C29 H31 N O3 -","1","1","TA1256","Wang, Qiguang; Xie, Liang; Zhai, Jianjun","Tylophorine B benzene solvate","Acta Crystallographica Section C","2000","56","2","197","198","10.1107/S0108270199013499","","","0.71073","MoKα","","0.077","0.062","","","","0.193","","","","","","1.131","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010687","13.888","0.003","10.947","0.002","22.33","0.005","90","","90.01","0.02","90","","3394.9","1.2","129","","129","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","sodium tetraphenylphosphonium bis(2-mercapto-4- methylphenolato)oxovanadate(IV)]","","- C38 H32 Na O3 P S2 V -","- C38 H32 Na O3 P S2 V -","- C152 H128 Na4 O12 P4 S8 V4 -","4","1","BK1473","Challen, Paul R.; McConville, David B.; Youngs, Wiley J.","One-dimensional chains in sodium tetraphenylphosphonium bis(2-mercapto-4-methylphenolato-<i>O</i>,<i>S</i>)oxovanadate(IV)","Acta Crystallographica Section C","2000","56","3","310","311","10.1107/S0108270199015838","","","0.71073","MoKα","","0.051","0.0328","","0.0719","0.0693","","","","1.004","1.157","1.157","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2010688","10.121","0.003","10.121","0.003","26.118","0.01","90","","90","","90","","2675.4","1.5","153","2","153","2","","","","","","","","6","P 41 21 2","P 4abw 2nw","92","","N-(diphenylphosphinoselenoyl)-P,P-diphenyl- tetrahydrofuran solvate","","- C28 H29 N O P2 Se2 -","- C28 H29 N O P2 Se2 -","- C112 H116 N4 O4 P8 Se8 -","4","0.5","BK1508","Pernin, Christopher G.; Ibers, James A.","Two tetrahydrofuran solvates of HN(SePPh~2~)~2~","Acta Crystallographica Section C","2000","56","3","376","378","10.1107/S010827019901584X","","","0.71073","MoKα","","0.0278","0.0222","","","","0.0586","","","","","","0.972","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010689","8.796","0.002","13.248","0.003","13.864","0.003","97.832","0.004","102.673","0.004","94.545","0.004","1551.5","0.6","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","N-(diphenylphosphinoselenoyl)-P,P-diphenyl- tetrahydrofuran solvate","","- C32 H37 N O2 P2 Se2 -","- C32 H37 N O2 P2 Se2 -","- C64 H74 N2 O4 P4 Se4 -","2","1","BK1508","Pernin, Christopher G.; Ibers, James A.","Two tetrahydrofuran solvates of HN(SePPh~2~)~2~","Acta Crystallographica Section C","2000","56","3","376","378","10.1107/S010827019901584X","","","0.71073","MoKα","","0.0462","0.0354","","","","0.0891","","","","","","1.242","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010690","9.4003","0.0012","9.4003","0.0012","17.35","0.004","90","","90","","120","","1327.7","0.4","293","2","293","2","","","","","","","","4","P -6 2 c","P -6c -2c","190","","Praseodimium oxydiacetate","","- C12 H28 O23 Pr2 -","- C12 H12 O22.998 Pr2 -","- C24 H24 O45.996 Pr4 -","2","0.166667","BK1511","Baggio, Ricardo; Perec, Mireille; Garland, Maria Teresa","Triaquatris(μ-oxydiacetato)dipraseodymium(III) pentahydrate and hexaaquatris(μ-oxydiacetato)dineodymium(III) oxydiacetic acid solvate dihydrate","Acta Crystallographica Section C","2000","56","3","312","315","10.1107/S0108270199015851","","","0.71073","MoKα","","0.032","0.02","","","","0.059","","","","","","1.083","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010691","14.096","0.002","6.844","0.001","32.223","0.003","90","","99.59","0.01","90","","3065.2","0.7","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Neodimium oxydiacetate","","- C16 H34 Nd2 O28 -","- C16 H16 Nd2 O28 -","- C64 H64 Nd8 O112 -","4","1","BK1511","Baggio, Ricardo; Perec, Mireille; Garland, Maria Teresa","Triaquatris(μ-oxydiacetato)dipraseodymium(III) pentahydrate and hexaaquatris(μ-oxydiacetato)dineodymium(III) oxydiacetic acid solvate dihydrate","Acta Crystallographica Section C","2000","56","3","312","315","10.1107/S0108270199015851","","","0.71073","MoKα","","0.089","0.047","","","","0.145","","","","","","1.032","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010692","7.903","0.004","11.068","0.004","17.053","0.003","90","","90","","90","","1491.6","1","296","","","","","","","","","","","5","P n n a","-P 2a 2bc","52","","","","- C14 H10 Cu N2 O9 -","- C14 H10 Cu N2 O9 -","- C56 H40 Cu4 N8 O36 -","4","0.5","BM1356","Okabe, Nobuo; Oya, Naomi","Copper(II) and zinc(II) complexes of pyridine-2,6-dicarboxylic acid","Acta Crystallographica Section C","2000","56","3","305","307","10.1107/S0108270199015565","","","0.71069","MoKα","","","0.081","","","","0.129","","","","","","1.03","","","","has coordinates","199607","2020-10-21","18:00:00",""
"2010693","13.765","0.002","10.052","0.002","14.06","0.002","90","","116.554","0.008","90","","1740.2","0.5","296","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C14 H14 N2 O11 Zn -","- C14 H14 N2 O11 Zn -","- C56 H56 N8 O44 Zn4 -","4","1","BM1356","Okabe, Nobuo; Oya, Naomi","Copper(II) and zinc(II) complexes of pyridine-2,6-dicarboxylic acid","Acta Crystallographica Section C","2000","56","3","305","307","10.1107/S0108270199015565","","","0.71069","MoKα","","","0.058","","","","0.114","","","","","","1.36","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010694","9.512","0.003","20.472","0.01","14.412","0.003","90","","99.92","0.02","90","","2764.5","1.7","293","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Aquatris(trans-2,3-dimethylacrylato)(1,10-phenanthroline)ytterbium(III)","","- C27 H31 N2 O7 Yb -","- C27 H31 N2 O7 Yb -","- C108 H124 N8 O28 Yb4 -","4","1","BM1371","Lu, Weimin; Wu, Bin; Wang, Lina; Lu, Yueqing","Aquatris(1,10-phenanthroline)(<i>trans</i>-2,3-dimethylacrylato)ytterbium(III)","Acta Crystallographica Section C","2000","56","3","316","318","10.1107/S0108270199016169","","","0.71069","MoKα","","","0.052","","","","0.063","","","","","","1.98","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010695","17.0016","0.001","10.654","0.001","15.9038","0.001","90","","90","","90","","2880.7","0.4","296","2","296","2","","","","","","","","5","P n a 21","P 2c -2n","33","","3,5-Diamino-6-(2-fluorophenyl)-1,2,4-triazine dimethylformamide","","- C12 H15 F N6 O -","- C12 H15 F N6 O -","- C96 H120 F8 N48 O8 -","8","2","BM1376","Janes, Robert W.","3,5-Diamino-6-(2-fluorophenyl)-1,2,4-triazine‒dimethylformamide (1/1)","Acta Crystallographica Section C","2000","56","3","362","364","10.1107/S0108270199015607","","","1.54178","CuKα","","0.0824","0.0525","","","","0.1665","","","","","","1.129","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2010696","8.5144","0.0001","22.79","0.0003","29.9046","0.0003","90","","96.6","0.001","90","","5764.33","0.12","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","N,N'-bis-(2-tosylaminobenzylidene)-1,2-ethanediamine","","- C30 H30 N4 O4 S2 -","- C30 H30 N4 O4 S2 -","- C240 H240 N32 O32 S16 -","8","1","BM1378","Mahía, José; Maestro, Miguel A.; Vázquez, Miguel; Bermejo, Manuel R.; González, Ana M.; Maneiro, Marcelino","<i>N,N</i>'-Bis(2-tosylaminobenzylidene)-1,2-ethanediamine","Acta Crystallographica Section C","2000","56","3","347","348","10.1107/S010827019901519X","","","0.71073","MoKα","","0.105","0.054","","","","0.127","","","","","","1.041","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010697","6.2209","0.0006","11.9726","0.0013","15.0705","0.0012","90","","90","","90","","1122.46","0.19","294","1","294","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(2S/3R)-3-hydroxy-2-(1-oxoisoindolin-2-yl)butanoic acid","","- C12 H13 N O4 -","- C12 H13 N O4 -","- C48 H52 N4 O16 -","4","1","BM1380","Gallagher, John F.; Brady, Fiona; Murphy, Carol","Intermolecular interactions in the chiral and racemic forms of 3-hydroxy-2-(1-oxoisoindolin-2-yl)butanoic acid derived from threonine","Acta Crystallographica Section C","2000","56","3","365","368","10.1107/S0108270199015619","","","0.7107","MoKα","","0.073","0.04","","","","0.096","","","","","","1.007","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010698","5.9772","0.0007","14.3906","0.0012","13.4926","0.0016","90","","93.131","0.007","90","","1158.8","0.2","294","1","294","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(2R/2S)-3-hydroxy-2-(1-oxoisoindolin-2-yl)butanoic acid","","- C12 H13 N O4 -","- C12 H13 N O4 -","- C48 H52 N4 O16 -","4","1","BM1380","Gallagher, John F.; Brady, Fiona; Murphy, Carol","Intermolecular interactions in the chiral and racemic forms of 3-hydroxy-2-(1-oxoisoindolin-2-yl)butanoic acid derived from threonine","Acta Crystallographica Section C","2000","56","3","365","368","10.1107/S0108270199015619","","","0.7107","MoKα","","0.051","0.034","","","","0.086","","","","","","1.045","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010699","13.408","0.007","13.277","0.004","13.577","0.006","90","","103.07","0.04","90","","2354.3","1.8","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N-[2-(isopropylamino)-5-nitrophenyl]acetamide","","- C11 H15 N3 O3 -","- C11 H15 N3 O3 -","- C88 H120 N24 O24 -","8","2","BM1387","Clark, Ronald D.; Romero, Angela; Borbulevych, Oleg Ya.; Antipin, Mikhail Yu.; Nesterov, Vladimir N.; Timofeeva, Tatiana V.","2-Amino derivatives of 5-nitrophenylacetamide","Acta Crystallographica Section C","2000","56","3","336","338","10.1107/S0108270199014985","","","0.71073","MoKα","","0.094","0.049","","0.149","","0.11","","","1.032","","","1.073","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010700","4.874","0.002","11.002","0.005","12.335","0.007","76.14","","82.27","","86.99","","636.2","0.5","193","2","293","2","","","","","","","","4","P -1","-P 1","2","","N-[2-(butylamino)-5-nitrophenyl]acetamide","","- C12 H17 N3 O3 -","- C12 H17 N3 O3 -","- C24 H34 N6 O6 -","2","1","BM1387","Clark, Ronald D.; Romero, Angela; Borbulevych, Oleg Ya.; Antipin, Mikhail Yu.; Nesterov, Vladimir N.; Timofeeva, Tatiana V.","2-Amino derivatives of 5-nitrophenylacetamide","Acta Crystallographica Section C","2000","56","3","336","338","10.1107/S0108270199014985","","","0.71073","MoKα","","0.171","0.068","","0.271","","0.141","","","1.014","","","1.103","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010701","4.786","0.001","13.03","0.003","8.727","0.002","90","","94.38","0.03","90","","542.6","0.2","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","N-[2-(dimethylamino)-5-nitrophenyl]acetamide","","- C10 H13 N3 O3 -","- C10 H13 N3 O3 -","- C20 H26 N6 O6 -","2","1","BM1387","Clark, Ronald D.; Romero, Angela; Borbulevych, Oleg Ya.; Antipin, Mikhail Yu.; Nesterov, Vladimir N.; Timofeeva, Tatiana V.","2-Amino derivatives of 5-nitrophenylacetamide","Acta Crystallographica Section C","2000","56","3","336","338","10.1107/S0108270199014985","","","0.71073","MoKα","","0.052","0.034","","0.11","","0.085","","","1.041","","","1.061","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010702","14.1107","0.0002","15.5953","0.0002","16.6469","0.0002","90","","90","","90","","3663.33","0.08","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Bis-[N,N'-{2,4,6-trimethylphenyl}-1,2-ethanediylidenediamine]copper(I) tetrafluoroborate","","- C40 H48 B Cu F4 N4 -","- C40 H48 B Cu F4 N4 -","- C160 H192 B4 Cu4 F16 N16 -","4","1","BM1389","Caroline L. Foster; Colin A. Kilner; Mark Thornton-Pett; Malcolm A. Halcrow","Bis[<i>N</i>,<i>N</i>'-bis(2,4,6-trimethylphenyl)-1,2-ethanediylidenediamine]copper(I) tetrafluoroborate","Acta Crystallographica Section C","2000","56","3","319","320","10.1107/S0108270199015863","","","0.71073","MoKα","","0.0317","0.029","","","","0.0732","","","","","","1.013","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2010703","17.806","0.002","9.2562","0.0006","9.9337","0.0013","90","","105.955","0.006","90","","1574.2","0.3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","tetratintetracosamolybdenumoctatriacontaoxide","","- Mo24 O38 Sn4.4 -","- Mo24 O38 Sn4.402 -","- Mo48 O76 Sn8.804 -","2","0.5","BR1252","Barrier, N.; Tortelier, J.; Gougeon, P.","Sn~4.4~Mo~24~O~38~","Acta Crystallographica Section C","2000","56","3","269","271","10.1107/S0108270199015127","","","0.71073","MoKα","","0.045","0.032","","","","0.077","","","","","","1.252","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010704","3.8274","0.0006","7.1591","0.0011","8.7756","0.0013","87.595","0.002","82.735","0.002","75.639","0.002","231.06","0.06","299","2","299","2","","","","","","","","5","P -1","-P 1","2","","","","- Cd Cl4 Cu H8 O4 -","- Cd Cl4 Cu H8 O4 -","- Cd Cl4 Cu H8 O4 -","1","0.5","BR1267","Kortz, Ulrich; Dickman, Michael H.","Cadmium copper tetrachloride tetrahydrate","Acta Crystallographica Section C","2000","56","3","265","266","10.1107/S0108270199013712","","","0.71073","MoKα","","0.029","0.027","","","","0.071","","","","","","1.074","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2010705","8.73","0.002","10.189","0.002","7.147","0.001","90","","100.02","0.03","90","","626","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","manganese(II) nicotinate","Poly[trans-diaquamanganese(II)-μ-(3-pyridinecarboxylato-N:O)-μ-(3-pyridine- carboxylato-O:N)]","","- C12 H12 Mn N2 O6 -","- C12 H12 Mn N2 O6 -","- C24 H24 Mn2 N4 O12 -","2","0.5","BR1271","Hao, Xiang; Wei, Yong-Ge; Liu, Qun; Zhang, Shi-Wei","Poly[<i>trans</i>-diaquamanganese(II)-μ-(3-pyridinecarboxylato-<i>N</i>:<i>O</i>)-μ-(3-pyridinecarboxylato-<i>O</i>:<i>N</i>)]","Acta Crystallographica Section C","2000","56","3","296","298","10.1107/S0108270199015358","","","0.71069","MoKα","","0.0509","0.0384","","","","0.1079","","","","","","1.065","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010706","9.423","0.001","9.423","0.001","36.945","0.008","90","","90","","120","","2841","0.7","298","","298","","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","","","- Ba3 H6 O24 P6 V2 -","- Ba3 H6 O24 P6 V2 -","- Ba18 H36 O144 P36 V12 -","6","0.166667","BR1277","Harrison, William T. A.; Buttery, Jarrod H.","Barium vanadium(III) hydrogen phosphate, Ba~3~V~2~(HPO~4~)~6~","Acta Crystallographica Section C","2000","56","3","274","275","10.1107/S0108270199015735","","","0.71073","MoKα","","","0.047","","","","0.049","","","","","","1.06","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2010707","12.2522","0.0009","13.8727","0.001","22.2931","0.0016","79.743","0.001","80.829","0.001","64.077","0.001","3339.2","0.4","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C70 H22 Al B2 Cl F40 Li2 N2 -","- C70 H22 Al B2 Cl F40 Li2 N2 -","- C140 H44 Al2 B4 Cl2 F80 Li4 N4 -","2","1","DA1092","Guzei, Ilia A.; Radzewich, Catherine E.; Jordan, Richard F.","Halocarbon and arene coordination of lithium(I) in (1-anilino-3-phenyliminopropenyl)chloro(methyl)aluminium bis{[tetrakis(pentafluorophenyl)borato]lithium} benzene solvate","Acta Crystallographica Section C","2000","56","3","279","281","10.1107/S0108270199012135","","","0.71073","MoKα","","0.089","0.043","","","","0.094","","","","","","0.933","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010708","6.3714","0.0009","10.56","0.002","11.61","0.003","90","","98.616","0.014","90","","772.3","0.3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","7-Oxobicyclo[2.2.1]heptane-1-carboxylic acid","","- C8 H10 O3 -","- C8 H10 O3 -","- C32 H40 O12 -","4","1","FG1572","Wong, Jesse K.; Macalintal, Rose Ann R.; Brunskill, Andrew P. J.; Lalancette, Roger A.; Thompson, Hugh W.","7-Oxobicyclo[2.2.1]heptane-1-carboxylic acid and (±)-7-oxobicyclo[2.2.1]hept-5-ene-2-<i>endo</i>-carboxylic acid: hydrogen bonding in two norbornyl keto acids","Acta Crystallographica Section C","2000","56","3","371","373","10.1107/S0108270199015747","","","0.71073","MoKα","","0.074","0.047","","","","0.117","","","","","","1.05","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010709","6.0039","0.0009","10.5565","0.0014","22.151","0.002","90","","90","","90","","1403.9","0.3","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","(±)-7-oxobicyclo[2.2.1]hept-5-ene-2-endo-carboxylic acid","","- C8 H8 O3 -","- C8 H8 O3 -","- C64 H64 O24 -","8","1","FG1572","Wong, Jesse K.; Macalintal, Rose Ann R.; Brunskill, Andrew P. J.; Lalancette, Roger A.; Thompson, Hugh W.","7-Oxobicyclo[2.2.1]heptane-1-carboxylic acid and (±)-7-oxobicyclo[2.2.1]hept-5-ene-2-<i>endo</i>-carboxylic acid: hydrogen bonding in two norbornyl keto acids","Acta Crystallographica Section C","2000","56","3","371","373","10.1107/S0108270199015747","","","0.71073","MoKα","","0.082","0.048","","","","0.136","","","","","","1.03","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010710","6.326","0.0003","31.465","0.002","7.668","0.0004","90.264","0.001","95.891","0.001","90.154","0.001","1518.21","0.14","173","2","","","","","","","","","","5","P 1","P 1","1","","4-Chloroacetophenone [1-(4-methoxyphenyl)ethylidene]hydrazone","","- C17 H17 Cl N2 O -","- C17 H16.25 Cl N2 O -","- C68 H65 Cl4 N8 O4 -","4","4","FR1211","Lewis, Michael; Barnes, Charles L.; Glaser, Rainer","4-Chloroacetophenone [1-(4-methoxyphenyl)ethylidene]hydrazone","Acta Crystallographica Section C","2000","56","3","393","396","10.1107/S0108270199011737","","","0.71073","MoKα","","","0.05","","","","0.13","","","","","","1.108","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010711","18.055","0.006","14.661","0.005","17.598","0.006","90","","116.12","0.05","90","","4183","3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[Trans-(2-methylthiobenzoato)phenylbis(triphenylphosphine)palladium(II)]","","- C50 H42 O2 P2 Pd S -","- C50 H42 O2 P2 Pd S -","- C200 H168 O8 P8 Pd4 S4 -","4","1","FR1231","Kruger, Gert J.; Thompson, Catharine; Meyer, Wolfgang H.; Brüll, Robert; Raubenheimer, Helgard G.","<i>trans</i>-(2-Methylthiobenzoato-<i>O</i>)phenylbis(triphenylphosphine)palladium(II), two conformational isomers","Acta Crystallographica Section C","2000","56","3","329","331","10.1107/S0108270199015449","","","0.71073","MoKα","","0.085","0.044","","","","0.093","","","","","","0.999","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2010712","12.5741","0.0006","20.5817","0.0009","16.0672","0.0008","90","","99.186","0.001","90","","4104.8","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[Trans-(2-methylthiobenzoato)phenylbis(triphenylphosphine)palladium(II)]","","- C50 H42 O2 P2 Pd S -","- C50 H42 O2 P2 Pd S -","- C200 H168 O8 P8 Pd4 S4 -","4","1","FR1231","Kruger, Gert J.; Thompson, Catharine; Meyer, Wolfgang H.; Brüll, Robert; Raubenheimer, Helgard G.","<i>trans</i>-(2-Methylthiobenzoato-<i>O</i>)phenylbis(triphenylphosphine)palladium(II), two conformational isomers","Acta Crystallographica Section C","2000","56","3","329","331","10.1107/S0108270199015449","","","0.71073","MoKα","","0.061","0.044","","","","0.108","","","","","","1.042","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2010713","9.8574","0.0006","10.9503","0.0006","16.5057","0.001","100.142","0.001","95.803","0.001","96.244","0.001","1730.19","0.18","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","[(2-isopropylthio)benzoato-O,S]phenyl(triphenylphosphine)palladium(II) tetrahydrofuran solvate","","- C38 H39 O3 P Pd S -","- C37.996 H38.992 O2.999 P Pd S -","- C75.992 H77.984 O5.998 P2 Pd2 S2 -","2","1","FR1232","Thompson, Catharine; Kruger, Gert J.; Meyer, Wolfgang H.; Brüll, Robert; Raubenheimer, Helgard G.","[2-(Isopropylthio)benzoato-<i>O</i>,<i>S</i>]phenyl(triphenylphosphine)palladium(II) tetrahydrofuran solvate","Acta Crystallographica Section C","2000","56","3","332","333","10.1107/S0108270199016480","","","0.71073","MoKα","","0.048","0.041","","","","0.097","","","","","","1.103","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2010714","10.405","0.002","11.524","0.002","9.177","0.002","113.44","0.01","113.94","0.02","93.94","0.02","887.3","0.4","296.2","","296.2","","","","","","","","","4","P -1","-P 1","2","","","","- C24 H19 N O -","- C24 H19 N O -","- C48 H38 N2 O2 -","2","1","FR1233","Trujillo, Hernando A.; Simon, Wendy M.; Pelkey, Erin T.; Gribble, Gordon W.; Jasinski, Jerry P.","A novel class of fused heterocycles, benzo[<i>b</i>]furo[2,3-<i>c</i>]pyrroles","Acta Crystallographica Section C","2000","56","3","386","388","10.1107/S0108270199016492","","","0.7107","MoKα","","0.22","0.049","","0.207","","0.225","","","1.03","","","1.03","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010715","9.956","0.001","11.329","0.002","8.939","0.002","109.89","0.01","107.06","0.01","69.47","0.01","870.4","0.3","296.2","","296.2","","","","","","","","","4","P -1","-P 1","2","","","","- C24 H19 N O -","- C24 H19 N O -","- C48 H38 N2 O2 -","2","1","FR1233","Trujillo, Hernando A.; Simon, Wendy M.; Pelkey, Erin T.; Gribble, Gordon W.; Jasinski, Jerry P.","A novel class of fused heterocycles, benzo[<i>b</i>]furo[2,3-<i>c</i>]pyrroles","Acta Crystallographica Section C","2000","56","3","386","388","10.1107/S0108270199016492","","","0.7107","MoKα","","0.172","0.045","","0.15","","0.197","","","1.04","","","1.04","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010716","6.5848","0.0015","9.991","0.004","19.688","0.006","90","","93.31","0.03","90","","1293.1","0.7","170","2","170","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","(N-Maleoylglycinate)trimethyltin(IV)","(N-Maleoylglycinate)trimethyltin(IV)","","- C9 H13 N O4 Sn -","- C9 H13 N O4 Sn -","- C36 H52 N4 O16 Sn4 -","4","1","FR1244","Parvez, Masood; Bhatti, Moazzam Hussain; Ali, Saqib; Mazhar, Muhammad; Qureshi, Sajid Iqbal","(<i>N</i>-Maleoylglycinato)trimethyltin(IV)","Acta Crystallographica Section C","2000","56","3","327","328","10.1107/S0108270199016510","","","0.71069","MoKα","","0.0689","0.041","","","","0.147","","","","","","1.202","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010717","9.3933","0.0007","9.3963","0.0007","30.329","0.002","90","","90","","90","","2676.9","0.3","193","2","193","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C14 H20 O4 -","- C14 H20 O4 -","- C112 H160 O32 -","8","2","FR1250","Guzei, Ilia A.; Wang, Xuemei; Kraus, George A.","An angularly fused three-ring precursor to phytuberin","Acta Crystallographica Section C","2000","56","3","389","390","10.1107/S0108270199016522","","","0.71073","MoKα","","0.0575","0.038","","","","0.079","","","","","","1.048","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010718","11.016","0.0012","23.084","0.003","9.9323","0.0012","90","","98.977","0.009","90","","2494.8","0.5","173","","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","N-ethyl, aza,tribenzo-21-crown-7","","","- C28 H33 N O6 -","- C28 H33 N O6 -","- C112 H132 N4 O24 -","4","1","FR1254","Bryan, Jeffrey C.; Lavis, Jerôme M.; Hay, Benjamin P.; Sachleben, Richard A.","<i>N</i>-Ethylazatribenzo-21-crown-7","Acta Crystallographica Section C","2000","56","3","391","392","10.1107/S0108270199016534","","","0.71073","MoKα","","0.066","0.04","","","","0.11","","","","","","1.03","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010719","19.178","0.004","10.988","0.003","28.728","0.007","90","","101.75","0.02","90","","5927","3","85","","85","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1-(2,3,4,5,1',2',3',4'-octamethylferrocenium-1-yl)- 3-(ruthenocenyl)allylium bis-tetrafluoroborate","","- C31 H37 B2 F8 Fe Ru -","- C31 H37 B2 F8 Fe Ru -","- C248 H296 B16 F64 Fe8 Ru8 -","8","2","GD1066","Barlow, Stephen; Day, Michael W.; Marder, Seth R.","The one-electron oxidation product of a metallocenyl-terminated cyanine","Acta Crystallographica Section C","2000","56","3","303","304","10.1107/S0108270199015462","","","0.71073","MoKα","","0.0858","0.0515","","","","0.0951","","","","","","1.751","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010720","14.622","0.003","10.656","0.004","9.216","0.004","112.72","0.03","91.29","0.03","89.68","0.03","1324.2","0.9","296.2","","296.2","","","","","","","","","5","P -1","-P 1","2","","","","- C42 H60 N6 O18 P6 -","- C42 H60 N6 O18 P6 -","- C42 H60 N6 O18 P6 -","1","0.5","GS1058","Marouni, Houda; Rzaigui, Mohamed; Bagieu-Beucher, Muriel","(<i>m</i>-CH~3~C~6~H~4~NH~3~)~6~P~6~O~18~","Acta Crystallographica Section C","2000","56","3","356","357","10.1107/S0108270199015280","","","0.7107","MoKα","","0.0347","0.035","","0.05","","0.05","","","1.28","","","1.28","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2010721","12.18","0.001","12.18","0.001","12.18","0.001","90","","90","","90","","1806.9","0.3","160","2","160","2","","","","","","","","6","P n -3 m :2","-P 4bc 2bc 3","224","","hexaammonium tetra-μ~3~-selenido-tetrakis[tricyanomolybdenum] hexahydrate","","- C12 H36 Mo4 N18 O6 Se4 -","- C12 H36 Mo4 N18 O6 Se4 -","- C24 H72 Mo8 N36 O12 Se8 -","2","0.0416667","GS1060","Virovets, Alexander V.; Fedin, Vladimir P.; Samsonenko, Denis G.; Clegg, William","A new cluster complex, (NH~4~)~6~[Mo~4~Se~4~(CN)~12~]·6H~2~O, containing a tetranuclear mixed-valence molybdenum core","Acta Crystallographica Section C","2000","56","3","272","273","10.1107/S0108270199015644","","","0.71073","MoKα","","0.08","0.068","","","","0.184","","","","","","1.48","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010722","8.869","0.002","9.836","0.002","12.225","0.006","90","","91.4","0.03","90","","1066.1","0.6","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","(1S,4R,5R,6R)-(6-(methoxycarbonyl)-2-(pivaloyloxymethyl)-4- (pivaloyloxy)bicyclo[3.1.0]hex-2-en-1-yl)-1-carboxylic acid","","- C20 H28 O8 -","- C20 H28 O8 -","- C40 H56 O16 -","2","1","GS1062","Chiaroni, Angèle; Riche, Claude; Cachet, Xavier; Deguin, Brigitte; Koch, Michel; Tillequin, François","(1<i>S</i>,4<i>R</i>,5<i>R</i>,6<i>R</i>)-6-Methoxycarbonyl-4-pivaloyloxy-2-(pivaloyloxymethyl)bicyclo[3.1.0]hex-2-ene-1-carboxylic acid","Acta Crystallographica Section C","2000","56","3","358","359","10.1107/S0108270199015309","","","1.5418","CuKα","","0.0428","0.0398","","0.1104","","0.1075","","","1.055","","","1.055","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010723","13.394","0.003","7.598","0.0009","5.066","0.002","90","","127.23","0.02","90","","410.5","0.2","293","2","293","2","","","","","","","","2","C 1 2/m 1","-C 2y","12","","Iron-Zinc (1:13) alloy","","- Fe Zn13 -","- Fe Zn13 -","- Fe2 Zn26 -","2","0.25","GS1065","Belin, Renaud; Tillard, Monique; Monconduit, Laure","Redetermination of the iron‒zinc phase FeZn~13~","Acta Crystallographica Section C","2000","56","3","267","268","10.1107/S0108270199014997","","","0.71069","MoKα","","0.0751","0.0417","","","","0.1092","","","","","","1.025","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010724","20.376","0.001","13.0504","0.0008","15.887","0.0009","90","","110.491","0.001","90","","3957.3","0.4","120","","120","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","bpbpH5(Cl2)(ClO4)2","","","- C36 H44.264 Cl4 N6 O9.132 -","- C36 H44.264 Cl4 N6 O9.132 -","- C144 H177.056 Cl16 N24 O36.528 -","4","1","GS1067","Gomes, Jonnes Taylor; Hazell, Alan; McKenzie, Christine J.","2,6-Bis[bis(2-pyridiniomethyl)aminomethyl]-4-<i>tert</i>-butylphenol dichloride diperchlorate hydrate","Acta Crystallographica Section C","2000","56","3","382","383","10.1107/S0108270199016315","","","0.71073","MoKα","","","0.033","","","","0.037","","","","","","1.078","","","","has coordinates,has Fobs","194474","2020-10-21","18:00:00",""
"2010725","8.5424","0.0008","18.089","0.002","9.3202","0.0009","90","","90.898","0.011","90","","1440","0.3","160","2","160","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","bis(4-methylphenyl)maleonitrile","cis-α,α'-Dicyan-4,4'-dimethyl-stilben","","- C18 H14 N2 -","- C18 H14 N2 -","- C72 H56 N8 -","4","1","GS1070","Faulmann, Christophe; Cassoux, Patrick; Pullen, Anthony E.","A new precursor for the synthesis of porphyrazine: 2,3-bis(4-methylphenyl)maleonitrile","Acta Crystallographica Section C","2000","56","3","384","385","10.1107/S0108270199016479","","","0.71073","MoKα","","0.0735","0.0375","","","","0.0997","","","","","","0.953","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010726","6.374","0.001","10.588","0.002","11.303","0.002","71.35","0.03","78.45","0.03","85.97","0.03","708.1","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","1,2R,4S,5-tetraammonio-3-amino-pentane tetrachloride - hydrate","","- C5 H23 Cl4 N5 O -","- C5 H23 Cl4 N5 O -","- C10 H46 Cl8 N10 O2 -","2","1","JZ1372","Guido J. Reiss; Anja Zimmer; Kaspar Hegetschweiler","Protonation products of pentaaminopentane as novel building blocks for hydrogen-bonded networks","Acta Crystallographica Section C","2000","56","3","284","288","10.1107/S0108270199015024","","","0.71073","MoKα","","0.035","0.0278","","","","0.0751","","","","","","1.02","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010727","7.255","0.004","10.893","0.006","12.173","0.006","107.49","0.04","91.52","0.04","96.67","0.04","909.4","0.9","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","1,2R,3,4S,5-pentaammonio-pentane trichloride tetrachlorozinkate - hydrate","","- C5 H24 Cl7 N5 O Zn -","- C5 H24 Cl7 N5 O Zn -","- C10 H48 Cl14 N10 O2 Zn2 -","2","1","JZ1372","Guido J. Reiss; Anja Zimmer; Kaspar Hegetschweiler","Protonation products of pentaaminopentane as novel building blocks for hydrogen-bonded networks","Acta Crystallographica Section C","2000","56","3","284","288","10.1107/S0108270199015024","","","0.71073","MoKα","","0.0273","0.0266","","","","0.0717","","","","","","1.06","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010728","10.8157","0.0007","21.6466","0.0006","14.354","0.002","90","","95.114","0.008","90","","3347.2","0.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","2,2'-bipyridine bis{[(4-methylphenyl) sulfonyl]-2-pyridyl-amide}zinc(II)","","- C34 H30 N6 O4 S2 Zn -","- C34 H30 N6 O4 S2 Zn -","- C136 H120 N24 O16 S8 Zn4 -","4","1","JZ1373","Cabaleiro, Santiago; Castro, Jesús; Romero, Jaime; García-Vázquez, José A.; Sousa, Antonio","(2,2'-Bipyridine-κ^2^<i>N</i>)bis[<i>N</i>-(2-pyridyl-κ<i>N</i>)-<i>p</i>-toluenesulfonamido-κ<i>N</i>]zinc(II)","Acta Crystallographica Section C","2000","56","3","293","295","10.1107/S010827019901536X","","","1.54184","CuKα","","0.0946","0.0443","","","","0.1365","","","","","","1.018","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010729","9.6111","0.0009","11.5199","0.0012","11.5621","0.0012","84.458","0.001","77.829","0.001","74.138","0.001","1202.7","0.2","168","2","168","2","","","","","","","","3","P -1","-P 1","2","4,4-Diphenyl-6-(2,2-diphenyl-1-hydroxyethyl)-2-cyclohexen-1-one","4,4-Diphenyl-6-(2,2-diphenyl-1-hydroxyethyl)-2-cyclohexen-1-one","","- C32 H28 O2 -","- C32 H28 O2 -","- C64 H56 O4 -","2","1","JZ1380","Kumar, V.S. Senthil; Nangia, Ashwini","6-(1-Hydroxy-2,2-diphenylethyl)-4,4-diphenyl-2-cyclohexen-1-one","Acta Crystallographica Section C","2000","56","3","360","361","10.1107/S010827019901553X","","","0.71073","MoKα","","0.0495","0.0345","","","","0.0929","","","","","","1.051","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010730","19.289","0.001","7.074","0.0006","14.575","0.002","90","","113.448","0.009","90","","1824.5","0.3","293","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C9 H16 La2 O17 -","- C9 H14 La2 O17.002 -","- C36 H56 La8 O68.008 -","4","0.5","LN1092","Benmerad, Belkacem; Guehria-Laïdoudi, Achoura; Bernardinelli, Gérald; Balegroune, Fadila","Polymeric tetraaquatris(malonato)dilanthanum(III) monohydrate","Acta Crystallographica Section C","2000","56","3","321","323","10.1107/S0108270199016182","","","0.71073","MoKα","","","0.022","","","","0.028","","","","","","1.162","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010731","15.922","0.002","16.7908","0.0016","16.453","0.004","90","","90","","90","","4398.6","1.3","288","2","288","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C44 H62 N2 O12 -","- C44 H62 N2 O12 -","- C176 H248 N8 O48 -","4","0.5","NA1433","Kim, Jong Seung; Jensen, William P.; Lee, Chang-Hee; Lee, Jin-Ho; Kim, Moon-Jib; Kim, Jin-Gyu; Suh, Il-Hwan","25,27:26,28-Bis(3,9-dioxa-6-azaundecane-1,11-dioxy)calix[4]arene tetrahydrate","Acta Crystallographica Section C","2000","56","3","379","381","10.1107/S0108270199016327","","","0.71069","MoKα","","0.1239","0.0665","","","","0.205","","","","","","0.994","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010732","11.839","0.002","9.108","0.002","21.319","0.004","90","","90","","90","","2298.8","0.8","293","2","293","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","poly[bis[copper(I)-μ-(4,4'-bipyridyl)-N:N']-μ-dimolybdato-O:O']","","- C20 H16 Cu2 Mo2 N4 O7 -","- C20 H16 Cu2 Mo2 N4 O7 -","- C80 H64 Cu8 Mo8 N16 O28 -","4","0.5","NA1440","You, Wan-Sheng; Wang, En-Bo; Xu, Lin; Hu, Chang-Wen; Luan, Guo-You","Chains of (4,4'-bipyridyl)copper(I) bridged by dimolybdate units","Acta Crystallographica Section C","2000","56","3","289","290","10.1107/S0108270199015036","","","0.71073","MoKα","","0.041","0.028","","0.069","0.066","","","","0.899","0.994","0.994","","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010733","13.9828","0.0003","9.6029","0.0002","14.0432","0.0002","90","","113.764","0.0013","90","","1725.78","0.06","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","dichlorodiethylbis(pyridine)tin(IV)","","- C14 H20 Cl2 N2 Sn -","- C14 H20 Cl2 N2 Sn -","- C56 H80 Cl8 N8 Sn4 -","4","0.5","NA1442","Casas, José S.; García-Martínez, Emilia; Sánchez-González, Angeles; Sordo, José; Villar, Roberto","Dichlorodiethylbis(pyridine-<i>N</i>)tin(IV)","Acta Crystallographica Section C","2000","56","3","299","300","10.1107/S0108270199015371","","","0.71073","MoKα","","0.0607","0.0316","","","","0.0766","","","","","","0.999","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010734","7.832","0.0016","25.703","0.005","8.984","0.0018","90","","111.38","0.03","90","","1684.1","0.7","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","cis-dichloro-trans-dimethyl-cis-bis(N-methylpyrrolidin-2-one-O)tin(IV)","","- C12 H24 Cl2 N2 O2 Sn -","- C12 H24 Cl2 N2 O2 Sn -","- C48 H96 Cl8 N8 O8 Sn4 -","4","1","NA1448","König, Uwe-Christoph; Berkei, Michael; Neikes, Frank; Preut, Hans; Mitchell, Terence Nigel","Complexes of dimethyltin dihalides with <i>N</i>-methylpyrrolidinone, C~12~H~24~N~2~O~2~<i>X</i>~2~Sn (<i>X</i> = Cl, Br or I)","Acta Crystallographica Section C","2000","56","3","324","326","10.1107/S0108270199016388","","","0.71073","MoKα","","0.028","0.02","","","","0.05","","","","","","0.984","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010735","7.475","0.0015","8.03","0.0016","14.977","0.003","90","","91.98","0.03","90","","898.4","0.3","173","2","173","2","","","","","","","","6","P 1 n 1","P -2yac","7","","cis-dibromo-trans-dimethyl-cis-bis(N-methylpyrrolidin-2-one-O)tin(IV)","","- C12 H24 Br2 N2 O2 Sn -","- C12 H24 Br2 N2 O2 Sn -","- C24 H48 Br4 N4 O4 Sn2 -","2","1","NA1448","König, Uwe-Christoph; Berkei, Michael; Neikes, Frank; Preut, Hans; Mitchell, Terence Nigel","Complexes of dimethyltin dihalides with <i>N</i>-methylpyrrolidinone, C~12~H~24~N~2~O~2~<i>X</i>~2~Sn (<i>X</i> = Cl, Br or I)","Acta Crystallographica Section C","2000","56","3","324","326","10.1107/S0108270199016388","","","0.71073","MoKα","","0.04","0.038","","","","0.104","","","","","","1.115","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010736","7.396","0.001","8.327","0.002","15.406","0.003","90","","90.31","0.03","90","","948.8","0.3","173","2","173","2","","","","","","","","6","P 1 n 1","P -2yac","7","","cis-diiodo-trans-dimethyl-cis-bis(N-methylpyrrolidin-2-one-O)tin(IV)","","- C12 H24 I2 N2 O2 Sn -","- C12 H24 I2 N2 O2 Sn -","- C24 H48 I4 N4 O4 Sn2 -","2","1","NA1448","König, Uwe-Christoph; Berkei, Michael; Neikes, Frank; Preut, Hans; Mitchell, Terence Nigel","Complexes of dimethyltin dihalides with <i>N</i>-methylpyrrolidinone, C~12~H~24~N~2~O~2~<i>X</i>~2~Sn (<i>X</i> = Cl, Br or I)","Acta Crystallographica Section C","2000","56","3","324","326","10.1107/S0108270199016388","","","0.71069","MoKα","","0.03","0.024","","","","0.043","","","","","","0.946","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010737","23.802","0.004","8.955","0.001","13.82","0.002","90","","97.55","0.01","90","","2920.2","0.7","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","(2,2'-dipyridyl sulfide-N,N')hydroxybis(nitrito-O)(nitrosyl-O)ruthenium(II)","","- C10 H9 N5 O6 Ru S -","- C10 H9 N5 O6 Ru S -","- C80 H72 N40 O48 Ru8 S8 -","8","1","OS1084","Bruno, Giuseppe; Nicoló, Francesco; Tresoldi, Giuseppe","(2,2'-Dipyridyl sulfide-<i>N</i>,<i>N</i>')hydroxybis(nitrito-<i>O</i>)(nitrogen monoxide-<i>N</i>)ruthenium(III)","Acta Crystallographica Section C","2000","56","3","282","283","10.1107/S0108270199014687","","","0.71073","MoKα","","0.043","0.028","","","","0.064","","","","","","0.879","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010738","8.043","0.001","17.482","0.004","15.237","0.003","90","","102.3","0.01","90","","2093.3","0.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","trans-Diaqua(C-meso-5,12-dimethyl-1,4,8,11- tetraazacyclotetradecane-N,N',N'',N''')copper(II) dichloride dihydrate","","- C12 H36 Cl2 Cu N4 O4 -","- C12 H36 Cl2 Cu N4 O4 -","- C48 H144 Cl8 Cu4 N16 O16 -","4","1","OS1090","Panneerselvam, Kaliyamoorthy; Lu, Tian-Huey; Chi, Ta-Yung; Tung, Shu-Fang; Chung, Chung-Sun","<i>trans</i>-Diaqua(<i>C</i>-<i>meso</i>-5,12-dimethyl-1,4,8,11-tetraazacyclotetradecane-<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''')copper(II) dichloride dihydrate","Acta Crystallographica Section C","2000","56","3","301","302","10.1107/S0108270199015474","","","0.71073","MoKα","","0.041","0.028","","","","0.076","","","","","","1.016","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010739","11.848","0.003","11.015","0.004","12.313","0.004","90","","109.01","0.03","90","","1519.3","0.9","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-methyl-1,4-thiazino[2,3-c;6,5-c']diquinoline","","- C19 H13 N3 S -","- C19 H13 N3 S -","- C76 H52 N12 S4 -","4","1","OS1091","Pluta, Krystian; Suwińska, Kinga","Azinyl sulfides. L. 14-Methyl-1,4-thiazino[2,3-<i>c</i>;6,5-<i>c</i>']diquinoline","Acta Crystallographica Section C","2000","56","3","374","375","10.1107/S0108270199015759","","","0.71073","MoKα","","0.076","0.042","","0.138","","0.109","","","1.032","","","1.14","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010740","9.707","0.0005","11.575","0.0006","11.592","0.0007","71.333","0.003","85.678","0.004","73.601","0.003","1183.58","0.12","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","4,5-bis[(2-hydroxyethyl)thio]-2-{4,5-bis[(2-hydroxyethyl)thio]-1,3-dithiol-2- ylidene}-1,3-dithiole","","- C14 H20 B F4 O4 S8 -","- C14 H20 B F4 O4 S8 -","- C28 H40 B2 F8 O8 S16 -","2","1","QA0207","Yao, Youxin; Zeng, Wenju; Zhang, Bin; Liu, Yunqi; Zhu, Daoben","2,3,4,5-Tetrakis[(2-hydroxyethyl)thio]tetrathiafulvalene tetrafluoroborate","Acta Crystallographica Section C","2000","56","3","e90","e91","10.1107/S0108270100001219","","","0.71073","MoKα","","0.06","0.055","","","","0.149","","","","","","1.075","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010741","7.699","0.002","9.341","0.002","12.934","0.003","77.77","0.03","78.52","0.03","69.09","0.03","841.4","0.4","153","","153","","","","","","","","","4","P -1","-P 1","2","tetramethylethyliden- bis(cyclopentadienyl)zirconiumbis(tetrahydroborate)'","","","- C16 H28 B2 Zr -","- C16 H28 B2 Zr -","- C32 H56 B4 Zr2 -","2","1","QA0209","Schaper, Frank; Brintzinger, Hans-Herbert","[{Me~4~C~2~(C~5~H~4~)~2~}Zr(BH~4~)~2~], a bis(tetrahydroborate) complex of a bridged zirconocene","Acta Crystallographica Section C","2000","56","3","e78","e78","10.1107/S0108270100002250","","","0.71073","MoKα","","0.027","0.023","","","","0.058","","","","","","1.037","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010742","15.975","0.002","15.773","0.002","17.142","0.002","90","","100.51","0.01","90","","4246.9","0.9","293","","293","","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","2,2'-(9,9-dihexyl)bifluorene","","- C50 H66 -","- C50 H66 -","- C200 H264 -","4","1","QA0213","Suchod, Bernadette; Stéphan, Olivier","2,2'-Bi(9,9-dihexylfluorene)","Acta Crystallographica Section C","2000","56","3","e92","e93","10.1107/S0108270100001499","","","0.71073","MoKα","","0.158","0.1","","0.043","","0.039","","","1.267","","","1.511","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2010743","11.85","0.003","10.913","0.004","17.506","0.002","90","","107.76","0.01","90","","2156","1","298.2","","298.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","sparfloxacin","","","- C19 H28 F2 N4 O6 -","- C19 H28 F2 N4 O6 -","- C76 H112 F8 N16 O24 -","4","1","QA0214","Sivalakshmidevi, A.; Vyas, K.; Om Reddy, G.","Sparfloxacin, an antibacterial drug","Acta Crystallographica Section C","2000","56","3","e115","e116","10.1107/S0108270100002523","","","1.5418","CuKα","","0.067","0.059","","0.111","","0.108","","","1.909","","","1.987","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010744","6.7837","0.0013","9.0268","0.0011","13.237","0.002","90","","101.02","0.02","90","","795.6","0.2","180","2","180","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Pyridinium-dihydrohenmonothiophosphate","","- C5 H8 N O3 P S -","- C5 H8 N O3 P S -","- C20 H32 N4 O12 P4 S4 -","4","1","QA0216","Ziemer, Burkhard; Rabis, Annegrit","Pyridinium dihydrogenmonothiophosphate","Acta Crystallographica Section C","2000","56","3","e94","e94","10.1107/S0108270100001517","","","0.71073","MoKα","","0.037","0.029","","","","0.077","","","","","","1.041","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010745","13.26","0.02","6.677","0.007","10.766","0.007","90","","90","","90","","953.2","1.9","295","","295","","","","","","","","","4","P n a 21","P 2c -2n","33","RTA","","","- As O5 Rb Ti -","- As O5 Rb Ti -","- As8 O40 Rb8 Ti8 -","8","2","QA0218","Nordborg, Jenni; Svensson, Göran; Albertsson, Jörgen","A single-crystal neutron diffraction study of RbTiOAsO~4~","Acta Crystallographica Section C","2000","56","3","e73","e74","10.1107/S0108270100001505","","neutron","1.207","neutron","","0.036","0.034","","0.033","","0.033","","","1.363","","","1.361","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2010746","10.029","0.002","10.029","0.002","10.029","0.002","90","","90","","90","","1008.7","0.3","173","2","173","2","","","","","","","","4","F m -3 m","-F 4 2 3","225","","","","- Cl2 H18 N6 Ni -","- Cl2 H18 N6 Ni -","- Cl8 H72 N24 Ni4 -","4","0.0208333","QA0219","Wagner, Matthias; Lerner, Hans-Wolfram; Bolte, Michael","Redetermination of [Ni(NH~3~)~6~]Cl~2~ at 173K","Acta Crystallographica Section C","2000","56","3","e77","e77","10.1107/S0108270100002262","","","0.71073","MoKα","","0.013","0.013","","","","0.033","","","","","","1.319","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010747","8.5893","0.0006","10.3543","0.0006","10.9893","0.0006","69.194","0.005","87.122","0.005","66.172","0.005","830.75","0.1","293","","293","2","","","","","","","","5","P -1","-P 1","2","","","","- H20 K4 Na2 O38 V10 -","- H20 K4 Na2 O38 V10 -","- H20 K4 Na2 O38 V10 -","1","0.5","QA0220","Matias, Pedro M.; Pessoa, João C.; Duarte, Maria Teresa; Madeira, Catarina","Tetrapotassium disodium decavanadate(V) decahydrate","Acta Crystallographica Section C","2000","56","3","e75","e76","10.1107/S0108270100001530","","","0.71069","MoKα","","0.033","0.028","","","","0.074","","","","","","1.098","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010748","11.2341","0.0017","6.8536","0.0011","13.0566","0.0012","90","","97.307","0.009","90","","997.1","0.2","294","1","294","1","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","7,7-Dichloro-1,6-dimethyl-2-oxa-5-thiabicyclo[4.1.0]heptane 5,5-dioxide","","- C7 H10 Cl2 O3 S -","- C7 H10 Cl2 O3 S -","- C28 H40 Cl8 O12 S4 -","4","1","QA0222","Brewer, A. David; Ferguson, George; Znotins, Andrew A.","7,7-Dichloro-1,6-dimethyl-2-oxa-5-thiabicyclo[4.1.0]heptane 5,5-dioxide and 6-chloro-2,3-dihydro-7-methyl-5-methylene-2<i>H</i>,3<i>H</i>,5<i>H</i>-1,4-dithiepine 1,1,4,4-tetraoxide","Acta Crystallographica Section C","2000","56","3","e109","e110","10.1107/S0108270100002286","","","0.71073","MoKα","","0.042","0.029","","","","0.075","","","","","","1.063","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010749","8.0689","0.0008","8.1209","0.001","9.9329","0.0014","92.01","0.011","110.855","0.011","119.21","0.011","513.19","0.14","294","1","294","1","","","","","","","","5","P -1","-P 1","2","","6-chloro-2,3-dihydro-7-methyl-5-methylene-2H,3H,5H-1,4-dithiepine 1,1,4,4-tetraoxide","","- C7 H9 Cl O4 S2 -","- C7 H9 Cl O4 S2 -","- C14 H18 Cl2 O8 S4 -","2","1","QA0222","Brewer, A. David; Ferguson, George; Znotins, Andrew A.","7,7-Dichloro-1,6-dimethyl-2-oxa-5-thiabicyclo[4.1.0]heptane 5,5-dioxide and 6-chloro-2,3-dihydro-7-methyl-5-methylene-2<i>H</i>,3<i>H</i>,5<i>H</i>-1,4-dithiepine 1,1,4,4-tetraoxide","Acta Crystallographica Section C","2000","56","3","e109","e110","10.1107/S0108270100002286","","","0.71073","MoKα","","0.031","0.029","","","","0.076","","","","","","1.066","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010750","5.245","0.002","16.915","0.002","10.461","0.002","90","","101.21","0.02","90","","910.4","0.4","296","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","trans-diaqua-bis(N-acetylanthranilato-O,O')copper(II)","","- C18 H20 Cu N2 O8 -","- C18 H20 Cu N2 O8 -","- C36 H40 Cu2 N4 O16 -","2","0.5","QA0223","Kani, Yoshiyuki; Tsuchimoto, Masanobu; Ohba, Shigeru","<i>trans</i>-Diaquabis(<i>N</i>-acetylanthranilato-<i>O</i>,<i>O</i>')copper(II)","Acta Crystallographica Section C","2000","56","3","e79","e79","10.1107/S0108270100002274","","","0.71073","MoKα","","","0.052","","","","0.058","","","","","","1.404","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010751","9.633","0.002","10.665","0.001","9.03","0.002","112.28","0.01","110.19","0.02","83.72","0.01","805.5","0.3","297","","297","","","","","","","","","4","P -1","-P 1","2","","","","- C24 H44 Cu2 O10 -","- C24 H44 Cu2 O10 -","- C24 H44 Cu2 O10 -","1","0.5","QA0224","Kani, Yoshiyuki; Tsuchimoto, Masanobu; Ohba, Shigeru; Tokii, Tadashi","<i>catena</i>-Poly[[tetrakis(μ-2,2-dimethylpropionato-<i>O</i>:<i>O</i>')dicopper(II)]-μ-dioxane-<i>O</i>:<i>O</i>'] and <i>catena</i>-poly[[tetrakis(μ-3,3-dimethylbutyrato-<i>O</i>:<i>O</i>')dicopper(II)]-μ-dioxane-<i>O</i>,<i>O</i>']","Acta Crystallographica Section C","2000","56","3","e80","e81","10.1107/S0108270100002304","","","0.71073","MoKα","","","0.051","","","","0.07","","","","","","1.08","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010752","10.08","0.001","11.308","0.002","8.952","0.001","113.3","0.01","108.92","0.01","84.64","0.01","885.8","0.2","298","","","","","","","","","","","4","P -1","-P 1","2","","","","- C28 H52 Cu2 O10 -","- C28 H52 Cu2 O10 -","- C28 H52 Cu2 O10 -","1","0.5","QA0224","Kani, Yoshiyuki; Tsuchimoto, Masanobu; Ohba, Shigeru; Tokii, Tadashi","<i>catena</i>-Poly[[tetrakis(μ-2,2-dimethylpropionato-<i>O</i>:<i>O</i>')dicopper(II)]-μ-dioxane-<i>O</i>:<i>O</i>'] and <i>catena</i>-poly[[tetrakis(μ-3,3-dimethylbutyrato-<i>O</i>:<i>O</i>')dicopper(II)]-μ-dioxane-<i>O</i>,<i>O</i>']","Acta Crystallographica Section C","2000","56","3","e80","e81","10.1107/S0108270100002304","","","0.71073","MoKα","","","0.041","","","","0.075","","","","","","1.067","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010753","6.4262","0.0003","11.0841","0.0004","12.9142","0.0005","90","","90","","90","","919.86","0.06","110","2","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(1R)-1,8,8-Trimethyl-3-oxabicyclo[3.2.1]octane-2,4-dione","","- C10 H14 O3 -","- C10 H14 O3 -","- C40 H56 O12 -","4","1","QB0154","Kumaradhas, P; Levendis, D. C.; Koritsanszky, T.","The low-temperature study of <small>D</small>- and <small>DL</small>-camphoric anhydride","Acta Crystallographica Section C","2000","56","3","e103","e104","10.1107/S0108270100001840","","","0.71073","MoKα","","0.029","0.029","","0.073","","0.072","","","1.109","","","1.109","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010754","6.4152","0.0004","11.4413","0.0008","12.5623","0.0008","90","","91.968","","90","","921.51","0.1","110","2","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(R/S)-1,8,8-Trimethyl-3-oxabicyclo[3.2.1]octane-2,4-dione","","- C10 H14 O3 -","- C10 H14 O3 -","- C40 H56 O12 -","4","1","QB0154","Kumaradhas, P; Levendis, D. C.; Koritsanszky, T.","The low-temperature study of <small>D</small>- and <small>DL</small>-camphoric anhydride","Acta Crystallographica Section C","2000","56","3","e103","e104","10.1107/S0108270100001840","","","0.71073","MoKα","","0.032","0.032","","0.082","","0.081","","","1.063","","","1.063","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010755","4.845","0.002","18.369","0.006","13.7745","0.0012","90","","91.77","0.02","90","","1225.3","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(2-phenylazophenyl-C,N')selenium iodide","","- C12 H9 I N2 Se -","- C12 H9 I N2 Se -","- C48 H36 I4 N8 Se4 -","4","1","QB0162","Majeed, Zulfiqar; McWhinnie, William R.; Lowe, Philip R.","A T-shaped selenenyl halide","Acta Crystallographica Section C","2000","56","3","e105","e106","10.1107/S0108270100001852","","","0.71073","MoKα","","0.064","0.043","","","","0.122","","","","","","1.168","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010756","5.6528","0.0001","11.1532","0.0002","16.9897","0.0001","90","","90","","90","","1071.15","0.03","158","2","158","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","N-acetyl-L-phenylalanine","","","- C11 H13 N O3 -","- C11 H13 N O3 -","- C44 H52 N4 O12 -","4","1","QB0164","Stout, Kyle L.; Hallock, Kevin J.; Kampf, Jeff W.; Ramamoorthy, Ayyalusamy","<i>N</i>-Acetyl-<small>L</small>-phenylalanine","Acta Crystallographica Section C","2000","56","3","e100","e100","10.1107/S0108270100001712","","","0.71073","MoKα","","0.03","0.028","","","","0.077","","","","","","1.077","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010757","13.249","0.003","10.801","0.002","21.193","0.005","90","","104.5","0.02","90","","2936.2","1.1","203","2","203","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis[2-(diphenylphosphinyl)benzene] disulfide","","- C36 H28 O2 P2 S2 -","- C36 H28 O2 P2 S2 -","- C144 H112 O8 P8 S8 -","4","0.5","QB0174","Perez-Lourido, P.; Garcia-Vazquez, J. A.; Romero, J.; Fernandez, P.; Sousa-Pedrares, A.; Sousa, A.","Bis[2-(diphenylphosphinoyl)benzene] disulfide","Acta Crystallographica Section C","2000","56","3","e101","e102","10.1107/S0108270100001797","","","0.71073","MoKα","","0.073","0.042","","","","0.091","","","","","","1.033","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010758","7.1952","0.0013","17.356","0.003","8.3298","0.0016","90","","111.148","0.014","90","","970.2","0.3","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H8 N2 O3 -","- C10 H8 N2 O3 -","- C40 H32 N8 O12 -","4","1","QB0175","Nesterov, Vladimir N.; Kislyi, Victor P.; Timofeeva, Tatiana V.; Antipin, Mikhail Yu.; Semenov, Victor V.","<i>trans</i>-1-Cyano-2-(2-methoxyphenyl)-1-nitroethylene","Acta Crystallographica Section C","2000","56","3","e107","e108","10.1107/S0108270100001864","","","0.71073","MoKα","","0.106","0.055","","","","0.14","","","","","","1.112","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010759","7.9608","0.0001","10.6844","0.0001","12.8215","0.0003","93.577","0.001","97.737","0.001","99.046","0.001","1063.28","0.03","150","2","150","2","","","","","","","","5","P -1","-P 1","2","Pyrazolo[1,5-a]pyridine","2-[(4-Bromophenyl)-4-cyano-5-ferrocenylpyrazolo[1,5-a]pyridin-7yl] acetonitrile","","- C26 H17 Br Fe N4 -","- C26 H17 Br Fe N4 -","- C52 H34 Br2 Fe2 N8 -","2","1","QB0178","Sarkhel, Sanjay; Srivastava, Prativa; Ram, Vishnu J.; Maulik, Prakas R.; Broder, Charlotte K.; Howard, Judith A. K.","A highly functionalized ferrocenylpyrazolo[2,3-<i>a</i>]pyridine","Acta Crystallographica Section C","2000","56","3","e88","e89","10.1107/S0108270100002535","","","0.71073","MoKα","","0.068","0.048","","0.14","0.106","","","","1.028","0.933","0.933","","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010760","16.685","0.002","16.685","0.002","5.468","0.001","90","","90","","120","","1318.3","0.3","293","","","","","","","","","","","4","R 3 :H","R 3","146","","tribenzylphosphine oxide","","- C21 H21 O P -","- C21 H21 O P -","- C63 H63 O3 P3 -","3","0.333333","QB0179","Novoa de Armas, Héctor; Pérez, Hiram; Peeters, Oswald M.; Blaton, Norbert M.; De Ranter, Camiel J.; López, José Manuel","Tribenzylphosphine oxide","Acta Crystallographica Section C","2000","56","3","e98","e99","10.1107/S0108270100001566","","","0.71073","MoKα","","0.034","0.032","","0.088","","0.088","","","1.068","","","1.068","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010761","13.9691","0.001","13.9691","0.001","32.39","0.003","90","","90","","120","","5473.7","0.8","293","2","293","2","","","","","","","","6","R -3 :H","-R 3","148","","Hexakis(antipyrine-O)terbium(III) triperchlorate","","- C66 H72 Cl3 N12 O18 Tb -","- C66 H72 Cl3 N12 O18 Tb -","- C198 H216 Cl9 N36 O54 Tb3 -","3","0.166667","QB0180","Su, Cheng-Yong; Yang, Xiao-Ping; Xu, An-Wu; Zhang, Ze-Fu; Liu, Hong-Ke; Kang, Bei-Sheng","Hexakis(antipyrine-<i>O</i>)terbium(III) triperchlorate","Acta Crystallographica Section C","2000","56","3","e82","e83","10.1107/S0108270100002298","","","0.71073","MoKα","","0.046","0.045","","","","0.11","","","","","","1.042","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010762","19.608","0.004","4.786","0.002","20.461","0.006","90","","97.91","0.02","90","","1901.9","1","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","caulerpin","Dimethyl-6,13-dihydrodibenzo[b,i]phenazine-5,12-dicarboxylate","","- C24 H18 N2 O4 -","- C24 H18 N2 O4 -","- C96 H72 N8 O16 -","4","0.5","QB0181","Parvez, Masood; Ara, Jehan; Sultana, Viqar; Qasim, Rashida; Ahmad, Viqar Uddin","Caulerpin","Acta Crystallographica Section C","2000","56","3","e96","e97","10.1107/S0108270100001529","","","0.71069","MoKα","","0.118","0.049","","","","0.232","","","","","","1.19","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010763","7.3275","0.0001","7.6321","0.0002","12.6379","0.0004","95.809","0.002","96.991","0.001","92.244","0.002","696.96","0.03","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Bis(N,N-dimethylthiocarbamoylthio)acetic acid","","- C8 H14 N2 O2 S4 -","- C8 H14 N2 O2 S4 -","- C16 H28 N4 O4 S8 -","2","1","QB0182","Muniandy, Suresh; Low, Kum Sang; Naumov, Pance; Shanmuga Sundara Raj, S.; Fun, Hoong-Kun; Razak, Ibrahim Abdul; Ng, Seik Weng","Bis(<i>N</i>,<i>N</i>-dimethylthiocarbamoylthio)acetic acid","Acta Crystallographica Section C","2000","56","3","e113","e114","10.1107/S0108270100002511","","","0.71073","MoKα","","0.073","0.053","","","","0.139","","","","","","0.946","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010764","7.251","0.001","28.761","0.003","9.635","0.001","90","","90","","90","","2009.3","0.4","298","2","298","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","Bis[(bis-2-hydroxyethyl)dithiocarbamato]dimethyltin(IV)","","- C12 H26 N2 O4 S4 Sn -","- C12 H26 N2 O4 S4 Sn -","- C48 H104 N8 O16 S16 Sn4 -","4","0.5","QB0183","Yang Farina, A. Aziz; Othman, Abdul Hamid; Baba, Ibrahim; Sivakumar, K.; Fun, Hoong-Kun; Ng, Seik Weng","Bis[<i>N</i>,<i>N</i>-bis(2-hydroxyethyl)dithiocarbamato]dimethyltin(IV)","Acta Crystallographica Section C","2000","56","3","e84","e85","10.1107/S0108270100002407","","","0.71073","MoKα","","0.035","0.027","","","","0.073","","","","","","1.049","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010765","10.155","0.003","15.638","0.005","20.102","0.006","90","","104.56","0.01","90","","3089.8","1.6","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Bis(dicyclohexylammonium) adipate monohydrate","","- C30 H58 N2 O5 -","- C30 H58 N2 O5 -","- C120 H232 N8 O20 -","4","0.5","QB0184","Yang, Yang-Yi; Chen, Xiao-Ming; Ng, Seik Weng","Bis(dicyclohexylammonium) adipate monohydrate","Acta Crystallographica Section C","2000","56","3","e111","e112","10.1107/S0108270100002419","","","0.71073","MoKα","","0.125","0.059","","","","0.159","","","","","","0.977","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010766","11.2608","0.0006","13.0527","0.0005","14.6607","0.0006","90","","90","","90","","2154.89","0.17","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Triphenyltin 3-ureidopropionate","Catena-poly[triphenyltin-μu-(3-ureidopropionato-O:O')]","","- C22 H22 N2 O3 Sn -","- C22 H22 N2 O3 Sn -","- C88 H88 N8 O12 Sn4 -","4","1","QB0186","Ng, Seik Weng","Orthorhombic modification of triphenyltin 3-ureidopropionate","Acta Crystallographica Section C","2000","56","3","e86","e87","10.1107/S0108270100002432","","","0.71073","MoKα","","0.044","0.034","","","","0.077","","","","","","1.056","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010767","17.7426","0.0009","15.5402","0.0006","19.8147","0.001","90","","104.279","0.002","90","","5294.6","0.4","127","2","127","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C55 H76 O11 -","- C55 H76 O11 -","- C220 H304 O44 -","4","1","SK1335","Thuéry, Pierre; Nierlich, Martine; Asfari, Zouhair; Vicens, Jacques","5,11,17,23-Tetra-<i>tert</i>-butyl-25,27-bis(carboxymethoxy)-26,28-bis(2-methoxyethoxy)calix[4]arene‒methanol (1/1)","Acta Crystallographica Section C","2000","56","3","343","344","10.1107/S010827019901522X","","","0.71073","MoKα","","0.101","0.055","","","","0.138","","","","","","1.009","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010768","8.752","0.002","10.525","0.005","20.619","0.005","90","","90","","90","","1899.3","1.1","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","5-Amino-6-phenyl-1,6-dihydropyridazin-3(2H)-one","","- C10 H9 N3 O -","- C10 H9 N3 O -","- C80 H72 N24 O8 -","8","1","SK1336","Novoa de Armas, Héctor; Blaton, Norbert M.; Peeters, Oswald M.; De Ranter, Camiel J.; Pita, Beatriz; Sotelo, Eddy; Ravinã, Enrique; Suárez, Margarita","5-Amino-6-phenyl-1,6-dihydropyridazin-3(2<i>H</i>)-one","Acta Crystallographica Section C","2000","56","3","345","346","10.1107/S0108270199015231","","","1.54178","CuKα","","0.043","0.038","","","","0.104","","","1.1","","","1.1","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010769","9.2597","0.0002","14.5473","0.0003","13.9263","0.0002","90","","90.726","0.001","90","","1875.77","0.06","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis[bis(diethylenetriamine)Zinc(II)] ferrocyanide tetrahydrate [Zn(dien)~2~]~2~Fe(CN)~6~. 4H~2~O, (dien = diethylenetriamine, NH~2~CH=CHNHCH=CHNH~2~)","","- C22 H60 Fe N18 O4 Zn2 -","- C22 H60 Fe N18 O4 Zn2 -","- C44 H120 Fe2 N36 O8 Zn4 -","2","0.5","SK1341","Razak, Ibrahim Abdul; Shanmuga Sundara Raj, S.; Fun, Hoong-Kun; Tong, Ye-Xiang; Lu, Zhong-Lin; Kang, Bei-Sheng","Bis[bis(diethylenetriamine)zinc(II)] hexacyanoferrate tetrahydrate","Acta Crystallographica Section C","2000","56","3","291","292","10.1107/S0108270199015176","","","0.71073","MoKα","","0.039","0.028","","","","0.069","","","","","","1.07","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010770","6.758","0.001","8.844","0.001","7.075","0.002","90","","93.5","0.01","90","","422.07","0.14","183","","","","","","","","","","Synthetic","3","P 1 21/c 1","-P 2ybc","14","","metaboric acid, β-phase","Clinometaborite","- B H O2 -","- B H O2 -","- B12 H12 O24 -","12","3","SK1343","Freyhardt, Clemens C.; Wiebcke, Michael; Felsche, Jürgen","The monoclinic and cubic phases of metaboric acid (precise redeterminations)","Acta Crystallographica Section C","2000","56","3","276","278","10.1107/S0108270199016042","","","0.71073","MoKα","","","0.0309","","","","0.0872","","","","","","1.076","","","","has coordinates,has Fobs","282068","2023-03-26","10:12:03",""
"2010771","8.8811","0.0003","8.8811","0.0003","8.8811","0.0003","90","","90","","90","","700.49","0.04","183","","","","","","","","","","Synthetic","3","P -4 3 n","P -4n 2 3","218","","metaboric acid, γ-phase","Metaborite","- B H O2 -","- B H O2 -","- B24 H24 O48 -","24","1","SK1343","Freyhardt, Clemens C.; Wiebcke, Michael; Felsche, Jürgen","The monoclinic and cubic phases of metaboric acid (precise redeterminations)","Acta Crystallographica Section C","2000","56","3","276","278","10.1107/S0108270199016042","","","0.71073","MoKα","","","0.019","","","","0.0445","","","","","","1.015","","","","has coordinates,has Fobs","282068","2023-03-26","10:12:03",""
"2010772","17.7759","0.0003","9.0661","0.0002","23.5939","0.0003","90","","90","","90","","3802.35","0.12","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","N-benzyl-2'-iodocinnamanilide","","- C22 H18 I N O -","- C22 H18 I N O -","- C176 H144 I8 N8 O8 -","8","1","SK1348","Renganayaki, S.; Subramanian, E.; Shanmuga Sundara Raj, S.; Fun, Hoong-Kun","<i>N</i>-Benzyl-2'-iodocinnamanilide and <i>N</i>-benzyl-2'-iodo-4'-methyl-2-phenylcinnamanilide","Acta Crystallographica Section C","2000","56","3","349","350","10.1107/S0108270199015243","","","0.71073","MoKα","","0.127","0.059","","","","0.095","","","","","","1.091","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010773","10.815","0.0002","11.3607","0.0002","20.2477","0.0005","90","","91.271","0.001","90","","2487.14","0.09","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-benzyl-2'-iodo-4'-methyl-2-phenylcinnamanilide","","- C29 H24 I N O -","- C29 H24 I N O -","- C116 H96 I4 N4 O4 -","4","1","SK1348","Renganayaki, S.; Subramanian, E.; Shanmuga Sundara Raj, S.; Fun, Hoong-Kun","<i>N</i>-Benzyl-2'-iodocinnamanilide and <i>N</i>-benzyl-2'-iodo-4'-methyl-2-phenylcinnamanilide","Acta Crystallographica Section C","2000","56","3","349","350","10.1107/S0108270199015243","","","0.71073","MoKα","","0.158","0.057","","","","0.102","","","","","","0.958","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010774","11.724","0.005","10.911","0.004","14.218","0.006","90","","113.11","0.04","90","","1672.8","1.3","180","1","180","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(±)-9-(2-Bromophenyl)-7,7-dimethyl-1,3,4,5,6,7,8,9-octahydrofuro[3,4- b]quinoline-1,8-dione","","- C19 H18 Br N O3 -","- C19 H18 Br N O3 -","- C76 H72 Br4 N4 O12 -","4","1","SK1350","Şimşek, Rahime; Linden, Anthony; Şafak, Cihat","(±)-9-(2-Bromophenyl)-7,7-dimethyl-1,3,4,5,6,7,8,9-octahydrofuro[3,4-<i>b</i>]quinoline-1,8-dione","Acta Crystallographica Section C","2000","56","3","351","353","10.1107/S0108270199015255","","","0.71069","MoKα","","0.16","0.059","","","","0.165","","","","","","0.967","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010775","3.974","0.003","9.164","0.008","19.172","0.006","90","","90","","90","","698.2","0.8","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2-bromo-5-hydroxybenzaldehyde","","- C7 H5 Br O2 -","- C7 H5 Br O2 -","- C28 H20 Br4 O8 -","4","1","SK1352","Matos Beja, A.; Paixão, J. A.; Ramos Silva, M.; Alte da Veiga, L.; d'A. Rocha Gonsalves, A. M.; Serra, A. C.","2-Bromo-5-hydroxybenzaldehyde","Acta Crystallographica Section C","2000","56","3","354","355","10.1107/S0108270199015267","","","0.71073","MoKα","","0.0575","0.0227","","","","0.0509","","","","","","1.048","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010776","5.553","0.001","12.34","0.001","20.875","0.002","90","","90","","90","","1430.4","0.3","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Costuslactone-B","3,6,10-trimethyl-2,3,3a,4,5,8,9,11a-octahydrocyclodeca[1,2-b]furan-2,9-dione","","- C15 H20 O3 -","- C15 H20 O3 -","- C60 H80 O12 -","4","1","TA1253","Wang, Qiguang; Zhou, Baofan; Zhai, Jianjun","Costuslactone B","Acta Crystallographica Section C","2000","56","3","369","370","10.1107/S0108270199015723","","","0.71073","MoKα","","0.033","0.031","","","","0.137","","","","","","1.239","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010777","11.382","0.005","12.162","0.004","15.855","0.007","90","","103.31","0.03","90","","2135.8","1.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","[2,6-Bis(3,5-dimethylpyrazol-1-ylmethyl)pyridine]copper(II)thiocyanate","[2,6-Bis(3,5-dimethylpyrazol-1-ylmethyl-κN^2^)pyridine-κN] bis(thiocyanato-N)copper(II)","","- C19 H21 Cu N7 S2 -","- C19 H21 Cu N7 S2 -","- C76 H84 Cu4 N28 S8 -","4","1","TA1259","Manikandan, Palanichamy; Justin Thomas, K. R.; Manoharan, Periakaruppan T.","[2,6-Bis(3,5-dimethylpyrazol-1-ylmethyl-κ<i>N</i>^2^)pyridine-κ<i>N</i>]bis(thiocyanato-<i>N</i>)copper(II)","Acta Crystallographica Section C","2000","56","3","308","309","10.1107/S0108270199015711","","","1.54184","CuKα","","0.054","0.047","","","","0.135","","","","","","1.035","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010778","6.844","0.002","6.908","0.002","9.061","0.003","101.398","0.004","90.799","0.004","112.515","0.003","386","0.2","170","2","170","2","","","","","","","","5","P -1","-P 1","2","","2-Amino-5-carboxypyridinium chloride","","- C6 H7 Cl N2 O2 -","- C6 H7 Cl N2 O2 -","- C12 H14 Cl2 N4 O4 -","2","1","TA1270","John Giantsidis; Mark M. Turnbull","6-Aminonicotinic acid hydrochloride","Acta Crystallographica Section C","2000","56","3","334","335","10.1107/S0108270199014821","","","0.71073","MoKα","","0.037","0.034","","","","0.091","","","","","","1.135","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010779","13.097","0.002","16.169","0.002","10.752","0.002","90","","95.818","0.012","90","","2265.2","0.6","293","1","293","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","BC-166","11-[4-(1,3-benzodioxol-5-ylmethyl)piperazino]-8-chloro-5H- dibenzo[b,e][1,4]diazepine","","- C25 H23 Cl N4 O2 -","- C25 H23 Cl N4 O2 -","- C100 H92 Cl4 N16 O8 -","4","1","TA1272","Capuano, Ben; Crosby, Ian T.; Gable, Robert W.; Lloyd, Edward J.","<i>N</i>-Piperonyl analogue of the atypical antipsychotic clozapine","Acta Crystallographica Section C","2000","56","3","339","340","10.1107/S0108270199015139","","","0.71073","MoKα","","0.057","0.039","","0.11","","0.097","","","1.025","","","1.063","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010780","8.056","0.001","6.7586","0.0006","11.694","0.003","90","","102.93","0.01","90","","620.56","0.19","295","2","295","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C13 H13 N3 O S -","- C13 H13 N3 O S -","- C26 H26 N6 O2 S2 -","2","1","TA1278","Lovejoy, David B.; Richardson, Des. R.; Bernhardt, Paul V.","2-Hydroxy-1-naphthaldehyde 2-methylthiosemicarbazone","Acta Crystallographica Section C","2000","56","3","341","342","10.1107/S0108270199015140","","","0.71073","MoKα","","0.0472","0.0413","","","","0.1206","","","","","","1.044","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010781","14.789","0.013","13.14","0.008","19.064","0.016","90","","97.94","0.03","90","","3669","5","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C30 H37 Bi Br5 N5 -","- C30 H37 Bi Br5 N5 -","- C120 H148 Bi4 Br20 N20 -","4","0.5","AV1032","James, Sian C.; Lawson, Yvonne G.; Norman, Nicholas C.; Orpen, A. Guy; Quayle, Michael J.","Salts of two pentahalo(<i>N</i>-donor)bismuthate(III) anions: [Bi<i>X</i>~5~<i>L</i>]^2{-^} (<i>X</i> = Cl, Br; <i>L</i> = pyridine, 4-picoline)","Acta Crystallographica Section C","2000","56","4","427","429","10.1107/S0108270100000263","","","0.71073","MoKα","","0.0451","0.0286","","","","0.0554","","","","","","0.919","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010782","18.699","0.002","14.889","0.003","7.408","0.003","90","","90","","90","","2062.5","1","173","2","173","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","pentachloropyridylbismuthate(III) pyridinium","","- C15 H17 Bi Cl5 N3 -","- C15 H17 Bi Cl5 N3 -","- C60 H68 Bi4 Cl20 N12 -","4","0.5","AV1032","James, Sian C.; Lawson, Yvonne G.; Norman, Nicholas C.; Orpen, A. Guy; Quayle, Michael J.","Salts of two pentahalo(<i>N</i>-donor)bismuthate(III) anions: [Bi<i>X</i>~5~<i>L</i>]^2{-^} (<i>X</i> = Cl, Br; <i>L</i> = pyridine, 4-picoline)","Acta Crystallographica Section C","2000","56","4","427","429","10.1107/S0108270100000263","","","0.71073","MoKα","","0.049","0.0298","","0.0578","","0.052","","","1.052","","","1.068","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010783","13.549","0.002","7.525","0.002","5.891","0.004","90","","90.04","0.03","90","","600.6","0.4","173","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,2'-bi(1,3,5,2-trithiaborapentalene)","","- C8 H4 B2 S6 -","- C8 H4 B2 S6 -","- C16 H8 B4 S12 -","2","0.5","BK1489","Norman, Nicholas C.; Orpen, A. Guy; Quayle, Michael J.; Rice, Craig R.","Three sulfur-containing diborane(4) compounds","Acta Crystallographica Section C","2000","56","4","440","444","10.1107/S0108270199014778","","","0.71073","MoKα","","0.063","0.055","","0.139","","0.135","","","0.984","","","1.06","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010784","9.578","0.002","9.686","0.002","12.172","0.003","95.56","0.02","91.99","0.02","113.349","0.012","1028.6","0.4","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","2,2'-bis(dimethylamino)-2,2'-bi(1,3,4,6,2-tetrathiaborapentalene-S-thione","","- C10 H14 B2 N2 S10 -","- C10 H14 B2 N2 S10 -","- C20 H28 B4 N4 S20 -","2","1","BK1489","Norman, Nicholas C.; Orpen, A. Guy; Quayle, Michael J.; Rice, Craig R.","Three sulfur-containing diborane(4) compounds","Acta Crystallographica Section C","2000","56","4","440","444","10.1107/S0108270199014778","","","0.71073","MoKα","","0.047","0.031","","0.076","","0.072","","","0.965","","","1.04","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010785","29.629","0.003","29.629","0.003","9.438","0.002","90","","90","","120","","7175.4","1.8","173","2","173","2","","","","","","","","6","R -3 :H","-R 3","148","","1,2-bis(dimethylamino)-1,1:2,2-bis(dimethylenedithioxy)diborane(4) dichloromethane solvate","","- C8.33 H22.66 B2 Cl0.66 N2 S4 -","- C8.334 H22.668 B2 Cl0.666667 N2 S4 -","- C150.012 H408.024 B36 Cl12 N36 S72 -","18","1","BK1489","Norman, Nicholas C.; Orpen, A. Guy; Quayle, Michael J.; Rice, Craig R.","Three sulfur-containing diborane(4) compounds","Acta Crystallographica Section C","2000","56","4","440","444","10.1107/S0108270199014778","","","0.71073","MoKα","","0.064","0.046","","","","0.129","","","","","","1.3","","","","has coordinates,has disorder,has Fobs","202207","2020-10-21","18:00:00",""
"2010786","7.0115","0.0001","18.7691","0.0006","21.1681","0.0007","90","","90","","90","","2785.71","0.13","200","1","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C10 H16 O -","- C10 H16 O -","- C120 H192 O12 -","12","3","BK1491","Harper, James K.; Arif, Atta M.; Grant, David M.","<i>cis</i>-Verbenol","Acta Crystallographica Section C","2000","56","4","451","452","10.1107/S010827019901570X","","","0.71073","MoKα","","","0.047","","","","0.127","","","","","","1.05","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010787","14.9958","0.001","17.5356","0.0012","9.0327","0.0006","90","","90","","90","","2375.2","0.3","173","","","","","","","","","","","4","C c c a :2","-C 2a 2ac","68","Bis(trimethylsilyl)mercury","Bis(trimethylsilyl)mercury","","- C12 H36 Hg2 Si4 -","- C12 H36 Hg2 Si4 -","- C48 H144 Hg8 Si16 -","4","0.25","BK1496","Pickett, Nigel L.; Just, Oliver; VanDerveer, Donald G.; Rees, Jr, William S.","Reinvestigation of bis(trimethylsilyl)mercury","Acta Crystallographica Section C","2000","56","4","412","413","10.1107/S0108270199016339","","","0.71073","MoKα","","","0.028","","","","0.074","","","","","","0.985","","","","has coordinates","176428","2020-10-21","18:00:00",""
"2010788","42.064","0.006","42.064","0.006","7.052","0.003","90","","90","","120","","10806","5","293","2","293","2","","","","","","","","6","R -3 :H","-R 3","148","","Aqua(n-hexyl)[3,3'-(propane-1,3-diyldinitrilo)bis(butan-2-one) dioximato-κ^4^-N]cobalt(III) perchlorate","","- C17 H34 Cl Co N4 O7 -","- C17 H34 Cl Co N4 O7 -","- C306 H612 Cl18 Co18 N72 O126 -","18","1","BK1502","Xiang, Ping; Chen, Ying; Shen, Xu-Jie; Chen, Hui-Lan; Duan, Chun-Ying","Aqua(<i>n</i>-hexyl)[3,3'-(propane-1,3-diyldinitrilo)bis(butan-2-one) dioximato-κ^4^<i>N</i>]cobalt(III) perchlorate","Acta Crystallographica Section C","2000","56","4","421","422","10.1107/S010827019901673X","","","0.71073","MoKα","","0.093","0.064","","","","0.183","","","","","","1.025","","","","has coordinates,has disorder","176760","2020-10-21","18:00:00",""
"2010789","16.427","0.002","15.195","0.002","7.194","0.001","90","","90","","90","","1795.7","0.4","293","2","293","2","","","","","","","","5","P c a 21","P 2c -2ac","29","DPPE","[2-(4-benzylphenoxy)ethyl]diethylammonium chloride","","- C19 H26 Cl N O -","- C19 H26 Cl N O -","- C76 H104 Cl4 N4 O4 -","4","1","BK1510","Hempel, Andrew; Camerman, Norman; Dauter, Zbigniew; Mastropaolo, Donald; Camerman, Arthur","The antiestrogen [2-(4-benzylphenoxy)ethyl]diethylammonium chloride","Acta Crystallographica Section C","2000","56","4","455","456","10.1107/S0108270199016741","","","0.92","synchrotronradiation","","0.041","0.036","","","","0.105","","","","","","1.002","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010790","8.7122","0.0005","12.8097","0.0011","13.7023","0.0012","113.2","0.007","91.68","0.006","101.35","0.006","1368.3","0.2","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","(8-dimethylamino-1-naphthyl)dimethylammonium 3-carboxy-1,4,5,6,7,7-hexachloro-bicyclo[2.2.1]hept-5-ene-2-carboxylate hydrate (1:1:1)","","- C23 H24 Cl6 N2 O5 -","- C23 H24 Cl6 N2 O5 -","- C46 H48 Cl12 N4 O10 -","2","1","BM1360","Keller, Daphne E.; Kooijman, Huub; Scheurs, Antoine M. M.; Kroon, Jan; Grech, Eugeniusz","(8-Dimethylamino-1-naphthyl)dimethylammonium 3-carboxy-1,4,5,-6,7,7-hexachlorobicyclo[2.2.1]hept-5-ene-2-carboxylate hydrate","Acta Crystallographica Section C","2000","56","4","479","480","10.1107/S0108270100000664","","","0.71073","MoKα","","0.07","0.039","","","","0.107","","","","","","0.998","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010791","9.592","0.012","11.989","0.014","12.574","0.014","115.219","0.01","102.68","0.01","94.734","0.01","1251","3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H18 N9 O12 Sm -","- C18 H14 N9 O12 Sm -","- C36 H28 N18 O24 Sm2 -","2","1","BM1386","Michael G.B.Drew; Michael J.Hudson; Peter B. Iveson; Charles Madic","[Sm(NO~3~)~3~(TPTZ)(H~2~O)]·2H~2~O [TPTZ is 2,4,6-tris(2-pyridyl)-1,3,5-triazine]","Acta Crystallographica Section C","2000","56","4","434","435","10.1107/S0108270100000615","","","0.71073","MoKα","","0.0348","0.0331","","","","0.0944","","","","","","1.087","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010792","6.748","0.003","10.466","0.004","12.555","0.004","90","","92.36","0.03","90","","885.9","0.6","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Ethyl 3-(2'-deoxyuridin-5-yl)-3-hydroxy-2-iodopropanoate","","- C14 H19 I N2 O8 -","- C14 H19 I N2 O8 -","- C28 H38 I2 N4 O16 -","2","1","BM1390","Mazumdar, G.; De, M.; Mukhopadhyay, A.; Mazumdar, S. K.; Mazumder, N.; Das, A. K.; Knaus, Edward E.","Ethyl 3-(2'-deoxyuridin-5-yl)-3-hydroxy-2-iodopropanoate, a nucleoside analogue","Acta Crystallographica Section C","2000","56","4","494","495","10.1107/S0108270100000998","","","0.71069","MoKα","","0.044","0.036","","0.137","0.071","","","","0.928","0.925","0.925","","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010793","6.4","0.002","14.181","0.003","7.416","0.001","90","","95.43","0.02","90","","670","0.3","297","","297","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Iron(II) Diphosphate Dihydrate","","- Fe2 H4 O9 P2 -","- Fe2 H4 O9 P2 -","- Fe8 H16 O36 P8 -","4","1","BR1253","Giesber, Henry G. III; Korzenski, Michael B.; Pennington, William T.; Kolis, Joseph W.","Fe~2~P~2~O~7~(H~2~O)~2~","Acta Crystallographica Section C","2000","56","4","399","400","10.1107/S0108270199014407","","","0.71073","MoKα","","0.0204","0.019","","0.0309","","0.0303","","","","","","1.18","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010794","11.3606","0.0008","6.0125","0.0004","5.1482","0.0004","90","","113.159","0.004","90","","323.31","0.04","295","","295","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","mercury(II) tungstate","","- Hg O4 W -","- Hg O4 W -","- Hg4 O16 W4 -","4","0.5","BR1261","Åsberg Dahlborg, Magnus B.; Svensson, Göran; Ouvarova, Tatiana","Mercury(II) tungstate from neutron powder data","Acta Crystallographica Section C","2000","56","4","397","398","10.1107/S0108270199013864","","neutron","1.47","neutron","","","","","","","","","","1.23","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2010795","10.0132","0.0004","17.3635","0.0006","82.496","0.003","90.006","0.008","90.026","0.004","89.983","0.005","14343.1","0.9","295","","295","","","","","","","","","3","F 1","F 1","1","","aluminum phosphate","","- Al O4 P -","- Al O4 P -","- Al160 O640 P160 -","160","","BR1269","Graetsch, Heribert","Two forms of aluminium phosphate tridymite from X-ray powder data","Acta Crystallographica Section C","2000","56","4","401","403","10.1107/S0108270199015164","","","1.54056","CuKα~1~","","","0.0332","","","","","","","2.16","2.16","2.16","","","","","has coordinates","208305","2020-10-21","18:00:00",""
"2010796","37.3863","0.0016","5.0455","0.0002","26.2217","0.001","90","","117.816","0.0013","90","","4374.7","0.3","295","","295","","","","","","","","","3","P 1 c 1","P -2yc","7","","aluminum phosphate","","- Al O4 P -","- Al O4 P -","- Al48 O192 P48 -","48","24","BR1269","Graetsch, Heribert","Two forms of aluminium phosphate tridymite from X-ray powder data","Acta Crystallographica Section C","2000","56","4","401","403","10.1107/S0108270199015164","","","1.54056","CuKα~1~","","","0.0727","","","","","","","1.79","1.79","1.79","","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010797","8.039","0.0005","7.694","0.0016","14.13","0.002","90","","90","","90","","874","0.2","208","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","β-Pyridinium dichloroiodide","","- C5 H6 Cl2 I N -","- C4.99998 H6 Cl2 I N0.99996 -","- C19.9999 H24 Cl8 I4 N3.99984 -","4","0.5","BR1276","Schulz Lang, Ernesto; Burrow, Robert A.; Diniz, Juraci","β-Pyridinium dichloroiodide","Acta Crystallographica Section C","2000","56","4","471","472","10.1107/S0108270100000317","","","0.71073","MoKα","","0.1069","0.0569","","","","0.141","","","","","","1.046","","","","has coordinates,has disorder,has Fobs","211393","2020-10-21","18:00:00",""
"2010798","6.8832","0.0006","9.0568","0.0008","12.4376","0.0011","90","","97.219","0.002","90","","769.21","0.12","153","","153","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C7 H7 N O6 -","- C7 H7 N O6 -","- C28 H28 N4 O24 -","4","1","CF1322","Hall, Annegret K.; Harrowfield, Jack M.; Skelton, Brian W.; White, Allan H.","Chelidamic acid monohydrate: the proton complex of a multidentate ligand","Acta Crystallographica Section C","2000","56","4","448","450","10.1107/S0108270199015620","","","0.71073","MoKα","","0.046","0.038","","0.05","","0.049","","","1.616","","","1.736","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2010799","12.748","0.003","16.508","0.009","19.19","0.016","90","","97.5","0.05","90","","4004","4","293","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H39 Gd N3 Na5 O31 -","- C21 H6 Gd N3 Na5 O31 -","- C84 H24 Gd4 N12 Na20 O124 -","4","1","CF1323","Hall, Annegret K.; Harrowfield, Jack M.; Skelton, Brian W.; White, Allan H.","The sodium salt of a tris(tridentate anion)gadolinium(III) complex: pentasodium bis[chelidamato(3{-})][chelidamato(2{-})]gadolinate(III) hexadecahydrate","Acta Crystallographica Section C","2000","56","4","407","411","10.1107/S0108270199015632","","","0.71073","MoKα","","0.083","0.072","","0.068","","0.068","","","1.542","","","1.606","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2010800","6.531","0.002","44.759","0.004","16.224","0.002","90","","90","","90","","4742.6","1.6","293","2","293","2","","","","","","","","6","F d d 2","F 2 -2d","43","","","","- C14 H2 Fe4 O12 S2 Se2 -","- C14 H2 Fe4 O12 S2 Se2 -","- C112 H16 Fe32 O96 S16 Se16 -","8","0.5","DA1109","Panneerselvam, Kaliyamoorthy; Lu, Tian-Huey; Tung, Shu-Fang; Dash, Aswini K.; Mathur, Pradeep","Mixed-chalcogenide double-butterfly complex [{(CO)~6~Fe~2~SSe}~2~{μ-C(H)—C(H)}]","Acta Crystallographica Section C","2000","56","4","438","439","10.1107/S0108270100001037","","","0.71073","MoKα","","0.0485","0.0372","","","","0.1077","","","","","","1.095","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010801","8.101","0.002","13.564","0.003","21.573","0.004","90","","91.13","0.03","90","","2370","0.9","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","[diaquamagnesium pyrithione][dithiobis(pyridine-N-oxide)]","[diaquabis(1-hydroxy-2(1H)-pyridinethiolato)magnesium(II)] [2,2'-dithiobis(pyridine-N-oxide)]","","- C20 H20 Mg N4 O6 S4 -","- C20 H20 Mg N4 O6 S4 -","- C80 H80 Mg4 N16 O24 S16 -","4","0.5","DE1120","Bond, Andrew; Jones, William","A host‒guest complex of diaquabis[1-hydroxy-2(1<i>H</i>)-pyridinethionato-<i>O</i>,<i>S</i>]magnesium(II) and 2,2'-dithiobis(pyridine <i>N</i>-oxide)","Acta Crystallographica Section C","2000","56","4","436","437","10.1107/S0108270199013608","","","0.71073","MoKα","","0.05","0.036","","","","0.096","","","","","","1.016","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010802","7.412","0.0015","11.505","0.002","13.255","0.003","103.13","0.03","103.97","0.03","106.8","0.03","995","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Acetatodiaqua[3-(salicyloylhydrazone)butan-2-one oximato]nickel(II) ethanol solvate","","- C15 H25 N3 Ni O8 -","- C15 H25 N3 Ni O8 -","- C30 H50 N6 Ni2 O16 -","2","1","DE1121","Song, You; Xu, Yan; Zhu, Dun-Ru; You, Xiao-Zeng","Acetatodiaqua[3-(salicyloylhydrazono)butan-2-one oximato]nickel(II) ethanol solvate","Acta Crystallographica Section C","2000","56","4","430","431","10.1107/S0108270100000329","","","0.71073","MoKα","","0.085","0.047","","0.134","0.122","","","","1","1.098","1.098","","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010803","10.881","0.002","15.753","0.002","5.4764","0.0005","90","","90","","90","","938.7","0.2","293.2","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C10 H9 N O3 -","- C10 H9 N O3 -","- C40 H36 N4 O12 -","4","1","DE1122","Kanazawa, Hitoshi","<i>N</i>-Carboxy-<small>L</small>-phenylalanine anhydride","Acta Crystallographica Section C","2000","56","4","469","470","10.1107/S0108270100000330","","","0.7107","MoKα","","","0.055","","","","0.158","","","","","","1.25","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010804","4.8488","0.0001","14.8294","0.0004","6.0228","0.0002","90","","110.534","0.001","90","","405.553","0.019","153","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","L-Seryl-L-Alanine","","- C6 H12 N2 O4 -","- C6 H12 N2 O4 -","- C12 H24 N4 O8 -","2","1","DE1127","Görbitz, Carl Henrik","A new {`}hydrogen-bond rule' applied to the structure of <small>L</small>-seryl-<small>L</small>-alanine and pairs of dipeptide retroanalogues","Acta Crystallographica Section C","2000","56","4","500","502","10.1107/S0108270100001463","","","0.71073","MoKα","","0.059","0.057","","","","0.127","","","","","","1.342","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010805","8.6654","0.0005","8.7898","0.0006","10.0105","0.0006","98.183","0.007","112.991","0.006","104.673","0.006","653.62","0.09","295","","","","","","","","","","","5","P -1","-P 1","2","","","","- C15 H11 N O4 S -","- C15 H11 N O4 S -","- C30 H22 N2 O8 S2 -","2","1","FR1229","Kendi, Engin; Özbey, Süheyla; Bozdoğan, Oya; Ertan, Rahmiye","Flavone-3'-sulfonamide","Acta Crystallographica Section C","2000","56","4","457","458","10.1107/S0108270199016923","","","0.71069","MoKα","","","0.037","","","","0.044","","","","","","0.9","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010806","11.227","0.001","13.443","0.001","15.835","0.002","68.06","0.01","72.55","0.01","76.3","0.01","2093.6","0.4","295","","","","","","","","","","","5","P -1","-P 1","2","","","","- C21 H24 Cl N4 O2.5 -","- C21 H24 Cl N4 O2.5 -","- C84 H96 Cl4 N16 O10 -","4","2","FR1230","Özcan, Sabahat; Kendi, Engin; Tunçbilek, Meral; Göker, Hakan","Methyl 1-(4-chlorobenzyl)-2-(4-methylpiperazin-1-yl)-1<i>H</i>-benzimidazole-5-carboxylate hemihydrate","Acta Crystallographica Section C","2000","56","4","459","460","10.1107/S0108270100000032","","","0.71069","MoKα","","","0.053","","","","0.068","","","","","","1.24","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010807","10.3","0.001","13.39","0.001","9.322","0.007","105.65","0.09","98.62","0.09","88.45","0.03","1223.9","1.1","296","","296.2","","","","","","","","","5","P -1","-P 1","2","","","","- C30 H24 N2 O2 S -","- C30 H24 N2 O2 S -","- C60 H48 N4 O4 S2 -","2","1","FR1236","Simon, Wendy M.; Trujillo, Hernando A.; Pelkey, Erin T.; Gribble, Gordon W.; Jasinski, Jerry P.","The fused heterocycle 2-benzyl-3-methyl-1-phenyl-4-phenylsulfonyl-2<i>H</i>,4<i>H</i>-pyrrolo[3,4-<i>b</i>]indole","Acta Crystallographica Section C","2000","56","4","461","462","10.1107/S0108270100000020","","","0.7107","MoKα","","0.151","0.05","","0.147","","0.196","","","2.342","","","1.05","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010808","8.486","0.001","9.247","0.003","7.917","0.002","104.84","0.02","110","0.01","97.37","0.02","548.1","0.3","296","","296","","","","","","","","","6","P -1","-P 1","2","","","","- C7 H10 F O7 P S -","- C7 H10 F O7 P S -","- C14 H20 F2 O14 P2 S2 -","2","1","FR1237","Adani, Fabrizio; Montoneri, Enzo; Squattrito, Philip J.","4-Fluoro-2-(phosphonomethyl)benzenesulfonic acid monohydrate","Acta Crystallographica Section C","2000","56","4","463","464","10.1107/S0108270100000184","","","0.7107","MoKα","","","0.044","","","","0.064","","","","","","1.98","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2010809","18.515","0.002","14.295","0.003","10.916","0.001","84.9","0.01","87.874","0.009","77.04","0.01","2804","0.7","296","1","","","","","","","","","","6","P -1","-P 1","2","","","","- C57 H51 Cl5 O P3 Pd3 -","- C57 H51 Cl5 O P3 Pd3 -","- C114 H102 Cl10 O2 P6 Pd6 -","2","1","FR1241","Kunihisa Sugimoto; Takayoshi Kuroda-Sowa; Sheng-Gang Yan; Masahiko Maekawa; Mugumu Munakata","A novel trinuclear palladium cluster compound: di-μ~3~-chloro-tris[chloro(triphenylphosphine-<i>P</i>)palladium] acetone solvate","Acta Crystallographica Section C","2000","56","4","414","415","10.1107/S0108270199016509","","","0.7107","MoKα","","","0.037","","","","0.101","","","","","","1.024","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2010810","9.0913","0.0009","11.4168","0.0011","18.0817","0.0017","90","","93.46","0.007","90","","1873.3","0.3","160","2","160","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","9-iodo-1,2-diphenyl-1,2-closo-dicarbadodecaborane(9)","","- C14 H19 B10 I -","- C14 H19 B10 I -","- C56 H76 B40 I4 -","4","1","GD1068","Thomas D. McGrath; Mark A. Fox; Alan J. Welch","1,2-Ph~2~-9-I-1,2-<i>closo</i>-C~2~B~10~H~9~","Acta Crystallographica Section C","2000","56","4","487","488","10.1107/S0108270100000743","","","0.71073","MoKα","","0.0507","0.0349","","","","0.0846","","","","","","1.022","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010811","11.56","0.001","8.4","0.001","13.954","0.001","90","0.01","103.41","0.01","90","0.01","1318","0.2","298","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C27 H29 N O9 -","- C27 H25 N O9 -","- C54 H50 N2 O18 -","2","1","GS1061","Marc Rolland; Monique Calmès; Françoise Escale; Jean Martinez","Nouveaux dérivés de <i>N</i>-phtalimido-2-arylepropanoate de pantolactonyle","Acta Crystallographica Section C","2000","56","4","445","447","10.1107/S0108270199015292","","","0.71073","MoKα","","","0.062","","","","0.098","","","","","","1.653","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2010812","9.5666","0.0003","11.1026","0.0002","20.32","0.0006","90","0.01","90","0.01","90","0.01","2158.27","0.1","298","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C23 H20 F N O6 -","- C23 H20 F N O6 -","- C92 H80 F4 N4 O24 -","4","1","GS1061","Marc Rolland; Monique Calmès; Françoise Escale; Jean Martinez","Nouveaux dérivés de <i>N</i>-phtalimido-2-arylepropanoate de pantolactonyle","Acta Crystallographica Section C","2000","56","4","445","447","10.1107/S0108270199015292","","","0.71073","MoKα","","","0.033","","","","0.052","","","","","","1.22","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010813","12.114","0.001","8.095","0.002","18.538","0.006","90","","106.3","0.01","90","","1744.8","0.7","299","2","299","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[N,N'-Bis(5-bromosalicylidene)-o-phenylenediamine]copper(II)","","- C20 H12 Br2 Cu N2 O2 -","- C20 H12 Br2 Cu N2 O2 -","- C80 H48 Br8 Cu4 N8 O8 -","4","1","GS1068","Elmali, Ayhan; Elerman, Yalc̨in; Svoboda, Ingrid","[<i>N</i>,<i>N</i>'-Bis(5-bromosalicylidene)-<i>o</i>-phenylenediaminato]copper(II)","Acta Crystallographica Section C","2000","56","4","423","424","10.1107/S0108270199016935","","","0.71093","MoKα","","0.11","0.04","","","","0.115","","","1.017","","","1.073","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010814","9.368","0.005","19.776","0.007","11.484","0.008","90","","101.92","0.04","90","","2082","2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","7-benzoyl-2-(4-methoxyphenyl)-6-phenyl-5-oxa-2,6-diazaspiro[3.4]octan-1-one","","- C25 H22 N2 O4 -","- C25 H22 N2 O4 -","- C100 H88 N8 O16 -","4","1","GS1071","Chiaroni, Angèle; Riche, Claude; Rigolet, Séverinne; Mélot, Jean-Marie; Vebrel, Joel","Two 5-oxa-2,6-diazaspiro[3.4]octan-1-one derivatives from the [3+2] cycloaddition of methylenelactams with nitrones","Acta Crystallographica Section C","2000","56","4","473","474","10.1107/S010827010000072X","","","1.5418","CuKα","","0.101","0.05","","0.147","","0.12","","","1.013","","","1.078","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010815","6.272","0.002","10.687","0.003","15.327","0.004","103.39","0.02","87.79","0.03","95.62","0.02","994.5","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","6-tert-butyl-2-(4-methylphenyl)-7-phenyl-5-oxa-2,6-diazaspiro[3.4]octan-1-one","","- C22 H26 N2 O2 -","- C22 H26 N2 O2 -","- C44 H52 N4 O4 -","2","1","GS1071","Chiaroni, Angèle; Riche, Claude; Rigolet, Séverinne; Mélot, Jean-Marie; Vebrel, Joel","Two 5-oxa-2,6-diazaspiro[3.4]octan-1-one derivatives from the [3+2] cycloaddition of methylenelactams with nitrones","Acta Crystallographica Section C","2000","56","4","473","474","10.1107/S010827010000072X","","","1.5418","CuKα","","0.212","0.083","","0.304","","0.218","","","0.966","","","1.167","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010816","13.3445","0.0002","13.7089","0.0002","14.2471","0.0002","106.644","0.007","116.816","0.008","90.965","0.007","2195.8","0.2","100","0.1","100","0.1","","","","","","","","7","P -1","-P 1","2","","Carbonyl[dihydrobis(pyrazol-1-yl-κN^2^)borato]hydridobis- (tri-p-tolylphosphine-κP)ruthenium(II)","","- C49 H51 B N4 O P2 Ru -","- C49 H51 B N4 O P2 Ru -","- C98 H102 B2 N8 O2 P4 Ru2 -","2","1","JA1005","Huh, Seong; Park, Young Jun; Lough, Alan. J.; Jun, Moo-Jin","Carbonyl[dihydrobis(pyrazol-1-yl-κ<i>N</i>^2^)borato]hydridobis(tri-<i>p</i>-tolylphosphine-κ<i>P</i>)ruthenium(II)","Acta Crystallographica Section C","2000","56","4","416","417","10.1107/S0108270199016649","","","0.71073","MoKα","","0.114","0.061","","","","0.152","","","","","","0.965","","","","has coordinates,has Fobs","209447","2020-10-21","18:00:00",""
"2010817","11.1132","0.0013","5.8547","0.0006","13.1706","0.0013","90","","100.466","0.009","90","","842.68","0.16","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(aniline)dithiocyanatocadmium(II)","","- C14 H14 Cd N4 S2 -","- C14 H14 Cd N4 S2 -","- C28 H28 Cd2 N8 S4 -","2","0.5","JA1012","Moon, Hyoung-Sil; Kim, Chong-Hyeak; Lee, Sueg-Geun","One-dimensional polymeric chain structure of bis(aniline)dithiocyanatocadmium(II)","Acta Crystallographica Section C","2000","56","4","425","426","10.1107/S0108270100000160","","","0.71073","MoKα","","0.0314","0.025","","","","0.0677","","","","","","1.046","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010818","13.425","0.003","7.4226","0.0012","15.0382","0.0017","90","","91.881","0.013","90","","1497.7","0.4","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","3β-Hydroxy-11-oxo-18α-olean-12-en-28-oic acid methyl ester","","- C33 H54 O5 -","- C33 H54 O5 -","- C66 H108 O10 -","2","1","JZ1368","Gzella, Andrzej","Triterpenoide. XIX. 3β-Hydroxy-11-oxo-18α-olean-12-en-28-säure-methylester und 3,11-Dioxo-18α-olean-12-en-28-säure-methylester","Acta Crystallographica Section C","2000","56","4","505","507","10.1107/S0108270199014602","","","1.54178","CuKα","","0.044","0.042","","","","0.124","","","","","","1.067","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010819","6.6304","0.0012","12.886","0.002","31.442","0.005","90","","90","","90","","2686.4","0.8","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","3,11-Dioxo-18α-olean-12-en-28-oic acid methyl ester","","- C31 H46 O4 -","- C31 H46 O4 -","- C124 H184 O16 -","4","1","JZ1368","Gzella, Andrzej","Triterpenoide. XIX. 3β-Hydroxy-11-oxo-18α-olean-12-en-28-säure-methylester und 3,11-Dioxo-18α-olean-12-en-28-säure-methylester","Acta Crystallographica Section C","2000","56","4","505","507","10.1107/S0108270199014602","","","1.54178","CuKα","","0.044","0.036","","","","0.105","","","","","","1.049","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010820","8.898","0.002","8.898","0.002","6.947","0.002","90","","90","","120","","476.3","0.2","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","SSS","2,4,6-Tris(methylthio)-1,3,5-triazine","","- C6 H9 N3 S3 -","- C6 H9 N3 S3 -","- C12 H18 N6 S6 -","2","0.166667","JZ1377","Greenberg, Mark; Shteiman, Vitaly; Kaftory, Menahem","2,4,6-Tris(methylthio)-1,3,5-triazine, 3-methyl-4,6-bis(methylthio)-1,3,5-triazine-2(3<i>H</i>)-thione, 1,3-dimethyl-4-methylthio-1,3,5-triazine-2,6(1<i>H</i>,3<i>H</i>)-dithione and 1,3,5-trimethyl-1,3,5-triazine-2,4,6(1<i>H</i>,3<i>H</i>,5<i>H</i>)-trithione","Acta Crystallographica Section C","2000","56","4","465","468","10.1107/S0108270100000214","","","0.7107","MoKα","","0.0641","0.0337","","","","0.0879","","","","","","1.029","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010821","16.566","0.006","6.813","0.002","8.926","0.003","90","","90","","90","","1007.4","0.6","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","SSN(sss)","3-Methyl-4,6-bismethylthio-1,3,5-triazine-2(3H)-thione","","- C6 H9 N3 S3 -","- C6 H9 N3 S3 -","- C24 H36 N12 S12 -","4","0.5","JZ1377","Greenberg, Mark; Shteiman, Vitaly; Kaftory, Menahem","2,4,6-Tris(methylthio)-1,3,5-triazine, 3-methyl-4,6-bis(methylthio)-1,3,5-triazine-2(3<i>H</i>)-thione, 1,3-dimethyl-4-methylthio-1,3,5-triazine-2,6(1<i>H</i>,3<i>H</i>)-dithione and 1,3,5-trimethyl-1,3,5-triazine-2,4,6(1<i>H</i>,3<i>H</i>,5<i>H</i>)-trithione","Acta Crystallographica Section C","2000","56","4","465","468","10.1107/S0108270100000214","","","0.7107","MoKα","","0.0726","0.0489","","","","0.117","","","","","","1.051","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010822","9.618","0.005","11.435","0.006","13.91","0.007","107.3","0.05","100.65","0.05","93.05","0.05","1425.9","1.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","SNN","1,3-Dimethyl-4-methylthio-1,3,5-triazine-2,6(1H,3H)-dithione","","- C6 H9 N3 S3 -","- C6 H9 N3 S3 -","- C36 H54 N18 S18 -","6","3","JZ1377","Greenberg, Mark; Shteiman, Vitaly; Kaftory, Menahem","2,4,6-Tris(methylthio)-1,3,5-triazine, 3-methyl-4,6-bis(methylthio)-1,3,5-triazine-2(3<i>H</i>)-thione, 1,3-dimethyl-4-methylthio-1,3,5-triazine-2,6(1<i>H</i>,3<i>H</i>)-dithione and 1,3,5-trimethyl-1,3,5-triazine-2,4,6(1<i>H</i>,3<i>H</i>,5<i>H</i>)-trithione","Acta Crystallographica Section C","2000","56","4","465","468","10.1107/S0108270100000214","","","0.7107","MoKα","","0.0603","0.0439","","","","0.1291","","","","","","1.065","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010823","15.247","0.001","8.792","0.001","16.165","0.001","90","","116.6","0.01","90","","1937.6","0.3","293","2","293","2","","","","","","","","4","C 1 2 1","C 2y","5","NNN(sss)","1,3,5-Trimethyl-1,3,5-triazine-2,4,6(1H,3H,5H)-trithione","","- C6 H9 N3 S3 -","- C6 H9 N3 S3 -","- C48 H72 N24 S24 -","8","2","JZ1377","Greenberg, Mark; Shteiman, Vitaly; Kaftory, Menahem","2,4,6-Tris(methylthio)-1,3,5-triazine, 3-methyl-4,6-bis(methylthio)-1,3,5-triazine-2(3<i>H</i>)-thione, 1,3-dimethyl-4-methylthio-1,3,5-triazine-2,6(1<i>H</i>,3<i>H</i>)-dithione and 1,3,5-trimethyl-1,3,5-triazine-2,4,6(1<i>H</i>,3<i>H</i>,5<i>H</i>)-trithione","Acta Crystallographica Section C","2000","56","4","465","468","10.1107/S0108270100000214","","","0.7107","MoKα","","0.0595","0.0558","","","","0.1492","","","","","","1.14","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010824","10.5235","0.0008","7.1136","0.0003","18.2587","0.0013","90","","100.632","0.009","90","","1343.38","0.16","173","1","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","isoaurone","(E)-6-Methoxy-3-(α-methoxybenzylidene)benzo[b]furan-2(3H)-one","","- C17 H14 O4 -","- C17 H14 O4 -","- C68 H56 O16 -","4","1","JZ1387","Burke, Anthony J.; Schmalle, Helmut W.; Brady, Bernard A.; O'Sullivan, W. Ivo","(<i>E</i>)-6-Methoxy-3-(α-methoxybenzylidene)benzo[<i>b</i>]furan-2(3<i>H</i>)-one at 173K","Acta Crystallographica Section C","2000","56","4","484","486","10.1107/S0108270100000731","","","0.71073","MoKα","","","0.034","","","","0.067","","","","","","1.012","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010825","9.259","0.003","7.2787","0.001","9.767","0.003","90","","110.29","0.02","90","","617.4","0.3","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","4-amino-1-(2-deoxy-β-D-erythro-pentofuranosyl)- 3-iodo-1H-pyrazolo[3,4-d]pyrimidine","","- C10 H12 I N5 O3 -","- C10 H12 I N5 O3 -","- C20 H24 I2 N10 O6 -","2","1","LN1089","Seela, Frank; Zulauf, Matthias; Reuter, Hans; Kastner, Guido","7-Iodo-8-aza-7-deaza-2'-deoxyadenosine and 7-bromo-8-aza-7-deaza-2'-deoxyadenosine","Acta Crystallographica Section C","2000","56","4","489","491","10.1107/S0108270100000780","","","0.71073","MoKα","","0.026","0.026","","","","0.069","","","","","","1.036","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010826","9.093","0.0009","7.2595","0.001","9.6369","0.0019","90","","109.362","0.011","90","","600.16","0.16","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","4-amino-3-bromo-1-(2-deoxy-β-D-erythro-pentofuranosyl)- 1H-pyrazolo[3,4-d]pyrimidine","","- C10 H12 Br N5 O3 -","- C10 H12 Br N5 O3 -","- C20 H24 Br2 N10 O6 -","2","1","LN1089","Seela, Frank; Zulauf, Matthias; Reuter, Hans; Kastner, Guido","7-Iodo-8-aza-7-deaza-2'-deoxyadenosine and 7-bromo-8-aza-7-deaza-2'-deoxyadenosine","Acta Crystallographica Section C","2000","56","4","489","491","10.1107/S0108270100000780","","","0.71073","MoKα","","0.04","0.035","","","","0.093","","","","","","1.052","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010827","7.146","0.001","10.561","0.001","21.306","0.001","90","","90","","90","","1607.9","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1:1 Hetero-assembly of 2-Aminopyrimidine and (+)-Camphoric acid","","- C14 H21 N3 O4 -","- C14 H21 N3 O4 -","- C56 H84 N12 O16 -","4","1","LN1090","Shyamaprosad Goswami; Reshmi Mukherjee; Kumaresh Ghosh; Ibrahim Abdul Razak; S. Shanmuga Sundara Raj; Hoong-Kun Fun","1:1 Hetero-assembly of 2-aminopyrimidine and (+)-camphoric acid","Acta Crystallographica Section C","2000","56","4","477","478","10.1107/S0108270100000755","","","0.71073","MoKα","","0.138","0.065","","","","0.159","","","","","","1.05","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010828","16.544","0.004","4.477","0.001","21.993","0.003","90","0.02","92.14","0.01","90","0.02","1627.8","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","sodium 6-(1,3-dihydro-4-hydroxy-6-methoxy-7-methyl-3-oxoisobenzofuran-5-yl)- 4-methylhex-4-enoate","","- C17 H19 Na O6 -","- C17 H19 Na O6 -","- C68 H76 Na4 O24 -","4","1","LN1094","Rihs, Grety; Papageorgiou, Christos; Pfeffer, Sabine","Sodium mycophenolate","Acta Crystallographica Section C","2000","56","4","432","433","10.1107/S0108270100000524","","","1.54178","CuKα","","0.085","0.048","","0.152","","0.121","","","0.857","","","0.918","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010829","9.4958","0.001","10.1947","0.0008","22.124","0.002","90","","90","","90","","2141.8","0.3","293","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(3R,4S)-3-Phenyl-1-[(R)-1-phenylethyl]-4-[(R)-1-phenylethyliminomethyl]azet idin-2-one","","- C26 H26 N2 O -","- C26 H26 N2 O -","- C104 H104 N8 O4 -","4","1","LN1096","Kooijman, Huub; Spek, Anthony L.; Kleijn, Henk; Maanen, Hendrik L. van; Jastrzebski, Johann T. B. H.; Koten, Gerard van","(3<i>R</i>,4<i>S</i>)-3-Phenyl-1-[(<i>R</i>)-1-phenylethyl]-4-[(<i>R</i>)-1-phenylethyliminomethyl]azetidin-2-one","Acta Crystallographica Section C","2000","56","4","481","483","10.1107/S0108270100000767","","","0.71073","MoKα","","0.064","0.04","","","","0.106","","","","","","1.018","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010830","11.4515","0.0002","8.6572","0.0001","22.6109","0.0004","90","","90.864","0.001","90","","2241.34","0.06","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-[1-(phenylsulfonyl)indol-3-yl]-3a,4,5,9b-tetrahydro-3H-cyclopenta[c] quinoline","","- C26 H22 N2 O2 S -","- C26 H22 N2 O2 S -","- C104 H88 N8 O8 S4 -","4","1","NA1443","Sankaranarayanan, R.; Velmurugan, D.; Shanmuga Sundara Raj, S.; Fun, Hoong-Kun; Babu, G.; Perumal, P.T.","4-[1-(Phenylsulfonyl)indol-3-yl]-3a,4,5,9b-tetrahydro-3<i>H</i>-cyclopenta[<i>c</i>]quinoline","Acta Crystallographica Section C","2000","56","4","475","476","10.1107/S0108270100000640","","","0.71073","MoKα","","0.094","0.054","","","","0.149","","","","","","1.019","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010831","7.025","0.001","8.0689","0.0004","16.754","0.002","90","","90","","90","","949.68","0.18","293","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N-acetyl-L-threoninate ammonium","","- C6 H14 N2 O4 -","- C6 H14 N2 O4 -","- C24 H56 N8 O16 -","4","1","NA1450","Puliti, Raffaella; Mattia, Carlo Andrea","Ammonium <i>N</i>-acetyl-<small>L</small>-threoninate and methylammonium <i>N</i>-acetyl-<small>L</small>-threoninate","Acta Crystallographica Section C","2000","56","4","496","499","10.1107/S0108270100001268","","","1.54056","CuKα","","0.0362","0.0358","","","","0.0435","","","","","","0.964","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010832","8.14","0.0009","7.178","0.002","9.081","0.001","90","","113.52","0.01","90","","486.51","0.16","293","","293","","","","","","","","","4","P 1 21 1","P 2yb","4","","N-acetyl-L-threoninate methylammonium","","- C7 H16 N2 O4 -","- C7 H16 N2 O4 -","- C14 H32 N4 O8 -","2","1","NA1450","Puliti, Raffaella; Mattia, Carlo Andrea","Ammonium <i>N</i>-acetyl-<small>L</small>-threoninate and methylammonium <i>N</i>-acetyl-<small>L</small>-threoninate","Acta Crystallographica Section C","2000","56","4","496","499","10.1107/S0108270100001268","","","1.54056","CuKα","","0.0415","0.0412","","","","0.0487","","","","","","0.989","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010833","7.754","0.004","8.949","0.008","11.251","0.007","78.48","0.06","70.26","0.04","70.06","0.06","687.6","0.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","1-(3-methoxybenzoyl)-3,3-diethylthiourea","","- C13 H18 N2 O2 S -","- C13 H15 N2 O2 S -","- C26 H30 N4 O4 S2 -","2","1","NA1453","Dago Morales, Angel; Novoa de Armas, Héctor; Blaton, Norbert M.; Peeters, Oswald M.; De Ranter, Camiel J.; Márquez, Heidy; Pomés Hernández, Ramón","1-(3-Methoxybenzoyl)-3,3-diethylthiourea","Acta Crystallographica Section C","2000","56","4","503","504","10.1107/S0108270100001554","","","0.71073","MoKα","","0.0866","0.0595","","","","0.1842","","","","","","1.03","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010834","5.422","0.002","8.3254","0.0019","12.542","0.004","90","","90.39","0.03","90","","566.1","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","strontium chromium(II) diphosphate","strontium chromium(II) diphosphate","","- Cr O7 P2 Sr -","- Cr O7 P2 Sr -","- Cr4 O28 P8 Sr4 -","4","1","OS1092","Maaß, Kai; Glaum, Robert","Strontium chromium(II) diphosphate, SrCrP~2~O~7~","Acta Crystallographica Section C","2000","56","4","404","406","10.1107/S0108270100000226","","","0.71073","MoKα","","0.029","0.027","","","","0.076","","","","","","1.096","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010835","9.704","0.002","19.102","0.004","17.407","0.004","90","","103.85","0.02","90","","3132.8","1.2","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N,N'-bis-(2-tosylaminobenzylidene)benzene-1,2-diamine","","- C34 H30 N4 O4 S2 -","- C34 H30 N4 O4 S2 -","- C136 H120 N16 O16 S8 -","4","1","OS1099","Mahía, José; Maestro, Miguel A.; Vázquez, Miguel; Bermejo, Manuel R.; González, Ana M.; Maneiro, Marcelino","<i>N</i>,<i>N</i>'-Bis(2-tosylaminobenzylidene)benzene-1,2-diamine","Acta Crystallographica Section C","2000","56","4","492","493","10.1107/S0108270100000809","","","0.71073","MoKα","","0.104","0.057","","","","0.143","","","","","","1.026","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010836","5.0864","0.0008","7.315","0.003","35.812","0.009","90","","90","0.02","90","","1332.5","0.7","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-guanidinium-5-[2-(fluoromethyl)phenyl]-1,3,4-thiadiazole chloride","","- C10 H9 Cl F3 N5 S -","- C10 H9 Cl F3 N5 S -","- C40 H36 Cl4 F12 N20 S4 -","4","1","OS1100","Janes, Robert W.","1-{5-[2-(Trifluoromethyl)phenyl]-1,3,4-thiadiazol-2-yl}guanidinium chloride","Acta Crystallographica Section C","2000","56","4","508","509","10.1107/S0108270100001669","","","1.54178","CuKα","","0.0658","0.0508","","","","0.1491","","","","","","1.043","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010837","6.891","0.001","7.345","0.001","9.497","0.002","90","","92.46","0.03","90","","480.24","0.14","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(2R,3R,4R,5S)-2-(2-Hydroxyethyl)-3,4,5-trihydroxypiperidine hydrochloride","","- C7 H16 Cl N O4 -","- C7 H16 Cl N O4 -","- C14 H32 Cl2 N2 O8 -","2","1","QA0204","Koman, Marian; Szolcsányi, Peter; Gracza, Tibor","(2<i>R</i>,3<i>R</i>,4<i>R</i>,5<i>S</i>)-3,4,5-Trihydroxy-2-(2-hydroxyethyl)piperidinium chloride","Acta Crystallographica Section C","2000","56","4","e138","e138","10.1107/S0108270100003231","","","0.71073","MoKα","","0.089","0.056","","0.276","","0.157","","","0.906","","","0.933","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010838","14.0685","0.0009","11.9199","0.0009","15.7428","0.0007","90","","99.541","0.004","90","","2603.5","0.3","293","2","293","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","Bis[(μ-κO:O'-acetato)(μ-κO:μ-κ^2^O'-acetato){(cyclopentadienyl)tris (dimethylphosphito-P)cobalt-O,O',O""}neodymium(III)]","","- C30 H58 Co2 Nd2 O26 P6 -","- C30 H58 Co2 Nd2 O26 P6 -","- C60 H116 Co4 Nd4 O52 P12 -","2","0.5","QA0226","Roh, Soo-Gyun; Jeong, Jong Hwa","Di-μ-acetato-<i>O</i>:<i>O</i>'-di-μ-acetato-<i>O</i>,<i>O</i>':<i>O</i>'-bis{[(cyclopentadienyl)tris(dimethylphosphito-<i>P</i>)cobalt-<i>O</i>,<i>O</i>',<i>O</i>'']neodymium(III)}","Acta Crystallographica Section C","2000","56","4","e120","e121","10.1107/S0108270100003243","","","0.71073","MoKα","","0.051","0.044","","","","0.123","","","","","","1.027","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2010839","6.287","0.006","6.287","0.006","31.93","0.01","90","","90","","90","","1262.1","1.7","293.2","","","","","","","","","","","3","P 41 21 2","P 4abw 2nw","92","","","","- C13 H8 S4 -","- C13 H8 S4 -","- C52 H32 S16 -","4","0.5","QA0227","Ueda, Kazumasa; Iwamatsu, Masaki; Sugimoto, Toyonari; Tada, Toshiji; Nishimura, Kei-Ichiro","2,2'-Spirobi(1,3-benzodithiole)","Acta Crystallographica Section C","2000","56","4","e160","e161","10.1107/S0108270100003528","","","0.7107","MoKα","","","0.0347","","","","0.0453","","","","","","1.325","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010840","8.414","0.001","15.763","0.002","6.991","0.001","91.82","0.01","99.91","0.01","81.59","0.01","903.5","0.2","298","1","","","","","","","","","","4","P -1","-P 1","2","","","","- C20 H15 N3 O6 -","- C20 H15 N3 O6 -","- C40 H30 N6 O12 -","2","1","QA0229","Hosomi, Hiroyuki; Ohba, Shigeru; Ito, Yoshikatsu","Charge-transfer complexes of <i>N</i>-methyl-, <i>N</i>-isopropyl-, <i>N</i>-butyl- and <i>N</i>-isobutylcarbazole with 3,5-dinitrobenzoic acid","Acta Crystallographica Section C","2000","56","4","e144","e146","10.1107/S010827010000384X","","","0.71073","MoKα","","","0.044","","","","0.147","","","","","","1.08","","","","has coordinates,has disorder","176760","2020-10-21","18:00:00",""
"2010841","8.504","0.002","29.533","0.004","8.568","0.002","90","","108.05","0.02","90","","2045.9","0.8","298","1","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C22 H19 N3 O6 -","- C22 H19 N3 O6 -","- C88 H76 N12 O24 -","4","1","QA0229","Hosomi, Hiroyuki; Ohba, Shigeru; Ito, Yoshikatsu","Charge-transfer complexes of <i>N</i>-methyl-, <i>N</i>-isopropyl-, <i>N</i>-butyl- and <i>N</i>-isobutylcarbazole with 3,5-dinitrobenzoic acid","Acta Crystallographica Section C","2000","56","4","e144","e146","10.1107/S010827010000384X","","","0.71073","MoKα","","","0.041","","","","0.122","","","","","","1.05","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2010842","16.723","0.002","16.784","0.003","8.4129","0.0009","102.36","0.01","92.34","0.01","109.91","0.01","2152","0.5","298","1","","","","","","","","","","4","P -1","-P 1","2","","","","- C23 H21 N3 O6 -","- C23 H21 N3 O6 -","- C92 H84 N12 O24 -","4","2","QA0229","Hosomi, Hiroyuki; Ohba, Shigeru; Ito, Yoshikatsu","Charge-transfer complexes of <i>N</i>-methyl-, <i>N</i>-isopropyl-, <i>N</i>-butyl- and <i>N</i>-isobutylcarbazole with 3,5-dinitrobenzoic acid","Acta Crystallographica Section C","2000","56","4","e144","e146","10.1107/S010827010000384X","","","0.71073","MoKα","","","0.061","","","","0.192","","","","","","1.74","","","","has coordinates,has disorder","176760","2020-10-21","18:00:00",""
"2010843","8.212","0.002","31.924","0.002","8.438","0.001","90","","106.54","0.01","90","","2120.6","0.6","298","1","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C23 H21 N3 O6 -","- C23 H21 N3 O6 -","- C92 H84 N12 O24 -","4","1","QA0229","Hosomi, Hiroyuki; Ohba, Shigeru; Ito, Yoshikatsu","Charge-transfer complexes of <i>N</i>-methyl-, <i>N</i>-isopropyl-, <i>N</i>-butyl- and <i>N</i>-isobutylcarbazole with 3,5-dinitrobenzoic acid","Acta Crystallographica Section C","2000","56","4","e144","e146","10.1107/S010827010000384X","","","0.71073","MoKα","","","0.049","","","","0.165","","","","","","1.03","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2010844","8.339","0.002","27.604","0.004","7.817","0.002","90","","90","","90","","1799.4","0.7","293","1","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H14 N4 O4 -","- C20 H14 N4 O4 -","- C80 H56 N16 O16 -","4","1","QA0230","Hosomi, Hiroyuki; Ohba, Shigeru; Ito, Yoshikatsu","Charge-transfer complexes of <i>N</i>-methyl-and <i>N</i>-ethylcarbazole with 3,5-dinitrobenzonitrile","Acta Crystallographica Section C","2000","56","4","e147","e148","10.1107/S0108270100003851","","","0.71073","MoKα","","","0.063","","","","0.162","","","","","","1","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010845","16.227","0.002","6.982","0.002","17.435","0.002","90","","107.3","0.01","90","","1886","0.6","293","1","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C21 H16 N4 O4 -","- C21 H16 N4 O4 -","- C84 H64 N16 O16 -","4","1","QA0230","Hosomi, Hiroyuki; Ohba, Shigeru; Ito, Yoshikatsu","Charge-transfer complexes of <i>N</i>-methyl-and <i>N</i>-ethylcarbazole with 3,5-dinitrobenzonitrile","Acta Crystallographica Section C","2000","56","4","e147","e148","10.1107/S0108270100003851","","","0.71073","MoKα","","","0.064","","","","0.16","","","","","","0.97","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010846","8.785","0.001","12.276","0.002","7.696","0.001","107.37","0.01","105.86","0.01","77.01","0.01","752.64","0.19","298","1","","","","","","","","","","4","P -1","-P 1","2","","","","- C14 H14 N4 O6 -","- C14 H14 N4 O6 -","- C28 H28 N8 O12 -","2","1","QA0231","Hosomi, Hiroyuki; Ohba, Shigeru; Ito, Yoshikatsu","Charge-transfer complexes of 4-(dimethylamino)pyridine with 2,4-, 3,4- and 3,5-dinitrobenzoic acid","Acta Crystallographica Section C","2000","56","4","e149","e150","10.1107/S0108270100003863","","","0.71073","MoKα","","","0.05","","","","0.136","","","","","","0.98","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010847","8.102","0.002","7.734","0.001","24.218","0.001","90","","95.77","0.01","90","","1509.8","0.4","298","1","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H14 N4 O6 -","- C14 H14 N4 O6 -","- C56 H56 N16 O24 -","4","1","QA0231","Hosomi, Hiroyuki; Ohba, Shigeru; Ito, Yoshikatsu","Charge-transfer complexes of 4-(dimethylamino)pyridine with 2,4-, 3,4- and 3,5-dinitrobenzoic acid","Acta Crystallographica Section C","2000","56","4","e149","e150","10.1107/S0108270100003863","","","0.71073","MoKα","","","0.04","","","","0.112","","","","","","1.01","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010848","13.774","0.002","18.615","0.001","5.888","0.002","90","","90","","90","","1509.7","0.6","298","1","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C14 H14 N4 O6 -","- C14 H14 N4 O6 -","- C56 H56 N16 O24 -","4","1","QA0231","Hosomi, Hiroyuki; Ohba, Shigeru; Ito, Yoshikatsu","Charge-transfer complexes of 4-(dimethylamino)pyridine with 2,4-, 3,4- and 3,5-dinitrobenzoic acid","Acta Crystallographica Section C","2000","56","4","e149","e150","10.1107/S0108270100003863","","","0.71073","MoKα","","","0.035","","","","0.093","","","","","","1.04","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010849","20.242","0.003","9.788","0.001","17.524","0.002","90","","115.36","0.01","90","","3137.4","0.7","300","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Nonapotassium cerium tetraphosphorus hexadecasulfide","","- Ce K9 P4 S16 -","- Ce K9 P4 S16 -","- Ce4 K36 P16 S64 -","4","0.5","QA0232","Gauthier, Gilles; Jobic, Stephane; Danaire, Veronique; Brec, Raymond; Evain, Michel","K~9~CeP~4~S~16~, a new thiophosphate of cerium with discrete [Ce(PS~4~)~4~]^9{-^} anions","Acta Crystallographica Section C","2000","56","4","e117","e117","10.1107/S0108270100003395","","","0.71073","MoKα","","0.037","0.026","","","","0.061","","","","1.06","1.06","1.12","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2010850","12.517","0.002","11.5","0.003","16.413","0.002","90","","106.893","0.009","90","","2260.6","0.8","297","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H22 N2 Ni O2 -","- C28 H22 N2 Ni O2 -","- C112 H88 N8 Ni4 O8 -","4","1","QA0233","Hoshina, Gakuse; Tsuchimoto, Masanobu; Ohba, Shigeru","[<i>N</i>,<i>N</i>'-Bis(salicylidene)-1,2-diphenyl-(<i>RS</i>,<i>SR</i>)-1,2-ethanediaminato]nickel(II)","Acta Crystallographica Section C","2000","56","4","e122","e122","10.1107/S0108270100003255","","","0.7107","MoKα","","","0.044","","","","0.109","","","","","","1.03","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010851","13.409","0.003","13.656","0.003","7.432","0.002","95.03","0.03","90.11","0.02","113.99","0.01","1237.5","0.5","295","1","","","","","","","","","","4","P -1","-P 1","2","","","","- C10 H19 N O4 -","- C10 H19 N O4 -","- C40 H76 N4 O16 -","4","2","QA0235","Hosomi, Hiroyuki; Ohba, Shigeru; Ito, Yoshikatsu","Triethylammonium hydrogen fumarate","Acta Crystallographica Section C","2000","56","4","e139","e139","10.1107/S0108270100003267","","","0.71073","MoKα","","","0.045","","","","0.117","","","","","","1.02","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2010852","5.8046","0.0003","10.64","0.0017","12.9556","0.0014","109.428","0.011","102.416","0.007","90.25","0.008","734.44","0.16","294","1","294","1","","","","","","","","4","P 1","P 1","1","N-3,5-dinitrobenzoyl-L-leucine","3,5-dinitro-N`-[(1R)-1,3-dimethylbutyl]benzamide","","- C13 H15 N3 O7 -","- C13 H15 N3 O7 -","- C26 H30 N6 O14 -","2","2","QA0236","Gallagher, John F.; Kenny, Peter T. M.; O`Donohoe, Michael","Intermolecular hydrogen bonding of the two independent molecules of <i>N</i>-3,5-dinitrobenzoyl-<small>L</small>-leucine","Acta Crystallographica Section C","2000","56","4","e157","e158","10.1107/S0108270100003486","","","0.7107","MoKα","","0.111","0.045","","","","0.079","","","","","","0.937","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010853","13.6929","0.0005","13.6929","0.0005","14.8094","0.0006","90","","90","","90","","2776.7","0.18","150","2","150","2","","","","","","","","5","P -4 21 m","P -4 2ab","113","","Bis(tetraethylammonium) tetraiodozincate","","- C16 H40 I4 N2 Zn -","- C16 H40 I4 N2 Zn -","- C64 H160 I16 N8 Zn4 -","4","0.5","QA0237","Harrison, William T. A.; Howie, R. Alan; Skakle, Janet; Wardell, James L.","Bis(tetraethylammonium) tetraiodozincate at 150 and 301K","Acta Crystallographica Section C","2000","56","4","e124","e125","10.1107/S0108270100003383","","","0.71073","MoKα","","0.072","0.048","","","","0.122","","","","","","1.035","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010854","13.8199","0.0006","13.8199","0.0006","14.8975","0.0007","90","","90","","90","","2845.3","0.2","301","2","301","2","","","","","","","","5","P -4 21 m","P -4 2ab","113","","bis(tetraethylammonium) tertraiodozincate","","- C16 H40 I4 N2 Zn -","- C16 H40 I4 N2 Zn -","- C64 H160 I16 N8 Zn4 -","4","0.5","QA0237","Harrison, William T. A.; Howie, R. Alan; Skakle, Janet; Wardell, James L.","Bis(tetraethylammonium) tetraiodozincate at 150 and 301K","Acta Crystallographica Section C","2000","56","4","e124","e125","10.1107/S0108270100003383","","","0.71073","MoKα","","0.075","0.049","","","","0.135","","","","","","0.993","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010855","11.728","0.004","5.105","0.003","14.547","0.002","90","","99.83","0.02","90","","858.2","0.6","299","1","","","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C18 H18 O6 Zn -","- C18 H18 O6 Zn -","- C36 H36 O12 Zn2 -","2","0.5","QA0239","Hosomi, Hiroyuki; Ohba, Shigeru; Ito, Yoshikatsu","<i>cis</i>-Diaquabis(<i>trans</i>-cinnamato-<i>O</i>,<i>O</i>')zinc(II)","Acta Crystallographica Section C","2000","56","4","e123","e123","10.1107/S0108270100003358","","","0.71073","MoKα","","","0.034","","","","0.088","","","","","","1.05","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2010856","6.878","0.003","19.658","0.003","26.493","0.002","90","","91.33","0.02","90","","3581.1","1.7","298","1","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C32 H56 O6 S2 Si -","- C32 H56 O6 S2 Si -","- C128 H224 O24 S8 Si4 -","4","2","QA0240","Hosomi, Hiroyuki; Ohba, Shigeru; Ohmori, Ken; Obitsu, Tetsuo; Ogawa, Yasuyuki; Ishikawa, Yuichi; Yamamura, Shosuke; Nishiyama, Shigeru","({-})-(3<i>S</i>)-4-(2-{[4,4-Dimethoxy-6-(benzyloxymethyl)perhydropyran-2-yl]methyl}-1,3-dithian-2-yl)-4-methyl-3-(1,1,2,2-tetramethyl-1-silapropoxy)pentan-1-ol","Acta Crystallographica Section C","2000","56","4","e140","e141","10.1107/S010827010000336X","","","0.71073","MoKα","","","0.051","","","","0.13","","","","","","1.02","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010857","11.2649","0.0001","13.1101","0.0002","16.6181","0.0003","90","","94.2249","0.0003","90","","2447.56","0.06","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","tris(8-quinolinolato-N,O)Cobalt(III) Ethanol Solvate","","- C29 H24 Co N3 O4 -","- C29 H24 Co N3 O4 -","- C116 H96 Co4 N12 O16 -","4","1","QA0241","Shanmuga Sundara Raj, S.; Razak, Ibrahim Abdul; Fun, Hoong-Kun; Zhao, PuSu; Jian, Fangfang; Yang, Xujie; Lu, Lude; Wang, Xin","Tris(8-quinolinolato-<i>N</i>,<i>O</i>)cobalt(III) ethanol solvate","Acta Crystallographica Section C","2000","56","4","e130","e131","10.1107/S0108270100003516","","","0.71073","MoKα","","0.102","0.055","","","","0.147","","","","","","0.973","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010858","7.911","0.002","8.984","0.002","11.133","0.003","108.56","0.03","94.6","0.03","112.38","0.03","675","0.4","150","","150","","","","","","","","","3","P -1","-P 1","2","","N,N'-diphenyl-1,4-phenylenediamine","","- C18 H16 N2 -","- C18 H16 N2 -","- C36 H32 N4 -","2","1","QA0242","Boyer, Isabelle; Quillard, Sophie; Corraze, Benoit; Deniard, Philippe; Evain, Michel","A second polymorphic form of <i>N</i>,<i>N</i>'-diphenyl-1,4-phenylenediamine","Acta Crystallographica Section C","2000","56","4","e159","e159","10.1107/S0108270100003498","","","0.71073","MoKα","","0.046","0.03","","","","0.069","","","","","","1.09","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010859","14.059","0.001","7.1282","0.0009","22.621","0.002","90","","94.148","0.001","90","","2261","0.4","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-Phenylbutan-2-one semicarbazone","","- C11 H15 N3 O -","- C11 H15 N3 O -","- C88 H120 N24 O8 -","8","2","QA0243","Degen, Alexander; Rühl, Stephan; Bolte, Michael","4-Phenylbutan-2-one semicarbazone","Acta Crystallographica Section C","2000","56","4","e162","e163","10.1107/S0108270100003802","","","0.71073","MoKα","","0.065","0.046","","","","0.109","","","","","","1.065","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2010860","8.23","0.001","15.423","0.002","8.476","0.001","90","","113.81","0.03","90","","984.3","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 H13 N3 O2 S -","- C8 H13 N3 O2 S -","- C32 H52 N12 O8 S4 -","4","1","QA0244","Lazrak, Fatima; Essassi, El-Mokhtar; El-Bali, Brahim; Bolte, Michael","1,2,4-Triazolo[2,3-<i>h</i>]-7,9-thiaza-11-crown-4","Acta Crystallographica Section C","2000","56","4","e164","e164","10.1107/S0108270100003814","","","0.71073","MoKα","","0.064","0.038","","","","0.081","","","","","","1.032","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010861","10.242","0.001","10.874","0.002","23.168","0.005","92.5","0.02","100.39","0.02","97.6","0.02","2509.6","0.8","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","[Chlorocobalt(III)(μ-C-meso-5,5,7,12,12,14-hexamethyl-1,4,8,11- tetraazacyclotetradecane-N-acetato-N,N',N'',N''',O:O')trichlorozinc(II)]","","- C18 H37 Cl4 Co N4 O2 Zn -","- C18 H37 Cl4 Co N4 O2 Zn -","- C72 H148 Cl16 Co4 N16 O8 Zn4 -","4","2","QA0245","Panneerselvam, Kaliyamoorthy; Lu, Tian-Huey; Chi, Ta-Yung; Tung, Shu-Fang; Chung, Chung-Sun","(μ-<i>C</i>-<i>meso</i>-5,5,7,12,12,14-Hexamethyl-1,4,8,11-tetraazacyclotetradecane-<i>N</i>-acetato-1κ^5^<i>N,N</i>',<i>N</i>'',<i>N</i>''',<i>O</i>:2κ<i>O</i>')tetrachloro-1κ<i>Cl</i>,2κ^3^<i>Cl</i>-cobalt(III)zinc(II)","Acta Crystallographica Section C","2000","56","4","e128","e129","10.1107/S0108270100003504","","","0.71073","MoKα","","0.12","0.052","","","","0.131","","","","","","0.932","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010862","8.76","0.002","32.09","0.002","6.269","0.002","90","","90","","90","","1762.3","0.7","248","1","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H24 O3 S -","- C18 H24 O3 S -","- C72 H96 O12 S4 -","4","1","QA0246","Hosomi, Hiroyuki; Ohba, Shigeru; Ohmori, Ken; Obitsu, Tetsuo; Ogawa, Yasuyuki; Ishikawa, Yuichi; Yamamura, Shosuke; Nishiyama, Shigeru","(+)-3-{(4<i>S</i>,5<i>S</i>)-5-[1,1-Dimethyl-2-(phenylthio)ethyl]-2,2-dimethyl-1,3-dioxolan-4-yl}prop-2-yn-1-ol","Acta Crystallographica Section C","2000","56","4","e142","e143","10.1107/S0108270100003371","","","1.54184","CuKα","","","0.04","","","","0.108","","","","","","1.08","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010863","8.73","0.001","10.052","0.001","14.998","0.002","90","","99.36","0.01","90","","1298.6","0.3","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H16 N2 O2 -","- C14 H16 N2 O2 -","- C56 H64 N8 O8 -","4","1","QA0247","Ould, Mohammed Sydia Mohamed Said; Djerrari, Bahia; El Abbassi, M'Barek; Essassi, El-Mokhtar; El-Bali, Brahim; Bolte, Michael","4-Acetonylidene-1-ethyl-2,3,4,5-tetrahydro-1<i>H</i>-1,5-benzodiazepin-2-one","Acta Crystallographica Section C","2000","56","4","e165","e166","10.1107/S0108270100003826","","","0.71073","MoKα","","0.046","0.039","","","","0.113","","","","","","1.068","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010864","8.9821","0.0014","10.856","0.0018","14.3002","0.0019","91.279","0.016","107.901","0.016","107.173","0.015","1257.9","0.4","294","1","294","1","","","","","","","","7","P -1","-P 1","2","","cis-Dichloro(dimethylaminomethylene)(triphenylphosphine)palladium(II)","","- C24 H28 Cl2 N O P Pd -","- C24 H28 Cl2 N O P Pd -","- C48 H56 Cl4 N2 O2 P2 Pd2 -","2","1","QA0248","McCrindle, Robert; McAlees, Alan J.; Zang, Erle; Ferguson, George","<i>cis</i>-Dichloro(dimethylaminomethylene)(triphenylphosphine)palladium(II) acetone solvate","Acta Crystallographica Section C","2000","56","4","e132","e133","10.1107/S0108270100003838","","","0.71073","MoKα","","0.041","0.028","","","","0.063","","","","","","1.024","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010865","10.485","0.003","8.179","0.001","20.985","0.001","90","","100.98","0.01","90","","1766.7","0.6","248","1","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Cyclohex-1-enecarboxylic acid benzyl-(2-methoxy-phenyl)-amide","","- C21 H23 N O2 -","- C21 H23 N O2 -","- C84 H92 N4 O8 -","4","1","QA0250","Hosomi, Hiroyuki; Ohba, Shigeru; Aoyama, Hiromu","<i>N</i>-Benzyl-<i>N</i>-(2-methoxyphenyl)cyclohex-1-enecarboxamide","Acta Crystallographica Section C","2000","56","4","e151","e151","10.1107/S0108270100004029","","","1.54184","CuKα","","","0.055","","","","0.159","","","","","","1.04","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010866","17.479","0.003","9.1","0.002","21.494","0.003","90","","101.94","0.01","90","","3344.8","1.1","248","1","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","N-Isopropyl-N-{(E)-2-phenyl-propenyl}-thiobenzamide","","- C19 H21 N S -","- C19 H21 N S -","- C152 H168 N8 S8 -","8","1","QA0252","Hosomi, Hiroyuki; Ohba, Shigeru; Aoyama, Hiromu","<i>N</i>-Isopropyl-<i>N</i>-[(<i>E</i>)-2-phenylpropenyl]thiobenzamide and <i>N</i>-isopropyl-3-methoxy-<i>N</i>-[(<i>E</i>)-2-phenylpropenyl]thiobenzamide","Acta Crystallographica Section C","2000","56","4","e152","e153","10.1107/S0108270100004030","","","1.54184","CuKα","","","0.046","","","","0.134","","","","","","1.06","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010867","19.483","0.001","9.111","0.001","21.611","0.002","90","","105.39","0.01","90","","3698.6","0.6","248","1","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","N-Isopropyl-3-methoxy-N-{(E)-2-phenyl-propenyl}-thiobenzamide","","- C20 H23 N O S -","- C20 H23 N O S -","- C160 H184 N8 O8 S8 -","8","1","QA0252","Hosomi, Hiroyuki; Ohba, Shigeru; Aoyama, Hiromu","<i>N</i>-Isopropyl-<i>N</i>-[(<i>E</i>)-2-phenylpropenyl]thiobenzamide and <i>N</i>-isopropyl-3-methoxy-<i>N</i>-[(<i>E</i>)-2-phenylpropenyl]thiobenzamide","Acta Crystallographica Section C","2000","56","4","e152","e153","10.1107/S0108270100004030","","","1.54184","CuKα","","","0.035","","","","0.101","","","","","","1.02","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010868","10.057","0.003","8.344","0.003","17.962","0.004","90","","100.13","0.02","90","","1483.8","0.8","298","1","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-Methyl-N-{(Z)-2-phenyl-propenyl}-thiobenzamide","","- C17 H17 N S -","- C17 H17 N S -","- C68 H68 N4 S4 -","4","1","QA0253","Hosomi, Hiroyuki; Ohba, Shigeru; Aoyama, Hiromu","<i>N</i>-Methyl-<i>N</i>-[(<i>Z</i>)-2-phenylpropenyl]thiobenzamide","Acta Crystallographica Section C","2000","56","4","e154","e154","10.1107/S0108270100004042","","","0.71073","MoKα","","","0.066","","","","0.175","","","","","","1.02","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010869","11.166","0.001","13.423","0.001","10.878","0.001","90","","90","","90","","1630.4","0.2","298","1","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2-Isopropyl-4-methyl-4-phenyl-3,4-dihydro-2H-isoquinoline-1-thione","","- C19 H21 N S -","- C19 H21 N S -","- C76 H84 N4 S4 -","4","1","QA0254","Hosomi, Hiroyuki; Ohba, Shigeru; Aoyama, Hiromu","2-Isopropyl-4-methyl-4-phenyl-1,2,3,4-tetrahydroisoquinoline-1-thione","Acta Crystallographica Section C","2000","56","4","e155","e155","10.1107/S0108270100004054","","","0.71073","MoKα","","","0.043","","","","0.124","","","","","","1.06","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010870","21.4651","0.0012","13.3773","0.0008","23.3868","0.0014","90","","90","","90","","6715.4","0.7","193","2","193","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C32 H19 F20 Ga N2 -","- C32 H19 F20 Ga N2 -","- C256 H152 F160 Ga8 N16 -","8","1","QB0173","Guzei, Ilia A.; Dagorne, Samuel; Jordan, Richard F.","Bis(isopropylamino)methylcarbenium tetrakis(pentafluorophenyl)gallate","Acta Crystallographica Section C","2000","56","4","e134","e135","10.1107/S0108270100003899","","","0.71073","MoKα","","0.114","0.045","","","","0.075","","","","","","1.014","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010871","10.904","0.003","13.184","0.004","10.352","0.002","99.74","0.02","97.24","0.02","80.06","0.02","1437.5","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","trans-[Co(acac)~2~(PMePh~2~)(MeOH)]PF~6~.H~2~O","trans-(Methanol)(methyldiphenylphosphine)bis(pentane-2,4-dionato)cobalt(III) Hexafluorophosphate Hydrate","","- C24 H33 Co F6 O6 P2 -","- C24 H31 Co F6 O5.776 P2 -","- C48 H62 Co2 F12 O11.552 P4 -","2","1","QB0187","Suzuki, Takayoshi","<i>trans</i>-(Methanol)(methyldiphenylphosphine)bis(pentane-2,4-dionato)cobalt(III) hexafluorophosphate hydrate","Acta Crystallographica Section C","2000","56","4","e118","e119","10.1107/S0108270100002894","","","0.71073","MoKα","","0.194","0.055","","","","0.167","","","","","","0.965","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010872","7.1304","0.0004","6.9381","0.0004","13.415","0.0007","90","","90.901","0.004","90","","663.58","0.06","297","","297","","","","","","","","","3","P 1 21 1","P 2yb","4","","1,2-dihydro-2-(1,2-dihydroxyprop-2-yl)-8H-furo[2,3-h]benzopyran-8-one monohydrate","","- C14 H16 O6 -","- C14 H16 O6 -","- C28 H32 O12 -","2","1","QB0188","Billiot, Fereshteh Haddadian; Billodeaux, Damon R.; Watkins, Steven F.; Fronczek, Frank R.","A chiral furocoumarin","Acta Crystallographica Section C","2000","56","4","e136","e137","10.1107/S0108270100002705","","","1.54184","CuKα","","0.038","0.036","","","","0.097","","","","","","1.07","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010873","33.654","0.009","30.229","0.008","6.798","0.002","90","","94.74","0.01","90","","6892","3","123","2","123","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Bis-[(4,4""-didecyloxy-p-terphenyl-2'-yl)methyl]carbonate","","- C79 H110 O7 -","- C79 H110 O7 -","- C316 H440 O28 -","4","1","QB0192","Gupta, Sakuntala; Palmer, R. A.; Potter, B. S.; Frampton, C. S.; Tschierske, Carsten; SenGupta, S. P.","A double mesogen based on linked <i>p</i>-terphenyl units","Acta Crystallographica Section C","2000","56","4","e156","e156","10.1107/S0108270100003279","","","0.71073","MoKα","","0.242","0.071","","0.201","","0.13","","","1.016","","","1.16","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010874","7.68","0.0011","8.576","0.002","8.889","0.002","88.29","0.02","78.46","0.02","67.29","0.02","528.4","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Bis(pyridilate)nickel(II)","bis[2-hydroxy-2,2-bis(2-pyridyl)ethanoate-O^1^,N,N']nickel(II)","","- C24 H18 N4 Ni O6 -","- C24 H16 N4 Ni O6 -","- C24 H16 N4 Ni O6 -","1","0.5","QB0193","Abrahams, Brendan F.; Hoskins, Bernard F.; Hudson, Timothy A.; Robson, Richard","Monoclinic and triclinic forms of bis[2-hydroxy-2,2-bis(2-pyridyl)ethanoato-<i>O</i>^1^,<i>N</i>,<i>N</i>']nickel(II)","Acta Crystallographica Section C","2000","56","4","e126","e127","10.1107/S0108270100003401","","","1.5418","CuKα","","0.056","0.046","","","","0.131","","","","","","1.071","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010875","7.7763","0.0008","15.736","0.002","8.839","0.0014","90","","96.56","0.011","90","","1074.5","0.2","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","Bis(pyridilate)nickel(II)","bis[2-hydroxy-2,2-bis(2-pyridyl)ethanoate-O^1^,N,N']nickel(II)","","- C24 H18 N4 Ni O6 -","- C24 H16 N4 Ni O6 -","- C48 H32 N8 Ni2 O12 -","2","1","QB0193","Abrahams, Brendan F.; Hoskins, Bernard F.; Hudson, Timothy A.; Robson, Richard","Monoclinic and triclinic forms of bis[2-hydroxy-2,2-bis(2-pyridyl)ethanoato-<i>O</i>^1^,<i>N</i>,<i>N</i>']nickel(II)","Acta Crystallographica Section C","2000","56","4","e126","e127","10.1107/S0108270100003401","","","1.5418","CuKα","","0.055","0.044","","","","0.116","","","","","","1.054","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010876","8.7124","0.0012","9.0659","0.0005","12.7901","0.0015","87.537","0.008","86.992","0.01","87.873","0.008","1007.3","0.19","163","2","163","2","","","","","","","","3","P -1","-P 1","2","1,3,5-Tri(chloromethyl)benzene","","","- C9 H9 Cl3 -","- C9 H9 Cl3 -","- C36 H36 Cl12 -","4","2","QB0195","Bryan, Jeffrey C.; Burnett, Michael N.; Sachleben, Richard A.","1,3,5-Tris(chloromethyl)benzene","Acta Crystallographica Section C","2000","56","4","e167","e167","10.1107/S0108270100003875","","","0.71073","MoKα","","0.052","0.032","","","","0.088","","","","","","1.041","","","","has coordinates","192316","2020-10-21","18:00:00",""
"2010877","12.474","0.003","15.213","0.004","10.684","0.003","90","","105.95","0.03","90","","1949.4","0.9","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Hydroxy-1-methyl-2-oxo-1,2-dihydro-quinoline-3-carboxylic acid(4-oxo-2-propyl-4H-quinazolin-3-yl)-amide","","- C22 H20 N4 O4 -","- C22 H20 N4 O4 -","- C88 H80 N16 O16 -","4","1","QB0196","Shishkina, S. V.; Shishkin, O. V.; Ukrainets, I. V.; Jaradat, N. A.; Gorokhova, O. V.","4-Hydroxy-1-methyl-2-oxo-<i>N</i>-(4-oxo-2-propyl-3,4-dihydroquinazolin-3-yl)-1,2-dihydroquinoline-3-carboxamide","Acta Crystallographica Section C","2000","56","4","e168","e169","10.1107/S0108270100003887","","","0.71073","MoKα","","0.134","0.064","","","","0.19","","","","","","0.955","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010878","6.6583","0.0001","13.733","0.002","17.414","0.001","90","","116.57","0.01","90","","1424.1","0.3","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","BEDT-TTF","bis(ethylenedithio)tetrathiafulvalene","","- C10 H8 S8 -","- C10 H8 S8 -","- C40 H32 S32 -","4","1","SK1337","Philippe Guionneau; Daniel Chasseau; Judith A.K. Howard; Peter Day","Neutral bis(ethylenedithio)tetrathiafulvalene at 100K","Acta Crystallographica Section C","2000","56","4","453","454","10.1107/S0108270199016753","","","0.71073","MoKα","","0.0399","0.0273","","","","0.061","","","","","","1.086","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010879","8.4937","0.0006","8.5226","0.0004","27.884","0.004","90","","90","","90","","2018.5","0.3","293","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","Poly[[bis(dimethyl sulfoxide-κO)tris(thiocyanato-κN)manganese(II)]-μ- thiocyanato-κ^2^N:S-mercury(II)]","","- C8 H12 Hg Mn N4 O2 S6 -","- C8 H12 Hg Mn N4 O2 S6 -","- C32 H48 Hg4 Mn4 N16 O8 S24 -","4","1","SK1349","Wang, Xin Qiang; Yu, Wen Tao; Xu, Dong; Lu, Meng Kai; Yuan, Duo Rong","Poly[[bis(dimethyl sulfoxide-κ<i>O</i>)tris(thiocyanato-κ<i>N</i>)manganese(II)]-μ-thiocyanato-κ^2^<i>N</i>:<i>S</i>-mercury(II)]","Acta Crystallographica Section C","2000","56","4","418","420","10.1107/S0108270199016765","","","0.71073","MoKα","","0.07","0.043","","","","0.112","","","","","","1.027","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010880","12.877","0.001","15.079","0.002","16.212","0.003","65.1","0.02","71.71","0.02","69.93","0.02","2628.4","0.8","295","2","293","2","","","","","","","","6","P -1","-P 1","2","","Di-μ-chlorobis[N-2-hydroxybuthyl)salicylideneiminato-N,O,O'copper(II)] methanol hydrate (1/1/1).","","- C45 H62 Cl4 Cu4 N4 O10 -","- C45 H62 Cl4 Cu4 N4 O10 -","- C90 H124 Cl8 Cu8 N8 O20 -","2","1","AV1033","Maniukiewicz, Waldemar; Bukowska-Strzyżewska, Maria","A 1:1 cocrystal of di-μ-chloro-bis{[<i>N</i>-(1-hydroxybut-2-yl)salicylideneiminato-<i>N</i>,<i>O</i>,<i>O</i>']copper(II)} monohydrate and its methanol solvate","Acta Crystallographica Section C","2000","56","5","562","563","10.1107/S0108270100002559","","","0.71073","MoKα","","0.0549","0.0458","","","","0.1186","","","","","","1.095","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010881","9.727","0.002","13.781","0.002","9.956","0.002","90","","90.46","0.02","90","","1334.5","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","tris-(2-cyanoethyl)isocyanuric acid","tris-(2-cyanoethyl)-1,3,5-triazine-2,4,6(1H,3H,5H)-trione","","- C12 H12 N6 O3 -","- C12 H12 N6 O3 -","- C48 H48 N24 O12 -","4","1","BK1500","Thallapally, Praveen K.; Desiraju, Gautam R.; tris-(2-cyanoethyl)-1,3,5-triazine-2,4,6(1H,3H,5H)-trione","Tris(2-cyanoethyl) isocyanurate","Acta Crystallographica Section C","2000","56","5","572","573","10.1107/S0108270100001396","","","0.71073","MoKα","","0.095","0.063","","0.19","0.157","","","","1.067","1.109","1.109","","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010882","9.4539","0.0002","11.8134","0.0003","12.8999","0.0003","86.918","0.001","83.194","0.001","77.308","0.001","1395.02","0.06","193","2","","","","","","","","","","7","P -1","-P 1","2","((Trimethylsilyl)amino)gallium dichloride THF","Dichloro(tetrahydrofuran-O)[(trimethylsilyl)amido-N]gallium(III)","","- C7 H18 Cl2 Ga N O Si -","- C7 H12 Cl2 Ga N O Si -","- C28 H48 Cl8 Ga4 N4 O4 Si4 -","4","2","BK1507","Pickett, Nigel L.; Just, Oliver; VanDerveer, Donald G.; Rees Jr, William S.","Dichloro(tetrahydrofuran-<i>O</i>)[(trimethylsilyl)amido-<i>N</i>]gallium(III)","Acta Crystallographica Section C","2000","56","5","560","561","10.1107/S010827010000247X","","","0.71073","MoKα","","","0.038","","","","0.108","","","","","","1.03","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010883","11.368","0.002","16.922","0.003","11.092","0.002","103.26","0.02","117.8","0.01","89.64","0.02","1824.6","0.6","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","1,2:1,3-Bis(μ-p-toluato-O:O')-1-(triphenylphosphine-P)- 1-ruthena-closo-undecaborane","","- C34 H37 B10 O4 P Ru -","- C34 H37 B10 O4 P Ru -","- C68 H74 B20 O8 P2 Ru2 -","2","1","BK1512","Nie, Yong; Hu, Chun-Hua; Wu, Qiang-Jin; Lu, Shao-Fang; Jin, Ruo-Shui; Zheng, Pei-Ju","1,2:1,3-Bis(μ-<i>p</i>-toluato-<i>O</i>:<i>O</i>')-1-(triphenylphosphine-<i>P</i>)-1-ruthena-<i>closo</i>-undecaborane","Acta Crystallographica Section C","2000","56","5","536","537","10.1107/S0108270100001207","","","0.71069","MoKα","","0.057","0.041","","","","0.123","","","","","","1.023","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010884","4.032","0.002","5.717","0.001","9.626","0.001","86.04","0.01","80.6","0.02","86.09","0.03","218.02","0.12","293","2","293","2","","","","","","","","4","P -1","-P 1","2","2,5-bis(methylthio)-1,4-benzoquinone","2,5-Bis(methylthio)-1,4-benzoquinone","","- C8 H8 O2 S2 -","- C8 H8 O2 S2 -","- C8 H8 O2 S2 -","1","0.5","BK1513","Parvez, Masood; Mesher, Shaun T.; Clark, Peter D.","2,5-Bis(methylthio)-1,4-benzoquinone and 2-methyl-3-(methylsulfonyl)benzo[<i>b</i>]thiophene","Acta Crystallographica Section C","2000","56","5","574","576","10.1107/S0108270100001402","","","1.54178","CuKα","","0.044","0.043","","","","0.111","","","","","","1.15","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010885","5.8228","0.0005","10.44","0.001","8.6217","0.0009","90","","99.57","0.01","90","","516.82","0.09","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","2-Methyl-3-(methylsulfonyl)benzo[b]thiophene","2-Methyl-3-(methylsulfonyl)benzo[b]thiophene","","- C10 H10 O2 S2 -","- C10 H10 O2 S2 -","- C20 H20 O4 S4 -","2","1","BK1513","Parvez, Masood; Mesher, Shaun T.; Clark, Peter D.","2,5-Bis(methylthio)-1,4-benzoquinone and 2-methyl-3-(methylsulfonyl)benzo[<i>b</i>]thiophene","Acta Crystallographica Section C","2000","56","5","574","576","10.1107/S0108270100001402","","","0.71069","MoKα","","0.046","0.029","","","","0.109","","","","","","1.19","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010886","12.3629","0.0007","6.7768","0.0004","16.9374","0.0012","90","","101.151","0.006","90","","1392.24","0.15","294","2","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H17 Na O6 -","- C12 H17 Na O6 -","- C48 H68 Na4 O24 -","4","1","BM1395","Muir, Kenneth W.; Macdonald, Alistair; Murray, Alistair; Macdonald, Allison","Sodium dihydrogen tris(cyclopropanecarboxylate)","Acta Crystallographica Section C","2000","56","5","534","535","10.1107/S0108270100001128","","","0.71073","MoKα","","","0.042","","","","0.125","","","","","","1.017","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2010887","17.995","0.004","16.601","0.003","16.879","0.003","90","","114.52","0.03","90","","4587.6","1.9","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C20 H25 Cl2 Cu N4 O6.5 -","- C20 H25 Cl2 Cu N4 O6.5 -","- C160 H200 Cl16 Cu8 N32 O52 -","8","1","BM1397","Koman, Marian; Seglá, Peter; Jamnický, Miroslav; Glowiak, Tadeusz","Chlorobis[4,4-bis(hydroxymethyl)-2-(2-pyridyl)-4,5-dihydrooxazole-<i>N</i>,<i>N</i>']copper(II) chloride hemihydrate","Acta Crystallographica Section C","2000","56","5","554","555","10.1107/S0108270100001633","","","0.71073","MoKα","","0.0632","0.0284","","","","0.0518","","","","","","0.804","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2010888","8.9439","0.0009","11.5231","0.0012","12.0135","0.0012","63.663","0.003","68.248","0.003","75.966","0.003","1026.06","0.18","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H21 N3 O2 S -","- C25 H21 N3 O2 S -","- C50 H42 N6 O4 S2 -","2","1","BM1400","Jain, Subhash C.; Bharadvaja, Aparna; Kumar, Rohtash; Agarwal, Deepti; Errington, William","3-[4-(3,4-Dimethylphenyl)-1,3-thiazol-2-yl]-2-(2-hydroxyphenyl)-1,2,3,4-tetrahydroquinazolin-4-one","Acta Crystallographica Section C","2000","56","5","592","593","10.1107/S0108270100001815","","","0.71073","MoKα","","0.0704","0.0434","","","","0.1156","","","","","","0.957","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010889","14.3618","0.0001","10.46","0.0001","7.5779","0.0001","90","","90","","90","","1138.39","0.02","190","2","190","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C5 H16 B8 N2 -","- C5 H16 B8 N2 -","- C20 H64 B32 N8 -","4","1","BR1272","Price, Caroline; Dörfler, Udo; Kennedy, John D.; Thornton-Pett, Mark","Polyhedral azaborane chemistry, 6-(C~5~H~5~N)-<i>arachno</i>-4-NB~8~H~11~","Acta Crystallographica Section C","2000","56","5","600","601","10.1107/S0108270100002742","","","0.71073","MoKα","","0.0365","0.0348","","","","0.0931","","","","","","1.067","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010890","10.066","0.001","9.681","0.002","10.234","0.001","90","","119.78","0.001","90","","865.6","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","potassium trinickel arsenate diarsenate","","- As3 K Ni3 O11 -","- As3 K Ni3 O11 -","- As12 K4 Ni12 O44 -","4","1","BR1273","Ben Smail, Ridha; Jouini, Tahar","KNi~3~(AsO~4~)(As~2~O~7~)","Acta Crystallographica Section C","2000","56","5","513","514","10.1107/S0108270100000792","","","0.71069","MoKα","","0.059","0.032","","0.066","","0.059","","","1.098","","","1.144","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010891","5.7354","0.0011","5.7354","0.0011","4.6635","0.0018","90","","90","","120","","132.85","0.06","298","2","298","2","","","","","","","","3","P -3 m 1","-P 3 2""","164","potassium hexafluoro titanate","dipotassium hexafluorotitanate(IV)","","- F6 K2 Ti -","- F6 K2 Ti -","- F6 K2 Ti -","1","0.0833333","BR1278","Göbel, Ole","Rerefinement of K~2~[TiF~6~]","Acta Crystallographica Section C","2000","56","5","521","522","10.1107/S0108270100002560","","","0.71073","MoKα","","0.04","0.028","","","","0.05","","","","","","1.152","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010892","6.2394","0.0008","11.6342","0.0008","14.1648","0.0012","89.697","0.007","88.44","0.009","81.32","0.008","1016.07","0.17","293","2","293","2","","","","","","","","4","P -1","-P 1","2","Calcium(II) meso-2,3-diphenylsuccinate heptahydrate","Calcium(II) meso-2,3-diphenylsuccinate heptahydrate","","- C16 H26 Ca O11 -","- C16 H26 Ca O11 -","- C32 H52 Ca2 O22 -","2","1","DA1102","Morin, Gregory, T.; Shang, Maoyu; Smith, Bradley D.; Calcium(II) meso-2,3-diphenylsuccinate heptahydrate","Calcium(II) <i>meso</i>-2,3-diphenylsuccinate heptahydrate","Acta Crystallographica Section C","2000","56","5","544","545","10.1107/S0108270100001578","","","0.71073","MoKα","","0.035","0.032","","0.083","0.079","","","","1.057","1.056","1.056","","","","","has coordinates,has disorder","176760","2020-10-21","18:00:00",""
"2010893","8.231","0.0016","10.655","0.002","17.042","0.003","90","","102.26","0.03","90","","1460.5","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[1-(Cp)-1-Ti-2-(Me)-3-(SiMe~3~)-2,3-C~2~B~4~H~4~)]~2~","","- C22 H42 B8 Si2 Ti2 -","- C22 H42 B8 Si2 Ti2 -","- C44 H84 B16 Si4 Ti4 -","2","0.5","DA1105","Hosmane, Narayan S.; Zheng, Chong","The dimeric mixed-ligand titanacarborane sandwich [1-(Cp)-1-Ti-2-(Me)-3-(SiMe~3~)-2,3-C~2~B~4~H~4~]~2~","Acta Crystallographica Section C","2000","56","5","525","527","10.1107/S0108270100001013","","","0.71073","MoKα","","0.0583","0.0354","","","","0.0889","","","","","","1.026","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010894","7.532","0.002","9.073","0.003","14.654","0.004","90","","99.07","0.02","90","","988.9","0.5","288","2","288","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(3-methoxy-4-methyl-N-methylbenzohydroxamato-O,O') copper(II)","","- C20 H24 Cu N2 O6 -","- C20 H24 Cu N2 O6 -","- C40 H48 Cu2 N4 O12 -","2","0.5","DA1108","Baughman, Russell G.; Brink, Daniel J.; Butler, Jill M.; New, Pamela R.","Three complexes of bis(<i>N</i>-methylbenzohydroxamato-<i>O</i>,<i>O</i>')copper(II)","Acta Crystallographica Section C","2000","56","5","528","531","10.1107/S0108270100001025","","","0.71073","MoKα","","0.0478","0.0345","","0.0952","","0.0873","","","1.057","","","1.112","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2010895","6.5953","0.0009","19.503","0.002","7.387","0.001","90","","116.454","0.009","90","","850.7","0.2","288","2","288","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis(4-chloro-N-methylbenzohydroxamato-O,O') copper(II)","","- C16 H14 Cl2 Cu N2 O4 -","- C16 H14 Cl2 Cu N2 O4 -","- C32 H28 Cl4 Cu2 N4 O8 -","2","0.5","DA1108","Baughman, Russell G.; Brink, Daniel J.; Butler, Jill M.; New, Pamela R.","Three complexes of bis(<i>N</i>-methylbenzohydroxamato-<i>O</i>,<i>O</i>')copper(II)","Acta Crystallographica Section C","2000","56","5","528","531","10.1107/S0108270100001025","","","0.71073","MoKα","","0.04","0.0299","","0.0839","","0.0755","","","1.101","","","1.117","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010896","11.197","0.002","9.571","0.001","14.676","0.002","90","","107.21","0.01","90","","1502.4","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis(3,5-dinitro-N-methylbenzohydroxamato-O,O') copper(II): chloroform (1:1)","","- C17 H13 Cl3 Cu N6 O12 -","- C18 H14 Cl6 Cu N6 O12 -","- C36 H28 Cl12 Cu2 N12 O24 -","2","0.5","DA1108","Baughman, Russell G.; Brink, Daniel J.; Butler, Jill M.; New, Pamela R.","Three complexes of bis(<i>N</i>-methylbenzohydroxamato-<i>O</i>,<i>O</i>')copper(II)","Acta Crystallographica Section C","2000","56","5","528","531","10.1107/S0108270100001025","","","0.71073","MoKα","","0.0845","0.0498","","0.1325","","0.113","","","1.05","","","1.13","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010897","15.651","0.003","16.048","0.003","24.022","0.005","90","","108.18","0.03","90","","5732","2","100","","100","","","","","","","","","6","C 1 c 1","C -2yc","9","","Bis(μ-3,11-diethyl-6,8-diphenyl-3,6,8,11-tetraphosphatridecane- κ^4^-P^3^,P^6^:P^8^,P^11^)dirhodium(I) bis(tetrafluoroborate)","","- C50 H80 B2 F8 P8 Rh2 -","- C50 H80 B2 F8 P8 Rh2 -","- C200 H320 B8 F32 P32 Rh8 -","4","1","DA1112","Hunt Jr, Clinton; Nelson, Brent D.; Harmon, Elisa G.; Fronczek, Frank R.; Watkins, Steven F.; Billodeaux, Damon R.; Stanley, George G.","A binuclear rhodium(I) complex with two tetraphosphine ligands at 100K","Acta Crystallographica Section C","2000","56","5","546","548","10.1107/S010827010000158X","","","0.71073","MoKα","","0.049","0.038","","0.095","0.089","","","","1.04","1.03","1.03","","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010898","17.472","0.004","4.9237","0.001","9.956","0.002","90","","94.08","0.03","90","","854.3","0.3","293","","293","","","","","","","","","3","C 1 2 1","C 2y","5","","1,3(R):4,6(R)-di-O-benzylidene-D-mannitol","","- C20 H22 O6 -","- C20 H22 O6 -","- C40 H44 O12 -","2","0.5","DA1113","Xiao, Yingxin; Voll, Ronald J.; Billodeaux, Damon R.; Fronczek, Frank R.; Younathan, Ezzat S.","1,3(<i>R</i>):4,6(<i>R</i>)-Di-<i>O</i>-benzylidene-<small>D</small>-mannitol","Acta Crystallographica Section C","2000","56","5","582","583","10.1107/S0108270100001591","","","1.54184","CuKα","","0.034","0.033","","","","0.093","","","","","","0.933","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010899","5.902","0.001","8.628","0.002","12.949","0.002","95.02","0.01","93.34","0.01","102.45","0.01","639.4","0.2","289","2","289","2","","","","","","","","4","P -1","-P 1","2","","2,2,5,5,8,8-hexamethyl-4,5,7,8-tetrahydroimidazo[1,2-a]pyrazine- -3,6-dione","","- C12 H19 N3 O2 -","- C12 H19 N3 O2 -","- C24 H38 N6 O4 -","2","1","DA1114","Basiuk, Vladimir A.; Van Meervelt, Luc; Soloshonok, Vadim A.; Basiuk, Elena V.","2,2,5,5,8,8-Hexamethyl-2,3,5,6,7,8-hexahydroimidazo[1,2-<i>a</i>]pyrazine-3,6-dione, a bicyclic product of α-aminoisobutyric acid condensation","Acta Crystallographica Section C","2000","56","5","598","599","10.1107/S0108270100002766","","","0.71073","MoKα","","0.0679","0.0424","","","","0.1164","","","","","","1.013","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010900","13.2543","0.0009","25.7694","0.0018","3.8521","0.0002","90","","90","","90","","1315.71","0.15","293","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","1,2,7,8 dibenzofluorenone","13H-dibenzo[a,i]fluoren-13-one","","- C21 H12 O -","- C21 H12 O -","- C84 H48 O4 -","4","0.5","DA1115","Morris, David G.; Higgins, Sean; Ryder, Karl S.; Howie, R. Alan; Muir, Kenneth W.","13<i>H</i>-Dibenzo[<i>a</i>,<i>i</i>]fluoren-13-one","Acta Crystallographica Section C","2000","56","5","570","571","10.1107/S0108270100001049","","","0.71073","MoKα","","0.116","0.054","","","","0.167","","","","","","1.004","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010901","8.32","0.002","11.222","0.003","12.409","0.003","115.317","0.004","107.351","0.004","92.688","0.004","979","0.4","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","bis(diethoxyselenophosphinoyl) triselenide","","- C8 H20 O4 P2 Se5 -","- C8 H20 O4 P2 Se5 -","- C16 H40 O8 P4 Se10 -","2","1","DA1125","Béreau, Virginie; Ibers, James A.","Bis(diethoxyselenophosphinoyl) triselenide and bis(diisopropoxyselenophosphinoyl) diselenide","Acta Crystallographica Section C","2000","56","5","584","586","10.1107/S0108270100001608","","","0.71073","MoKα","","0.029","0.021","","","","0.054","","","","","","0.902","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010902","8.3796","0.001","8.5314","0.001","8.5577","0.001","98.668","0.002","111.851","0.002","93.459","0.002","556.81","0.11","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","bis(diisopropoxyselenophosphinoyl) diselenide","","- C12 H28 O4 P2 Se4 -","- C12 H28 O4 P2 Se4 -","- C12 H28 O4 P2 Se4 -","1","0.5","DA1125","Béreau, Virginie; Ibers, James A.","Bis(diethoxyselenophosphinoyl) triselenide and bis(diisopropoxyselenophosphinoyl) diselenide","Acta Crystallographica Section C","2000","56","5","584","586","10.1107/S0108270100001608","","","0.71073","MoKα","","0.029","0.026","","","","0.071","","","","","","1.33","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010903","5.794","0.004","4.719","0.005","28.688","0.005","90","","95.08","0.03","90","","781.3","1","293","","293","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","gallic acid monohydrate","3,4,5-trihydroxybenzoic acid monohydrate","","- C7 H8 O6 -","- C7 H8 O6 -","- C28 H32 O24 -","4","1","DE1123","Jiang, Ren-Wang; Ming, Dong-Sheng; But, Paul P. H.; Mak, Thomas C. W.","Gallic acid monohydrate","Acta Crystallographica Section C","2000","56","5","594","595","10.1107/S0108270100001827","","","0.71073","MoKα","","0.083","0.042","","0.112","","0.127","","","","","","1.006","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010904","6.802","0.0011","6.066","0.002","7.804","0.0013","90","","112.61","0.011","90","","297.25","0.12","125","","125","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","picolinic acid N-oxide","2-carboxypyridine-N-oxide'","","- C6 H5 N O3 -","- C6 H5 N O3 -","- C12 H10 N2 O6 -","2","0.5","DE1129","Steiner, Thomas; Schreurs, Antoine M. M.; Lutz, Martin; Kroon, Jan","Strong intramolecular O—H···O hydrogen bonds in quinaldic acid <i>N</i>-oxide and picolinic acid <i>N</i>-oxide","Acta Crystallographica Section C","2000","56","5","577","579","10.1107/S0108270100001475","","","0.71073","MoKα","","0.0405","0.0344","","","","0.0955","","","","","","1.117","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010905","3.821","0.003","16.2406","0.001","13.062","0.003","90","","91.01","0.01","90","","810.4","0.7","125","","125","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","quinaldic acid N-oxide","2-carboxyquinoline-N-oxide","","- C10 H7 N O3 -","- C10 H7 N O3 -","- C40 H28 N4 O12 -","4","1","DE1129","Steiner, Thomas; Schreurs, Antoine M. M.; Lutz, Martin; Kroon, Jan","Strong intramolecular O—H···O hydrogen bonds in quinaldic acid <i>N</i>-oxide and picolinic acid <i>N</i>-oxide","Acta Crystallographica Section C","2000","56","5","577","579","10.1107/S0108270100001475","","","0.71073","MoKα","","0.063","0.0439","","","","0.1148","","","","","","1.089","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010906","14.518","0.009","13.701","0.007","23.924","0.004","90","","106.59","0.04","90","","4561","4","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C25 H38 N Ti -","- C25 H38 N Ti -","- C200 H304 N8 Ti8 -","8","1","FG1577","Ellis, Dianne D.; Spek, Anthony L.","[η^5^,σ-3,3-Dimethyl-1-(2,3,4,5-tetramethylcyclopentadienyl)but-1-en-2-amino](η^5^-pentamethylcyclopentadienyl)titanium","Acta Crystallographica Section C","2000","56","5","558","559","10.1107/S0108270100002158","","","0.71073","MoKα","","0.0995","0.0555","","","","0.1616","","","","","","1.066","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010907","16.9096","0.0017","18.351","0.002","8.35","0.002","90","","90","","90","","2591.1","0.7","100","2","100","2","","","","","","","","3","P c c n","-P 2ab 2ac","56","","","","- C28 H40 O8 -","- C28 H40 O8 -","- C112 H160 O32 -","4","0.5","FG1578","Ellis, Dianne D.; Spek, Anthony L.","1,3:16,18-Bis(xylyl)-30-crown-8","Acta Crystallographica Section C","2000","56","5","596","597","10.1107/S010827010000250X","","","0.71073","MoKα(Zr-filtered)","","0.0584","0.0429","","","","0.1093","","","","","","1.025","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010908","11.327","0.001","7.054","0.001","12.381","0.001","90","","90","","90","","989.25","0.18","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","selenitotetrammine cobaltate(III) nitrate, monohydrate","","- Co H14 N5 O7 Se -","- Co H14 N5 O7 Se -","- Co4 H56 N20 O28 Se4 -","4","0.5","FR1235","Emara, A. A. A.; Krause Bauer, Jeanette A.; Galal, A.","Tetraammine(selenito-<i>O</i>,<i>O</i>')cobaltate(III) nitrate monohydrate","Acta Crystallographica Section C","2000","56","5","515","517","10.1107/S010827010000127X","","","0.71073","MoKα","","0.0369","0.0295","","","","0.0645","","","","","","1.121","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010909","23.12","0.02","12.566","0.009","19.142","0.01","90","","93.32","0.07","90","","5552","7","220","2","220","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","(Z)-N-(Bromomagnesio)-1-(2-naphthylmethoxy)propan-2-imine","","- C58 H76 Br2 Mg2 N2 O6 -","- C58 H76 Br2 Mg2 N2 O6 -","- C232 H304 Br8 Mg8 N8 O24 -","4","0.5","FR1246","Charette, André B.; Gagnon, Alexandre; Bélanger-Gariépy, Francine","(<i>Z</i>)-Bis{μ-[1-(2-naphthylmethyloxy)propan-2-iminato-<i>O</i>,<i>N</i>:<i>N</i>]}bis[bromobis(tetrahydrofuran-<i>O</i>)magnesium] ditoluene solvate","Acta Crystallographica Section C","2000","56","5","538","540","10.1107/S0108270100001281","","","1.54056","CuKα","","0.1056","0.043","","0.0891","","0.0765","","","0.777","","","0.981","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2010910","10.5873","0.0004","17.583","0.0007","18.0564","0.0007","90","","93.303","0.001","90","","3355.7","0.2","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C34 H46 Fe P2 Pd S2 -","- C34 H46 Fe P2 Pd S2 -","- C136 H184 Fe4 P8 Pd4 S8 -","4","1","FR1253","Ilia A. Guzei; Letladi L. Maisela; James Darkwa","[Ferrocene-1,1'-diylbis(diisopropylphosphine-<i>P</i>)]bis(phenylthio)palladium(II)","Acta Crystallographica Section C","2000","56","5","564","565","10.1107/S0108270100000172","","","0.71073","MoKα","","0.0448","0.028","","","","0.0519","","","","","","1.04","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010911","6.2605","0.0007","12.0422","0.0008","18.193","0.002","105.689","0.007","95.477","0.009","95.672","0.007","1303.3","0.2","293","2","","","","","","","","","","4","P -1","-P 1","2","","","","- C14 H21 N O -","- C14 H21 N O -","- C56 H84 N4 O4 -","4","2","FR1259","Luck, Rudy L.; Mendenhall, G. David","2,4,4-Trimethyl-2-phenyl-3-pentanone oxime","Acta Crystallographica Section C","2000","56","5","602","603","10.1107/S0108270100002754","","","0.71069","MoKα","","","0.038","","","","0.105","","","","","","1.014","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010912","5.9384","0.0004","12.3808","0.0009","17.2097","0.0014","90","","90","","90","","1265.29","0.16","294","1","294","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(2S)-2-(1-oxo-1H-2,3-dihydroisoindol-2-yl)pentanoic acid","","- C13 H15 N O3 -","- C13 H15 N O3 -","- C52 H60 N4 O12 -","4","1","GD1085","Gallagher, John F.; Brady, Fiona","O—H···O, C—H···O and C—H···π~arene~ intermolecular interactions in (2<i>S</i>)-2-(1-oxo-1<i>H</i>-2,3-dihydroisoindol-2-yl)pentanoic acid and (2<i>S</i>)-3-methyl-2-(1-oxo-1<i>H</i>-2,3-dihydroisoindol-2-yl)butanoic acid","Acta Crystallographica Section C","2000","56","5","619","622","10.1107/S0108270100003553","","","0.7107","MoKα","","0.047","0.029","","","","0.076","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2010913","5.8767","0.0006","9.9036","0.0013","10.4818","0.0015","103.332","0.013","99.759","0.011","89.792","0.011","584.62","0.13","294","1","294","1","","","","","","","","4","P 1","P 1","1","","(2S)-3-methyl-2-(1-oxo-1H-2,3-dihydroisoindol-2-yl)butanoic acid","","- C13 H15 N O3 -","- C13 H15 N O3 -","- C26 H30 N2 O6 -","2","2","GD1085","Gallagher, John F.; Brady, Fiona","O—H···O, C—H···O and C—H···π~arene~ intermolecular interactions in (2<i>S</i>)-2-(1-oxo-1<i>H</i>-2,3-dihydroisoindol-2-yl)pentanoic acid and (2<i>S</i>)-3-methyl-2-(1-oxo-1<i>H</i>-2,3-dihydroisoindol-2-yl)butanoic acid","Acta Crystallographica Section C","2000","56","5","619","622","10.1107/S0108270100003553","","","0.7107","MoKα","","0.06","0.048","","","","0.112","","","","","","1.016","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010914","9.101","0.001","6.073","0.001","10.312","0.001","90","","106.28","0.01","90","","547.09","0.12","294","","294","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N-méthyl succinimide","","- C5 H7 N O2 -","- C5 H7 N O2 -","- C20 H28 N4 O8 -","4","1","GS1047","Tenon, J.A.; Carles, M.; Aycard, J.P.","<i>N</i>-Méthyl succinimide","Acta Crystallographica Section C","2000","56","5","568","569","10.1107/S0108270199016170","","","0.71073","Mo-Kα","","0.068","0.042","","","","0.053","","","","","","1.869","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010915","7.2516","0.0007","10.723","0.003","12.142","0.006","90","","115.8","0.01","90","","850","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tétradihydrogénophosphate de cobalt et de sodium tétrahydrate","","- Co H16 Na2 O20 P4 -","- Co H16 Na2 O20 P4 -","- Co2 H32 Na4 O40 P8 -","2","0.5","GS1053","Guesmi, Abderrahmen; Zid, Mohamed Faouzi; Driss, Ahmed","Na~2~Co(H~2~PO~4~)~4~·4H~2~O","Acta Crystallographica Section C","2000","56","5","511","512","10.1107/S0108270199015279","","","0.71069","MoKα","","0.021","0.02","","0.057","","0.056","","","1.171","","","1.186","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010916","9.323","0.005","18.038","0.005","10.968","0.005","90","","106.57","0.005","90","","1767.9","1.3","293","2","","","","","","","","","","4","P 1 21 1","P 2yb","4","","methyl (1S,2S,3R,4R)-2-benzamido-3-(1,2-dihydroxyethyl)bicyclo [2.2.1]heptane-2-carboxylate","","- C18 H23 N O5 -","- C18 H23 N O5 -","- C72 H92 N4 O20 -","4","2","JZ1375","Buñuel, Elena; Cativiela, Carlos; Díaz-de-Villegas, María D.; Gálvez, José A.","Two new conformationally restricted 4,5-dihydroxynorvaline analogues with a norbornane skeleton","Acta Crystallographica Section C","2000","56","5","587","591","10.1107/S0108270100001645","","","0.71073","MoKα","","","0.04","","","","0.093","","","","","","1.053","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010917","7.187","0.005","11.72","0.005","20.258","0.005","90","","90","","90","","1706.4","1.5","293","2","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","methyl (1R,2S,3R,4S)-2-benzamido-3-(1,2-dihydroxyethyl)bicyclo[2.2.1]heptane-2- carboxylate","","- C18 H23 N O5 -","- C18 H23 N O5 -","- C72 H92 N4 O20 -","4","1","JZ1375","Buñuel, Elena; Cativiela, Carlos; Díaz-de-Villegas, María D.; Gálvez, José A.","Two new conformationally restricted 4,5-dihydroxynorvaline analogues with a norbornane skeleton","Acta Crystallographica Section C","2000","56","5","587","591","10.1107/S0108270100001645","","","0.71073","MoKα","","","0.029","","","","0.07","","","","","","1.058","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010918","7.499","0.001","9.114","0.002","16.717","0.002","86.06","0.02","88.61","0.01","76.73","0.02","1109.4","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","5-nitro-2-thiofuranilide","N-phenyl-5-nitro-2-thiofuramide","","- C11 H8 N2 O3 S -","- C11 H8 N2 O3 S -","- C44 H32 N8 O12 S4 -","4","2","JZ1378","Pavlović, Gordana; Mance, Ana Dunja; Jakopčić, Krešimir","5-Nitro-<i>N</i>-phenyl-2-thiofuramide","Acta Crystallographica Section C","2000","56","5","604","606","10.1107/S0108270100002882","","","0.71073","MoKα","","0.0947","0.0452","","","","0.1304","","","","","","0.958","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010919","7.1766","0.0001","7.8911","0.0001","13.7036","0.0001","90","","90","","90","","776.052","0.016","173","2","173","2","","","","","","","","5","P m n a","-P 2ac 2","53","","","","- C12 H14 Cl4 N2 Si -","- C12 H14 Cl4 N2 Si -","- C24 H28 Cl8 N4 Si2 -","2","0.25","LN1098","Hensen, Karl; Mayr-Stein, Ralf; Spangenberg, Björn; Bolte, Michael","Complexes of mixed silicon halides with 4-picoline","Acta Crystallographica Section C","2000","56","5","610","613","10.1107/S010827010000278X","","","0.71073","MoKα","","0.0216","0.0202","","","","0.0579","","","","","","1.148","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2010920","7.177","0.001","7.962","0.001","13.557","0.001","90","","90","","90","","774.69","0.16","173","2","173","2","","","","","","","","6","P m n a","-P 2ac 2","53","","","","- C12 H14 Br Cl3 N2 Si -","- C12 H14 Br Cl3 N2 Si -","- C24 H28 Br2 Cl6 N4 Si2 -","2","0.25","LN1098","Hensen, Karl; Mayr-Stein, Ralf; Spangenberg, Björn; Bolte, Michael","Complexes of mixed silicon halides with 4-picoline","Acta Crystallographica Section C","2000","56","5","610","613","10.1107/S010827010000278X","","","0.71073","MoKα","","0.0542","0.0402","","","","0.1114","","","","","","1.123","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2010921","7.252","0.002","8.12","0.002","13.54","0.003","90","","90","","90","","797.3","0.3","173","2","173","2","","","","","","","","6","P m n a","-P 2ac 2","53","","","","- C12 H14 Br2 Cl2 N2 Si -","- C12 H14 Br2 Cl2 N2 Si -","- C24 H28 Br4 Cl4 N4 Si2 -","2","0.25","LN1098","Hensen, Karl; Mayr-Stein, Ralf; Spangenberg, Björn; Bolte, Michael","Complexes of mixed silicon halides with 4-picoline","Acta Crystallographica Section C","2000","56","5","610","613","10.1107/S010827010000278X","","","0.71073","MoKα","","0.0352","0.0272","","","","0.0634","","","","","","1.119","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2010922","7.296","0.001","8.211","0.001","13.472","0.001","90","","90","","90","","807.07","0.16","173","2","173","2","","","","","","","","6","P m n a","-P 2ac 2","53","","","","- C12 H14 Br3 Cl N2 Si -","- C12 H14 Br3 Cl N2 Si -","- C24 H28 Br6 Cl2 N4 Si2 -","2","0.25","LN1098","Hensen, Karl; Mayr-Stein, Ralf; Spangenberg, Björn; Bolte, Michael","Complexes of mixed silicon halides with 4-picoline","Acta Crystallographica Section C","2000","56","5","610","613","10.1107/S010827010000278X","","","0.71073","MoKα","","0.0343","0.0235","","","","0.0521","","","","","","1.161","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2010923","7.3298","0.0002","8.2819","0.0003","13.4126","0.0003","90","","90","","90","","814.21","0.04","143","2","143","2","","","","","","","","5","P m n a","-P 2ac 2","53","","","","- C12 H14 Br4 N2 Si -","- C12 H14 Br4 N2 Si -","- C24 H28 Br8 N4 Si2 -","2","0.25","LN1098","Hensen, Karl; Mayr-Stein, Ralf; Spangenberg, Björn; Bolte, Michael","Complexes of mixed silicon halides with 4-picoline","Acta Crystallographica Section C","2000","56","5","610","613","10.1107/S010827010000278X","","","0.71073","MoKα","","0.0405","0.0277","","","","0.0653","","","","","","1.041","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2010924","16.241","0.002","16.241","0.002","15.21","0.003","90","","90","","90","","4011.9","1.1","173","2","173","2","","","","","","","","6","I 4/m","-I 4","87","","","","- C25 H29 Cl5 I6 N4 Si -","- C25 H29 Cl5 I6 N4 Si -","- C100 H116 Cl20 I24 N16 Si4 -","4","0.25","LN1099","Hensen, Karl; Mayr-Stein, Ralf; Rühl, Stephan; Bolte, Michael","<i>trans</i>-Dichlorotetrakis(4-methylpyridine)silicon bis(triiodide) chloroform solvate","Acta Crystallographica Section C","2000","56","5","614","615","10.1107/S0108270100002791","","","0.71073","MoKα","","0.0549","0.0412","","","","0.0962","","","","","","1.047","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010925","22.934","0.005","13.481","0.003","24.904","0.005","90","","115.65","0.03","90","","6941","3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Tris(2,2'-bipyridyl)nickel(II) thiosulfate heptahydrate","","- C30 H38 N6 Ni O10 S2 -","- C30 H32 N6 Ni O10.007 S2 -","- C240 H256 N48 Ni8 O80.056 S16 -","8","1","NA1452","Eleonora Freire; Sergio Baggio; Alvaro Mombru; Ricardo Baggio","Tris(2,2'-bipyridyl-<i>N</i>,<i>N</i>')nickel(II) thiosulfate heptahydrate","Acta Crystallographica Section C","2000","56","5","541","543","10.1107/S0108270100001414","","","0.71073","MoKα","","0.112","0.059","","","","0.209","","","","","","1.061","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010926","7.471","0.001","13.988","0.001","15.739","0.002","90","","90","","90","","1644.8","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","2',3'-didehydro-2',3'-O-dideoxythymidine (D4T) 1-methylpyrrolidone (NMPO) solvate","1-(2',3'-dideoxy-β-D-glycero-pent-2-enofuranosyl)thimine 1-methylpyrrolidone","","- C15 H21 N3 O5 -","- C15 H21 N3 O5 -","- C60 H84 N12 O20 -","4","1","NA1454","Viterbo, Davide; Milanesio, Marco; Pomés Hernández, Ramón; Rodríguez Tanty, Chryslaine; Colás González, Ivan; Sablón Carrazana, Marquiza; Duque Rodríguez, Julio","2',3'-Didehydro-3'-deoxythymidine <i>N</i>-methyl-2-pyrrolidone solvate (D4T·NMPO)","Acta Crystallographica Section C","2000","56","5","580","581","10.1107/S0108270100001451","","","0.71069","MoKα","","0.0992","0.0584","","","","0.1553","","","","","","0.998","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010927","6.894","0.001","10.675","0.001","11.878","0.002","73.19","0.01","79.75","0.01","84.91","0.01","822.8","0.2","203","2","203","2","","","","","","","","6","P -1","-P 1","2","","Bis(vanillin thiosemicarbazonato)nickel(II) ethanol solvate","","- C26 H44 N6 Ni O8 S2 -","- C26 H44 N6 Ni O8 S2 -","- C26 H44 N6 Ni O8 S2 -","1","0.5","OS1098","Akinchan, Narayan T.; Abram, Ulrich","Bis(4-hydroxy-3-methoxybenzaldehyde thiosemicarbazonato-<i>N</i>^1^,<i>S</i>)nickel(II) tetraethanol solvate","Acta Crystallographica Section C","2000","56","5","549","550","10.1107/S0108270100001657","","","1.54184","CuKα","","0.0531","0.0521","","","","0.1515","","","","","","1.086","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010928","9.6424","0.0009","14.861","0.002","17.021","0.002","107.604","0.003","101.474","0.002","106.528","0.002","2117.6","0.4","120","","120","","","","","","","","","6","P -1","-P 1","2","","","","- C24 H54 Fe2 N24 Ni3 O3 -","- C24 H54 Fe2 N24 Ni3 O3 -","- C48 H108 Fe4 N48 Ni6 O6 -","2","1","OS1101","Jakob Østerberg Eriksen; Alan Hazell; Astrid Jensen; Josua Jepsen; Rasmus Damgaard Poulsen","Bimetallic assemblies, [Ni(en)~2~]~3~[<i>M</i>(CN)~6~]~2~·3H~2~O (en = H~2~NCH~2~CH~2~NH~2~; <i>M</i> = Fe, Co)","Acta Crystallographica Section C","2000","56","5","551","553","10.1107/S0108270100001670","","","0.71073","MoKα","","","0.024","","","","0.033","","","","","","1.139","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010929","9.6303","0.0008","14.787","0.001","16.951","0.001","107.5","0.002","101.464","0.002","106.652","0.002","2095.6","0.3","120","","120","","","","","","","","","6","P -1","-P 1","2","","","","- C24 H54 Co2 N24 Ni3 O3 -","- C24 H54 Co2 N24 Ni3 O3 -","- C48 H108 Co4 N48 Ni6 O6 -","2","1","OS1101","Jakob Østerberg Eriksen; Alan Hazell; Astrid Jensen; Josua Jepsen; Rasmus Damgaard Poulsen","Bimetallic assemblies, [Ni(en)~2~]~3~[<i>M</i>(CN)~6~]~2~·3H~2~O (en = H~2~NCH~2~CH~2~NH~2~; <i>M</i> = Fe, Co)","Acta Crystallographica Section C","2000","56","5","551","553","10.1107/S0108270100001670","","","0.71073","MoKα","","","0.028","","","","0.04","","","","","","1.385","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010930","13.4892","0.0003","6.8637","0.0001","10.6908","0.0001","90","","90","","90","","989.82","0.03","297","2","297","2","","","","","","","","4","P n a 21","P 2c -2n","33","CTA","","","- As Cs O5 Ti -","- As Cs O5 Ti -","- As8 Cs8 O40 Ti8 -","8","2","OS1106","Nordborg, Jenni","Alkaline positions in CsTiOAsO~4~","Acta Crystallographica Section C","2000","56","5","518","520","10.1107/S010827010000130X","","","0.71073","MoKα","","0.082","0.038","","0.031","","0.026","","","1.887","","","1.993","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2010931","13.4892","0.0003","6.8637","0.0001","10.6908","0.0001","90","","90","","90","","989.82","0.03","297","2","197","2","","","","","","","","4","P n a 21","P 2c -2n","33","CTA","","","- As Cs O5 Ti -","- As Cs O5 Ti -","- As8 Cs8 O40 Ti8 -","8","2","OS1106","Nordborg, Jenni","Alkaline positions in CsTiOAsO~4~","Acta Crystallographica Section C","2000","56","5","518","520","10.1107/S010827010000130X","","","0.71073","MoKα","","0.078","0.034","","0.029","","0.023","","","1.729","","","1.763","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2010932","13.4623","0.0001","6.8484","0.0001","10.7075","0.0001","90","","90","","90","","987.18","0.019","183","1","183","1","","","","","","","","4","P n a 21","P 2c -2n","33","CTA","","","- As Cs O5 Ti -","- As Cs O5 Ti -","- As8 Cs8 O40 Ti8 -","8","2","OS1106","Nordborg, Jenni","Alkaline positions in CsTiOAsO~4~","Acta Crystallographica Section C","2000","56","5","518","520","10.1107/S010827010000130X","","","0.71073","MoKα","","0.096","0.043","","0.037","","0.03","","","1.879","","","1.996","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2010933","11.384","0.001","10.202","0.001","14.942","0.002","90","","146.816","0.006","90","","949.8","0.2","298","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H9 N O2 S -","- C10 H9 N O2 S -","- C40 H36 N4 O8 S4 -","4","1","QA0206","Keita, A.; Ahabchane, N.; Essassi, E. M.; Pierrot, M.","2-Acetyl-4<i>H</i>-benzothiazin-3(2<i>H</i>)-one","Acta Crystallographica Section C","2000","56","5","e227","e227","10.1107/S0108270100005692","","","0.71073","MoKα","","0.035","0.032","","0.045","","0.045","","","1.178","","","1.21","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010934","6.7152","0.0003","10.1507","0.0005","15.5447","0.0009","90","","90","","90","","1059.59","0.09","123","2","123","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2-Azacyclopentylidene(pentacarbonyl)chromium(0)","","- C9 H7 Cr N O5 -","- C9 H7 Cr N O5 -","- C36 H28 Cr4 N4 O20 -","4","1","QA0221","Nieger, Martin; Haase, Wilm-Christian; Dötz, Karl Heinz","An N-unprotected Fischer pyrrolidinylidene complex","Acta Crystallographica Section C","2000","56","5","e174","e175","10.1107/S0108270100004479","","","0.71073","MoKα","","0.029","0.024","","","","0.057","","","","","","1.017","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010935","11.2427","0.0002","13.3736","0.0002","12.4932","0.0002","90","","108.109","0.001","90","","1785.38","0.05","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","μ-oxo-bis-{oxo[N,N'-2,2-dimethylpropane-1,3- diylbis(salicylideneiminato)]rhenium (V)}","","- C38 H40 N4 O7 Re2 -","- C38 H40 N4 O7 Re2 -","- C76 H80 N8 O14 Re4 -","2","0.5","QA0249","Huang, Wen-Tao; Lo, Jem-Mau; Yao, Hsueh-Hua; Liao, Fen-Ling","μ-Oxo-bis{{2,2'-[2,2-dimethylpropane-1,3-diylbis(nitrilomethylidyne)]diphenolato}oxorhenium(V)}","Acta Crystallographica Section C","2000","56","5","e172","e173","10.1107/S0108270100004455","","","0.71073","MoKα","","0.058","0.038","","","","0.084","","","","","","1.013","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010936","10.88","0.002","16.458","0.002","21.261","0.002","90","","90","","90","","3807.1","0.9","248","1","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Cyclohex-1-enecarbothioic acid benzyl-(4-methoxy-phenyl)-amide","","- C21 H23 N O S -","- C21 H23 N O S -","- C168 H184 N8 O8 S8 -","8","1","QA0251","Hosomi, Hiroyuki; Ohba, Shigeru; Aoyama, Hiromu","<i>N</i>-Benzyl-<i>N</i>-(4-methoxyphenyl)cyclohex-1-enecarbothioamide","Acta Crystallographica Section C","2000","56","5","e221","e221","10.1107/S0108270100004467","","","1.54184","CuKα","","","0.062","","","","0.168","","","","","","1.24","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010937","13.278","0.002","11.34","0.003","15.94","0.002","90","","101.12","0.01","90","","2355.1","0.8","297","1","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H22 N2 O3 V -","- C28 H22 N2 O3 V -","- C112 H88 N8 O12 V4 -","4","1","QA0255","Hoshina, Gakuse; Tsuchimoto, Masanobu; Ohba, Shigeru","The <i>exo</i> and <i>endo</i> isomers of [<i>N</i>,<i>N</i>'-bis(salicylidene)-1,2-diphenyl-(<i>RS</i>,<i>SR</i>)-1,2-ethanediyldiaminato]oxovanadium(IV)","Acta Crystallographica Section C","2000","56","5","e188","e189","10.1107/S0108270100004509","","","0.71073","MoKα","","","0.047","","","","0.133","","","","","","1.03","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2010938","17.671","0.006","21.635","0.007","12.565","0.004","90","","90","","90","","4804","3","297","1","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C28 H22 N2 O3 V -","- C28 H22 N2 O3 V -","- C224 H176 N16 O24 V8 -","8","1","QA0255","Hoshina, Gakuse; Tsuchimoto, Masanobu; Ohba, Shigeru","The <i>exo</i> and <i>endo</i> isomers of [<i>N</i>,<i>N</i>'-bis(salicylidene)-1,2-diphenyl-(<i>RS</i>,<i>SR</i>)-1,2-ethanediyldiaminato]oxovanadium(IV)","Acta Crystallographica Section C","2000","56","5","e188","e189","10.1107/S0108270100004509","","","0.71073","MoKα","","","0.055","","","","0.193","","","","","","1.04","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010939","10.124","0.004","12.672","0.003","9.632","0.002","110.83","0.02","96.36","0.03","85.32","0.03","1146.6","0.6","298","","","","","","","","","","","5","P -1","-P 1","2","","","","- C28 H22 Mn N3 O2 -","- C28 H22 Mn N3 O2 -","- C56 H44 Mn2 N6 O4 -","2","1","QA0256","Iwamoto, Hirofumi; Tsuchimoto, Masanobu; Ohba, Shigeru","[1,2-Diphenyl-<i>N</i>,<i>N</i>'-bis(salicylidene)-(<i>RR</i>,<i>SS</i>)-1,2-ethanediyldiaminato]nitridomanganese(V)","Acta Crystallographica Section C","2000","56","5","e187","e187","10.1107/S0108270100004492","","","0.71073","MoKα","","","0.033","","","","0.09","","","","","","1.04","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010940","9.123","0.001","13.219","0.002","9.82","0.001","90","","112.17","0.06","90","","1096.7","0.5","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(triethanolamine)nickel(II) acetate","","- C16 H36 N2 Ni O10 -","- C16 H36 N2 Ni O10 -","- C32 H72 N4 Ni2 O20 -","2","0.5","QA0257","Krabbes, Ingmar; Seichter, Wilhelm; Gloe, Karsten","Bis(triethanolamine-<i>O</i>,<i>O</i>')nickel(II) diacetate","Acta Crystallographica Section C","2000","56","5","e178","e178","10.1107/S0108270100004819","","","0.71073","MoKα","","0.037","0.03","","0.082","","0.077","","","0.983","","","0.996","","","","has coordinates,has Fobs","192027","2020-10-21","18:00:00",""
"2010941","21.957","0.004","20.518","0.002","7.522","0.001","90","","90","","90","","3388.8","0.8","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","N'-(4-(1,1-dimethylpropyl)-benzylidene)-2-pyridinecarboxamidrazone","","- C18 H22 N4 -","- C18 H22 N4 -","- C144 H176 N32 -","8","1","QA0258","Billington, David C.; Lowe, Philip R.; Rathbone, Daniel L.; Schwalbe, Carl H.","A new amidrazone derivative with antimycobacterial activity","Acta Crystallographica Section C","2000","56","5","e211","e212","10.1107/S0108270100004807","","","1.5418","CuKα","","0.153","0.072","","","","0.231","","","","","","1.001","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2010942","12.812","0.011","7.185","0.007","17.835","0.015","90","","99.61","0.07","90","","1619","3","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2,2'-Dipyridylaminepentacarbonyltungsten(0)","","- C15 H9 N3 O5 W -","- C15 H9 N3 O5 W -","- C60 H36 N12 O20 W4 -","4","1","QA0259","Creaven, Bernadette S.; Howie, R. Alan; Long, Conor","Pentacarbonyl(di-2-pyridylamine)tungsten(0)","Acta Crystallographica Section C","2000","56","5","e181","e182","10.1107/S0108270100004728","","","0.71073","MoKα","","0.063","0.037","","","","0.082","","","","","","1.016","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010943","14.0672","0.0013","12.692","0.001","15.5238","0.0017","90","","92.972","0.009","90","","2767.9","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C35 H26 Cl N O -","- C35 H26 Cl N O -","- C140 H104 Cl4 N4 O4 -","4","1","QA0260","Kabak, Mehmet; Elerman, Yalc̨in; Güner, Vildan; Durlu, Tahsin Nuri","<i>N</i>-(<i>p</i>-Chlorophenyl)-3,3-diphenyl-4-(β-phenylstyryl)azetidin-2-one","Acta Crystallographica Section C","2000","56","5","e207","e208","10.1107/S0108270100004546","","","0.71069","MoKα","","0.117","0.048","","","","0.165","","","","","","1.031","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2010944","8.949","0.011","14.302","0.016","17.53","0.016","94.89","0.08","83.79","0.08","96.24","0.09","2211","4","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","p-Nitrobenzoato-triphenyl-tin","","- C25 H19 N O4 Sn -","- C25 H19 N O4 Sn -","- C100 H76 N4 O16 Sn4 -","4","2","QA0261","Howie, R. Alan; Wardell, James L.; Wardell, Solange M.S.V.; Cox, Philip J.","(<i>p</i>-Nitrobenzoato)triphenyltin at 298K","Acta Crystallographica Section C","2000","56","5","e179","e180","10.1107/S0108270100004510","","","0.71073","MoKα","","0.07","0.038","","","","0.088","","","","","","1.019","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010945","32.529","0.004","11.877","0.005","18.909","0.007","90","","121.01","0.01","90","","6261","4","297","1","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H38 N2 O3 V -","- C36 H38 N2 O3 V -","- C288 H304 N16 O24 V8 -","8","1","QA0262","Hoshina, Gakuse; Tsuchimoto, Masanobu; Ohba, Shigeru","<i>exo</i>-[<i>N</i>,<i>N</i>'-Bis(3-<i>tert</i>-butylsalicylidene)-1,2-diphenyl-(<i>RS</i>,<i>SR</i>)-1,2-ethanediyldiaminato]oxovanadium(IV)","Acta Crystallographica Section C","2000","56","5","e190","e190","10.1107/S0108270100004534","","","0.71073","MoKα","","","0.061","","","","0.219","","","","","","1.18","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2010946","11.172","0.001","9.337","0.001","15.634","0.001","90","","94.1","0.01","90","","1626.7","0.3","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C19 H15 N O6 -","- C19 H15 N O6 -","- C76 H60 N4 O24 -","4","1","QA0263","Filali Baba, Bouchra; Kerbal, Abdelali; Bitit, Najib; El-Bali, Brahim; Escudie, Jean; Ranaivonjatovo, Henry; Bolte, Michael","Methyl 3-<i>para</i>-anisyl-4-(2-hydroxybenzoyl)isoxazole-5-carboxylate","Acta Crystallographica Section C","2000","56","5","e205","e206","10.1107/S0108270100004522","","","0.71073","MoKα","","0.053","0.04","","","","0.105","","","","","","1.024","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010947","15.408","0.001","10.256","0.001","19.402","0.001","90","","107.91","0.01","90","","2917.4","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H32 N4 O6 S2 -","- C26 H32 N4 O6 S2 -","- C104 H128 N16 O24 S8 -","4","1","QA0264","Camí, Gerardo; Server-Carrió, Juan; Fustero, Santos; Pedregosa, José","A novel heterocyclic sulfonamide: <i>N</i>-benzyl-5-[<i>N</i>-benzyl-<i>N</i>-(<i>tert</i>-butyloxycarbonyl)amino]-<i>N</i>-(<i>tert</i>-butyloxycarbonyl)-1,3,4-thiadiazole-2-sulfonamide","Acta Crystallographica Section C","2000","56","5","e209","e210","10.1107/S0108270100004741","","","0.7107","MoKα","","0.092","0.049","","","","0.156","","","","","","1.057","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010948","15.942","0.001","6.3738","0.0004","20.895","0.002","90","","111.129","0.007","90","","1980.4","0.3","293","2","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C15 H17 Cl3 O2 S2 Sn -","- C15 H17 Cl3 O2 S2 Sn -","- C60 H68 Cl12 O8 S8 Sn4 -","4","1","QA0265","Gambardella, Maria Teresa do Prado; Francisco, Regina Helena Porto; Rodrigues, Ana Maria G. Dias; de Sousa, Gerimário Freitas","<i>catena</i>-Poly[<i>fac</i>-trichloromethyltin(IV)-μ-[<i>meso</i>-1,2-bis(phenylsulfinyl)ethane-<i>O</i>:<i>O</i>']]","Acta Crystallographica Section C","2000","56","5","e176","e177","10.1107/S010827010000473X","","","0.71073","MoKα","","0.068","0.031","","","","0.087","","","","","","1.054","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010949","8.2971","0.0011","9.4297","0.0014","9.648","0.0013","68.794","0.012","67.62","0.009","67.565","0.01","624.14","0.16","180","2","180","2","","","","","","","","3","P -1","-P 1","2","","(1R^*^,2R^*^)-1,2-o-(2',3'-dimethoxybutane-2',3'-diyl)-cyclohexane","","- C12 H22 O4 -","- C12 H22 O4 -","- C24 H44 O8 -","2","1","QA0268","Weinig, Hans-Georg; Koert, Ulrich; Ziemer, Burkhard","(1<i>R</i>*,2<i>R</i>*)-1,2-(2,3-Dimethoxybutane-2,3-dioxy)cyclohexane","Acta Crystallographica Section C","2000","56","5","e218","e218","10.1107/S0108270100005485","","","0.71073","MoKα","","0.045","0.039","","","","0.112","","","","","","1.07","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010950","10.661","0.002","11.852","0.002","13.501","0.003","76.85","0.03","81.35","0.03","72.12","0.03","1575","0.6","150","2","","","","","","","","","","5","P -1","-P 1","2","","","","- C14 H20 N2 O4 S -","- C14 H20 N2 O4 S -","- C56 H80 N8 O16 S4 -","4","2","QA0270","Coles, Simon J.; Douheret, David; Hursthouse, Michael B.; Kilburn, Jeremy D.; Rossi, Sara","<i>tert</i>-Butyl 2-[2-(ethoxycarbothioylamino)-3-pyridyloxy]acetate and <i>tert</i>-butyl 2-(3-thioxopyrido[2,1-<i>c</i>][1,2,4]thiadiazol-8-yloxy)acetate","Acta Crystallographica Section C","2000","56","5","e224","e226","10.1107/S0108270100005667","","","0.71073","MoKα","","","0.039","","","","0.123","","","","","","0.883","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010951","15.521","0.003","6.827","0.001","13.574","0.003","90","","100.06","0.03","90","","1416.2","0.5","150","2","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H14 N2 O3 S2 -","- C12 H14 N2 O3 S2 -","- C48 H56 N8 O12 S8 -","4","1","QA0270","Coles, Simon J.; Douheret, David; Hursthouse, Michael B.; Kilburn, Jeremy D.; Rossi, Sara","<i>tert</i>-Butyl 2-[2-(ethoxycarbothioylamino)-3-pyridyloxy]acetate and <i>tert</i>-butyl 2-(3-thioxopyrido[2,1-<i>c</i>][1,2,4]thiadiazol-8-yloxy)acetate","Acta Crystallographica Section C","2000","56","5","e224","e226","10.1107/S0108270100005667","","","0.71073","MoKα","","","0.039","","","","0.122","","","","","","0.807","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010952","9.681","0.002","18.474","0.002","15.786","0.002","90","","95.27","0.01","90","","2811.3","0.7","298","1","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C31 H26 N2 O8 V -","- C31 H26 N2 O8 V -","- C124 H104 N8 O32 V4 -","4","1","QA0271","Uemura, Ryushi; Tsuchimoto, Masanobu; Ohba, Shigeru","[<i>N</i>,<i>N</i>'-Bis(3-carboxysalicylidene)-1,2-diphenyl-(<i>RR</i>,<i>SS</i>)-1,2-ethanediyldiaminato-<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>'](methanol-<i>O</i>)oxovanadium(IV) and [<i>N</i>,<i>N</i>'-bis(3-carboxysalicylidene)-2,3-dimethyl-2,3-butanediyldiaminato-<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>']oxovanadium(IV) monohydrate","Acta Crystallographica Section C","2000","56","5","e199","e200","10.1107/S0108270100005679","","","0.71073","MoKα","","","0.056","","","","0.167","","","","","","1.309","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2010953","10.508","0.003","11.728","0.002","9.726","0.002","107.66","0.02","96.21","0.02","100.45","0.02","1106","0.5","298","1","","","","","","","","","","5","P -1","-P 1","2","","","","- C22 H24 N2 O8 V -","- C22 H24 N2 O8 V -","- C44 H48 N4 O16 V2 -","2","1","QA0271","Uemura, Ryushi; Tsuchimoto, Masanobu; Ohba, Shigeru","[<i>N</i>,<i>N</i>'-Bis(3-carboxysalicylidene)-1,2-diphenyl-(<i>RR</i>,<i>SS</i>)-1,2-ethanediyldiaminato-<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>'](methanol-<i>O</i>)oxovanadium(IV) and [<i>N</i>,<i>N</i>'-bis(3-carboxysalicylidene)-2,3-dimethyl-2,3-butanediyldiaminato-<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>']oxovanadium(IV) monohydrate","Acta Crystallographica Section C","2000","56","5","e199","e200","10.1107/S0108270100005679","","","0.71073","MoKα","","","0.039","","","","0.116","","","","","","1.053","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010954","12.083","0.003","14.234","0.004","12.05","0.002","93.19","0.02","109.53","0.01","111.55","0.02","1778.7","0.8","295","1","","","","","","","","","","6","P -1","-P 1","2","","","","- C38 H30 Fe N8 O3 S2 -","- C38 H24 Fe N8 O3 S2 -","- C76 H48 Fe2 N16 O6 S4 -","2","1","QA0272","Hoshina, Gakuse; Ohba, Shigeru; Tsuchiya, Naoko; Isobe, Tetsuhiko; Senna, Mamoru","Tris(1,10-phenanthroline-<i>N</i>,<i>N</i>')iron(II) dithiocyanate trihydrate","Acta Crystallographica Section C","2000","56","5","e191","e192","10.1107/S0108270100005539","","","0.71073","MoKα","","","0.062","","","","0.201","","","","","","1.03","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010955","7.453","0.005","14.911","0.005","11.458","0.005","90","","107.75","0.04","90","","1212.7","1.1","298","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C22 H24 Cu2 N4 O8 -","- C22 H24 Cu2 N4 O8 -","- C44 H48 Cu4 N8 O16 -","2","0.5","QA0273","Kani, Yoshiyuki; Tsuchimoto, Masanobu; Ohba, Shigeru","Tetra-μ-acetato-<i>O</i>:<i>O</i>'-bis[(7-azaindole-<i>N</i>)copper(II)]","Acta Crystallographica Section C","2000","56","5","e193","e193","10.1107/S0108270100005540","","","0.71073","MoKα","","","0.041","","","","0.148","","","","","","0.93","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010956","11.99","0.004","12.988","0.004","11.296","0.005","106.52","0.03","94.31","0.03","90.79","0.03","1680.6","1.1","298","","","","","","","","","","","6","P -1","-P 1","2","","μ-acetato-O:O'-bis({2,2'[1,2-ethanediylbis(nitrilomethylidyne)]diphenolato}- manganese(III)) perchlorate","","- C34 H31 Cl Mn2 N4 O10 -","- C34 H31 Cl Mn2 N4 O10 -","- C68 H62 Cl2 Mn4 N8 O20 -","2","1","QA0274","Kani, Yoshiyuki; Ohba, Shigeru; Nishida, Yuzo","μ-Acetato-<i>O</i>:<i>O</i>'-bis{[bis(salicylidene)ethylenediaminato]manganese(III)} perchlorate","Acta Crystallographica Section C","2000","56","5","e194","e194","10.1107/S0108270100005552","","","0.71073","MoKα","","","0.039","","","","0.106","","","","","","1.37","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010957","13.799","0.002","14.488","0.002","12.608","0.002","99.33","0.01","111.86","0.01","113.14","0.01","2005.7","0.6","300","","","","","","","","","","","6","P -1","-P 1","2","","","","- C38 H39 Cl4 Cu2 N6 O4.5 -","- C38 H39 Cl4 Cu2 N6 O4.5 -","- C76 H78 Cl8 Cu4 N12 O9 -","2","1","QA0276","Kani, Yoshiyuki; Ohba, Shigeru; Ito, Sayo; Nishida, Yuzo","μ-Chloro-bis{[benzylbis(2-pyridylmethyl)amine-κ^3^<i>N</i>]chlorocopper(II)} perchlorate hemihydrate","Acta Crystallographica Section C","2000","56","5","e195","e195","10.1107/S0108270100005564","","","0.71073","MoKα","","","0.04","","","","0.141","","","","","","1.02","","","","has coordinates","194474","2020-10-21","18:00:00",""
"2010958","11.38","0.001","9.877","0.002","17.4","0.002","90","","104.79","0.01","90","","1891","0.5","298","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C38 H36 Cl2 Cu2 N6 O10 -","- C38 H36 Cl2 Cu2 N6 O10 -","- C76 H72 Cl4 Cu4 N12 O20 -","2","0.5","QA0277","Kani, Yoshiyuki; Ohba, Shigeru; Ito, Sayo; Nishida, Yuzo","Redetermination of bis{[(2-hydroxyphenylmethyl)bis(2-pyridylmethyl)aminato]copper(II)} diperchlorate","Acta Crystallographica Section C","2000","56","5","e201","e201","10.1107/S0108270100005680","","","0.71073","MoKα","","","0.063","","","","0.185","","","","","","0.98","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010959","13.064","0.003","13.347","0.004","14.077","0.003","90","","101.52","0.02","90","","2405.1","1.1","296","","","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C21 H22 Cl Cu F6 N4 O P -","- C21 H22 Cl Cu F6 N4 O P -","- C84 H88 Cl4 Cu4 F24 N16 O4 P4 -","4","1","QA0278","Kani, Yoshiyuki; Ohba, Shigeru; Nishida, Yuzo","[<i>N</i>'-Benzoyl-<i>N</i>,<i>N</i>-bis(2-pyridylmethyl-κ<i>N</i>)ethylenediamine-κ<i>N</i>]chlorocopper(II) hexafluorophosphate","Acta Crystallographica Section C","2000","56","5","e196","e196","10.1107/S0108270100005576","","","0.71073","MoKα","","","0.065","","","","0.196","","","","","","1.38","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010960","11.044","0.002","11.085","0.001","15.858","0.001","90","","95.1","0.009","90","","1933.7","0.4","299","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H22 Cl2 Cu N4 O4 -","- C16 H22 Cl2 Cu N4 O4 -","- C64 H88 Cl8 Cu4 N16 O16 -","4","1","QA0279","Kani, Yoshiyuki; Ohba, Shigeru; Kunita, Mami; Nishida, Yuzo","[1,6-Bis(2-pyridylmethyl)-2,5-diazahexane-κ^4^<i>N</i>]chlorocopper(II) perchlorate","Acta Crystallographica Section C","2000","56","5","e197","e197","10.1107/S0108270100005588","","","0.71073","MoKα","","","0.049","","","","0.122","","","","","","1.51","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010961","12.513","0.002","14.613","0.002","12.569","0.002","90","","109.34","0.01","90","","2168.6","0.6","298","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H26 Cl2 Cu N4 O4 -","- C18 H26 Cl2 Cu N4 O4 -","- C72 H104 Cl8 Cu4 N16 O16 -","4","1","QA0280","Kani, Yoshiyuki; Ohba, Shigeru; Kunita, Mami; Nishida, Yuzo","Chloro[<i>N</i>',<i>N</i>'-diethyl-<i>N</i>,<i>N</i>-bis(2-pyridylmethyl)ethylenediamine-κ^4^<i>N</i>]copper(II) perchlorate","Acta Crystallographica Section C","2000","56","5","e198","e198","10.1107/S010827010000559X","","","0.71073","MoKα","","","0.064","","","","0.161","","","","","","1.51","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010962","18.06","0.003","23.477","0.003","5.736","0.002","90","","90","","90","","2432","1","296","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C26 H34 O6 -","- C26 H34 O6 -","- C104 H136 O24 -","4","1","QA0281","Kani, Yoshiyuki; Ohba, Shigeru; Amano, Seiji; Ogawa, Noriko; Ohtsuka, Masami; Chida, Noritaka","(1<i>R</i>,2<i>R</i>,3<i>S</i>,4<i>S</i>)-2-[(2<i>R</i>,3<i>S</i>)-2,3-Dimethyloxiran-2-yl]-3,4-bis(4-methoxybenzyloxy)cyclohexanol","Acta Crystallographica Section C","2000","56","5","e222","e222","10.1107/S0108270100005606","","","0.71073","MoKα","","","0.073","","","","0.221","","","","","","1.92","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010963","14.381","0.002","14.381","0.002","12.265","0.002","90","","90","","90","","2536.6","0.6","296","","","","","","","","","","","4","P 43","P 4cw","78","","","","- C23 H29 N O11 -","- C23 H29 N O11 -","- C92 H116 N4 O44 -","4","1","QA0282","Kani, Yoshiyuki; Ohba, Shigeru; Oishi, Takeshi; Ando, Koji; Inomiya, Kenjin; Chida, Noritaka","(2<i>S</i>,3<i>R</i>,4<i>S</i>,5<i>R</i>,6<i>S</i>)-6-Benzyloxymethyl-4-(methoxymethyloxy)-9-oxo-8-oxa-1-azabicyclo[4.3.0]nonane-2,3,5-triyl triacetate","Acta Crystallographica Section C","2000","56","5","e223","e223","10.1107/S0108270100005618","","","0.71073","MoKα","","","0.047","","","","0.116","","","","","","1.19","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2010964","8.0114","0.0004","9.8149","0.0007","10.2505","0.0008","107.919","0.002","106.039","0.004","91.831","0.004","731","0.09","291","1","291","1","","","","","","","","3","P -1","-P 1","2","","","","- C16 H26 O2 -","- C16 H26 O2 -","- C32 H52 O4 -","2","1","QB0191","Hollmann, Christoph; Schürmann, Markus; Preut, Hans; Eilbracht, Peter","(1<i>R</i>*,11<i>R</i>*)-Bicyclo[9.4.1]hexadecane-12,16-dione","Acta Crystallographica Section C","2000","56","5","e215","e215","10.1107/S010827010000528X","","","0.71073","MoKα","","0.089","0.04","","","","0.098","","","","","","0.922","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010965","10.675","0.002","11.083","0.002","15.195","0.003","90","","108.19","0.03","90","","1707.9","0.6","293","2","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis(acetonylpyridine) pyridinium hexaiodo-bismuth(III)","","- C21 H26 Bi I6 N3 O2 -","- C22.18 H26 Bi I6 N2 O2 -","- C44.36 H52 Bi2 I12 N4 O4 -","2","0.5","QB0197","Peng, Ying; Lu, Shaofang; Wu, Daxu; Wu, Qiangjin; Huang, Jianquan","Bis(1-acetonylpyridinium) pyridinium hexaiodobismuth(III)","Acta Crystallographica Section C","2000","56","5","e183","e184","10.1107/S0108270100005230","","","0.71069","MoKα","","","0.036","","","","0.091","","","","","","1.039","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010966","7.201","0.002","10.348","0.002","7.19","0.002","95.59","0.02","92.95","0.02","98.47","0.02","526.2","0.2","303","","303","","","","","","","","","5","P -1","-P 1","2","","","","- C8 H9 Cl2 N O4 -","- C8 H9 Cl2 N O4 -","- C16 H18 Cl4 N2 O8 -","2","1","QB0198","Ishida, Hiroyuki; Kashino, Setsuo","Ethylammonium and diethylammonium salts of chloranilic acid","Acta Crystallographica Section C","2000","56","5","e202","e204","10.1107/S0108270100004480","","","0.71073","MoKα","","0.058","0.042","","0.058","","0.05","","","1.29","","","1.29","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010967","9.159","0.003","9.617","0.002","8.979","0.003","108.17","0.02","111.27","0.03","103.78","0.02","642.8","0.4","302","","302","","","","","","","","","5","P -1","-P 1","2","","","","- C10 H13 Cl2 N O4 -","- C10 H13 Cl2 N O4 -","- C20 H26 Cl4 N2 O8 -","2","1","QB0198","Ishida, Hiroyuki; Kashino, Setsuo","Ethylammonium and diethylammonium salts of chloranilic acid","Acta Crystallographica Section C","2000","56","5","e202","e204","10.1107/S0108270100004480","","","0.71073","MoKα","","0.062","0.053","","0.099","","0.091","","","1.64","","","1.64","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010968","7.827","0.0004","12.7936","0.0008","17.3523","0.0012","90","","90","","90","","1737.58","0.18","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2(S)-amino-3-(1H-imidazol-4(5)-yl)propyl cyclohexylmethyl ether dihydrochloride","","- C13 H25 Cl2 N3 O -","- C13 H25 Cl2 N3 O -","- C52 H100 Cl8 N12 O4 -","4","1","QB0202","Kovalainen, Jari T.; Wegelius, Elina; Christiaans, Johannes A. M.; Huuskonen, Juhani; Gynther, Jukka","2(<i>S</i>)-Amino-3-[1<i>H</i>-imidazol-4(5)-yl]propyl cyclohexylmethyl ether dihydrochloride and 2(<i>S</i>)-amino-3-[1<i>H</i>-imidazol-4(5)-yl]propyl 4-bromobenzyl ether dihydrochloride","Acta Crystallographica Section C","2000","56","5","e216","e217","10.1107/S0108270100005291","","","0.71073","MoKα","","0.094","0.046","","","","0.084","","","","","","1.009","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010969","7.553","0.0002","12.9964","0.0006","17.78","0.0009","90","","90","","90","","1745.32","0.13","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","2(S)-amino-3-(1H-imidazol-4(5)-yl)propyl 4-bromobenzyl ether dihydrochloride","","- C13 H18 Br Cl2 N3 O -","- C13 H18 Br Cl2 N3 O -","- C52 H72 Br4 Cl8 N12 O4 -","4","1","QB0202","Kovalainen, Jari T.; Wegelius, Elina; Christiaans, Johannes A. M.; Huuskonen, Juhani; Gynther, Jukka","2(<i>S</i>)-Amino-3-[1<i>H</i>-imidazol-4(5)-yl]propyl cyclohexylmethyl ether dihydrochloride and 2(<i>S</i>)-amino-3-[1<i>H</i>-imidazol-4(5)-yl]propyl 4-bromobenzyl ether dihydrochloride","Acta Crystallographica Section C","2000","56","5","e216","e217","10.1107/S0108270100005291","","","0.71073","MoKα","","0.088","0.047","","","","0.09","","","","","","1.037","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010970","7.6548","0.0015","10.436","0.002","17.543","0.004","90","","91.34","0.03","90","","1401","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","N2-(4-Methoxyphenyl)-3-(2-pyrrolidinyliden)-1-chloro-1,1- -difluoro-2-propan imine","","- C14 H15 Cl F2 N2 O -","- C14 H15 Cl F2 N2 O -","- C56 H60 Cl4 F8 N8 O4 -","4","1","QB0204","Fustero, Santos; García de la Torre, Marta; Ramírez de Arellano, M. Carmen","1-Chloro-1,1-difluoro-<i>N</i>-(4-methoxyphenyl)-3-(pyrrolidin-2-ylidene)propan-2-imine","Acta Crystallographica Section C","2000","56","5","e213","e214","10.1107/S0108270100005217","","","0.71073","MoKα","","0.094","0.07","","","","0.208","","","","","","1.038","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010971","10.3829","0.0007","14.0871","0.0012","14.9994","0.0014","90","","102.931","0.009","90","","2138.3","0.3","295","","295","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- Cr H48 I Mo6 Na2 O48 -","- Cr I Mo6 Na2 O48 -","- Cr2 I2 Mo12 Na4 O96 -","2","0.5","QB0206","Rosu, Cristina; Weakley, Timothy J. R.","Disodium chromium(III) hexamolybdoiodate(VII) 24-hydrate, Na~2~Cr[IMo~6~O~24~]·24H~2~O","Acta Crystallographica Section C","2000","56","5","e170","e171","10.1107/S0108270100005229","","","0.71073","MoKα","","0.046","0.034","","0.095","","0.05","","","1.86","","","1.86","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2010972","9.825","0.002","10.904","0.002","16.051","0.003","90","","101.44","0.03","90","","1685.4","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H40 Cu2 N4 Se8 -","- C20 H40 Cu2 N4 Se8 -","- C40 H80 Cu4 N8 Se16 -","2","0.5","QB0207","Bao, Mutai; Weng, Jiabao; Su, Weiping; Cao, Rong; Hong, Maochun","Bis[bis(<i>N</i>,<i>N</i>-diethyl-1,1-diselenocarbamato)copper(II)], [Cu(Se~2~CNEt~2~)~2~]~2~","Acta Crystallographica Section C","2000","56","5","e185","e186","10.1107/S0108270100005503","","","0.71073","MoKα","","0.041","0.032","","","","0.086","","","","","","1.082","","","","has coordinates,has Fobs","211196","2020-10-21","18:00:00",""
"2010973","6.719","0.001","10.029","0.002","25.615","0.005","90","","90.65","0.03","90","","1726","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Bis(N,N-diethyl-1,1-diselenocarbamate)selenium","","- C10 H20 N2 Se5 -","- C10 H20 N2 Se5 -","- C40 H80 N8 Se20 -","4","1","QB0208","Bao, Mutai; Hong, Maochun; Su, Weiping; Cao, Rong","Bis(<i>N</i>,<i>N</i>-diethyl-1,1-diselenocarbamato-<i>Se</i>)selenium, [(Se~2~CNEt~2~)~2~Se]","Acta Crystallographica Section C","2000","56","5","e219","e220","10.1107/S0108270100005497","","","0.71073","MoKα","","0.067","0.048","","","","0.113","","","","","","0.996","","","","has coordinates,has Fobs","211196","2020-10-21","18:00:00",""
"2010974","21.093","0.002","4.6905","0.0003","9.2544","0.0009","90","","101.323","0.003","90","","897.78","0.14","150","2","293","2","","","","","","","","4","P 1 c 1","P -2yc","7","Zinc octanoate","poly[zinc(II)-bis(μ-octanoato-O:O')]","","- C16 H30 O4 Zn -","- C16 H30 O4 Zn -","- C32 H60 O8 Zn2 -","2","1","SK1351","Lacouture, Françoise; Peultier, Jerôme; Francois, Michel; Steinmetz, Jean","Anhydrous polymeric zinc(II) octanoate","Acta Crystallographica Section C","2000","56","5","556","557","10.1107/S0108270100001876","","","0.71073","MoKα","","0.088","0.058","","","","0.167","","","","","","1.002","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2010975","11.831","0.002","14.927","0.003","12.929","0.003","90","","98.63","0.03","90","","2257.4","0.8","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H16 Cl2 I2 N4 Si -","- C20 H16 Cl2 I2 N4 Si -","- C80 H64 Cl8 I8 N16 Si4 -","4","1","SK1363","Hensen, Karl; Mayr-Stein, Ralf; Rühl, Stephan; Bolte, Michael","<i>cis</i>-Bis(2,2'-bipyridyl-<i>N</i>,<i>N</i>')dichlorosilicon diiodide","Acta Crystallographica Section C","2000","56","5","607","609","10.1107/S0108270100001888","","","0.71073","MoKα","","0.0441","0.0289","","","","0.0597","","","","","","1.071","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010976","15.125","0.0004","5.6702","0.0001","22.8781","0.0005","90","","95.3753","0.0013","90","","1953.44","0.08","291","2","291","2","","","","","","","","3","C 1 2 1","C 2y","5","asperuloside monohydrate","[2aS-(2aα,4aα,5α,7bα)]-5-(β-D-glucopyranosyloxy)-1-oxo-2a,4a,5,7b- tetrahydro-1H-2,6-dioxacyclopenta[cd]inden-4-ylmethyl acetate monohydrate","","- C18 H24 O12 -","- C18 H24 O12 -","- C72 H96 O48 -","4","1","SK1376","Linden, Anthony; Çalis, Ihsan; Neuburger, Markus; Sticher, Otto","Asperuloside monohydrate","Acta Crystallographica Section C","2000","56","5","616","618","10.1107/S0108270100003292","","","0.71073","MoKα","","0.061","0.041","","","","0.101","","","","","","1.028","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010977","13.378","0.002","13.378","0.002","18.803","0.006","90","","90","","90","","3365.2","1.3","293","2","293","2","","","","","","","","3","P 43 21 2","P 4nw 2abw","96","","","","- C20 H24 O2 -","- C20 H24 O2 -","- C160 H192 O16 -","8","1","SX1081","Do Valle, N. T.; De Simone, C. A.; Pereira, M. A.; Goulart, M. O. F.","[1a(1aα,5β,9aα)]-1,1a,4,5,7,8,9,9a-Octahydro-3-hydroxy-1,1,2,5-tetramethyl-7-methylene-6<i>H</i>-cyclopropa[3,4]cyclohept[1,2-<i>e</i>]inden-6-one","Acta Crystallographica Section C","2000","56","5","566","567","10.1107/S0108270199016108","","","0.71073","MoKα","","0.0711","0.0573","","","","0.1249","","","","","","1.157","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010978","9.502","0.001","10.286","0.001","11.289","0.001","87.76","0.01","77.48","0.01","69.85","0.01","1010.43","0.19","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C10 H24 Mn2 O19 -","- C10 H24 Mn2 O19 -","- C20 H48 Mn4 O38 -","2","1","TA1268","Deping Cheng; Yueqing Zheng; Jianli Lin; Duanjun Xu; Yuanzhi Xu","A binuclear manganese(II) complex, decaaqua(μ-1,2,4,5-benzenetetracarboxylato-<i>O</i>^1^:<i>O</i>^4^)dimanganese(II) hydrate","Acta Crystallographica Section C","2000","56","5","523","524","10.1107/S0108270100000342","","","0.71073","MoKα","","0.0344","0.0298","","0.0864","0.0829","","","","1.029","1.06","1.06","","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2010979","15.169","0.01","25.197","0.008","11.638","0.006","90","","90","","90","","4448","4","296.2","","","","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","trans-(4-Amino-2,2,6,6-tetramethylpiperidine-N^4^)bis(pentane-2,4-dionato-O,O') (triphenylphosphine-P)cobalt(III) hexafluorophosphate dichloromethane solvate","","- C38 H51 Cl2 Co F6 N2 O4 P2 -","- C38 H51 Cl2 Co F6 N2 O4 P2 -","- C152 H204 Cl8 Co4 F24 N8 O16 P8 -","4","1","TA1277","Suzuki, Takayoshi; Ogita, Masahiro; Kaizaki, Sumio","<i>trans</i>-(4-Amino-2,2,6,6-tetramethylpiperidine-<i>N</i>^4^)bis(pentane-2,4-dionato-<i>O</i>,<i>O</i>')(triphenylphosphine-<i>P</i>)cobalt(III) hexafluorophosphate dichloromethane solvate","Acta Crystallographica Section C","2000","56","5","532","533","10.1107/S010827010000113X","","","0.7107","MoKα","","","0.051","","","","0.193","","","","","","0.969","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2010980","12.2683","0.001","15.0622","0.0017","18.2824","0.0017","81.818","0.009","71.05","0.007","85.001","0.009","3159.7","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","dipotassium di-μ-oxo-bis[aqua(oxalato-O^1^,O^2^)oxomolybdenum(III)] trihydrate","","- C4 H10 K2 Mo2 O17 -","- C4 H10 K2 Mo2 O17 -","- C32 H80 K16 Mo16 O136 -","8","4","AV1030","Strukan, Neven; Cindrić, Marina; Kamenar, Boris","K~2~[Mo~2~O~4~(C~2~O~4~)~2~(H~2~O)~2~]·3H~2~O","Acta Crystallographica Section C","2000","56","6","639","641","10.1107/S0108270100002547","","","0.71069","MoKα","","0.165","0.049","","0.142","","0.106","","","0.934","","","0.934","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010981","13.58","0.005","9.488","0.002","20.266","0.007","90","","99.73","0.03","90","","2573.7","1.4","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","N-nitrosomelatonin","","- C13 H15 N3 O3 -","- C13 H15 N3 O3 -","- C104 H120 N24 O24 -","8","1","BK1515","Turjanski, Adrián; Chaia, Zulema Débora; Doctorovich, Fabio; Estrin, Dario; Rosenstein, Ruth; Piro, Oscar E.","<i>N</i>-Nitrosomelatonin","Acta Crystallographica Section C","2000","56","6","682","683","10.1107/S010827010000456X","","","0.71073","MoKα","","0.082","0.042","","0.151","","0.109","","","1.08","","","1.01","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010982","6.6363","0.0013","8.1836","0.0016","10.468","0.002","70.68","0.03","88.01","0.03","80.77","0.03","529.4","0.2","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","2-(1,3-dithian-2-yl)benzaldehyde","","- C11 H12 O S2 -","- C11 H12 O S2 -","- C22 H24 O2 S4 -","2","1","BK1516","Jene, Paul G.; Ibers, James A.","2-(1,3-Dithian-2-yl)benzaldehyde and <i>N</i>-{2-[2-(1,3-dioxan-2-yl)phenoxy]ethyl}phthalimide","Acta Crystallographica Section C","2000","56","6","705","707","10.1107/S010827010000353X","","","0.71073","MoKα","","0.041","0.039","","","","0.112","","","","","","2.07","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010983","6.02","0.0004","15.0289","0.0011","18.966","0.0013","90","","94.841","0.001","90","","1709.8","0.2","153","2","153","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N-{2-[2-(1,3-dioxan-2-yl)phenoxy]ethyl}phthalimide","","- C20 H19 N O5 -","- C20 H19 N O5 -","- C80 H76 N4 O20 -","4","1","BK1516","Jene, Paul G.; Ibers, James A.","2-(1,3-Dithian-2-yl)benzaldehyde and <i>N</i>-{2-[2-(1,3-dioxan-2-yl)phenoxy]ethyl}phthalimide","Acta Crystallographica Section C","2000","56","6","705","707","10.1107/S010827010000353X","","","0.71073","MoKα","","0.096","0.05","","","","0.096","","","","","","1.04","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010984","10.97","0.002","8.986","0.002","20.881","0.004","90","","103.66","0.03","90","","2000.2","0.7","150","2","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C11 H8 N4 S -","- C11 H8 N4 S -","- C88 H64 N32 S8 -","8","1","BM1405","Coles, Simon J.; Douheret, David; Hursthouse, Michael B.; Kilburn, Jeremy D.","2-(2-Pyridylimino)-2<i>H</i>-1,2,4-thiadiazolo[2,3-<i>a</i>]pyridine","Acta Crystallographica Section C","2000","56","6","687","688","10.1107/S0108270100003152","","","0.71073","MoKα","","","0.0274","","","","0.0645","","","","","","1.162","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010985","6.297","0.004","4.951","0.003","12.751","0.006","90","","91.65","0.06","90","","397.4","0.4","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","Lithium Rubidium Gallium Borate","","","- B3 Ga2 Li2 O9 Rb -","- B3 Ga2 Li2 O9 Rb -","- B6 Ga4 Li4 O18 Rb2 -","2","0.5","BR1279","Judith L. Kissick; Douglas A. Keszler","RbLi~2~Ga~2~(BO~3~)~3~","Acta Crystallographica Section C","2000","56","6","631","632","10.1107/S0108270100004078","","","0.71069","MoKα","","0.0414","0.026","","","","0.0724","","","","","","1.05","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010986","16.05","0.003","3.9375","0.0008","7.0309","0.0014","90","","90","","90","","444.33","0.15","153","2","153","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Gd2 O Se2 -","- Gd2 O Se2 -","- Gd8 O4 Se8 -","4","0.5","BR1282","Tougait, Olivier; Ibers, James A.","Gd~2~OSe~2~","Acta Crystallographica Section C","2000","56","6","623","624","10.1107/S0108270100003024","","","0.71073","MoKα","","0.0256","0.0235","","","","0.0588","","","","","","1.101","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010987","7.0725","0.0005","8.4187","0.0007","14.2273","0.0011","90","","90","","90","","847.11","0.11","300","","300","","","","","","","","","3","P b n m","-P 2c 2ab","62","","","","- La2 O9 Se3 -","- La2 O9 Se3 -","- La8 O36 Se12 -","4","0.5","BR1284","Harrison, William T. A.","Lanthanum selenite, La~2~(SeO~3~)~3~","Acta Crystallographica Section C","2000","56","6","627","628","10.1107/S0108270100003164","","","0.71073","MoKα","","","0.026","","","","0.029","","","","","","1.08","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2010988","7.7247","0.0006","10.2237","0.0007","8.3429","0.0006","90","","104.788","0.001","90","","637.06","0.08","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","cesium titanium pyrophosphate","","- Cs O7 P2 Ti -","- Cs O7 P2 Ti -","- Cs4 O28 P8 Ti4 -","4","1","BR1285","Huang, Fu Qiang; Ibers, James A.","CsTiP~2~O~7~","Acta Crystallographica Section C","2000","56","6","625","626","10.1107/S0108270100003036","","","0.71073","MoKα","","0.0235","0.0234","","","","0.0682","","","","","","1.417","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2010989","13.9497","0.0013","14.7055","0.0015","14.049","0.002","90","","109.43","0.008","90","","2717.8","0.6","163","","163","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","(η^6^-hexamethylbenzene)bis(trifluoromethanesulfonato-O) (2,4,6-trimethylaniline-N)ruthenium(II)","","- C23 H31 F6 N O6 Ru S2 -","- C23 H31 F6 N O6 Ru S2 -","- C92 H124 F24 N4 O24 Ru4 S8 -","4","1","DA1103","Feher, Frank J.; Baldwin, Richard K.; Ziller, Joseph W.","(η^6^-Hexamethylbenzene)(mesidine)ditriflatoruthenium(II)","Acta Crystallographica Section C","2000","56","6","633","634","10.1107/S0108270100001001","","","0.71073","MoKα","","0.045","0.03","","","","0.07","","","","","","1.038","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010990","5.1886","0.0006","7.8583","0.001","8.6621","0.001","90","","104.977","0.008","90","","341.19","0.07","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Polymeric bis(glycolato)cobalt(II)","","- C4 H6 Co O6 -","- C4 H6 Co O6 -","- C8 H12 Co2 O12 -","2","0.5","DA1106","Medina, Gerardo; Gasque, Laura; Bernès, Sylvain","Polymeric bis(glycolato)cobalt(II)","Acta Crystallographica Section C","2000","56","6","637","638","10.1107/S010827010000161X","","","0.71073","MoKα","","0.024","0.02","","","","0.053","","","","","","1.096","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010991","8.3856","0.0004","9.727","0.0004","11.186","0.0005","69.274","0.003","68.037","0.003","70.933","0.003","771.31","0.06","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","Ethyl E-2-Cyano-3-(8-dimethylaminonaphth-1-yl)propenoate","","- C18 H18 N2 O2 -","- C18 H18 N2 O2 -","- C36 H36 N4 O4 -","2","1","FG1575","Paul C. Bell; Marie Drameh; Nicola Hanley; John D. Wallis","Interaction between a dimethylamino group and an electron-deficient alkene in ethyl (<i>E</i>)-2-cyano-3-(8-dimethylamino-1-naphthyl)propenoate","Acta Crystallographica Section C","2000","56","6","670","671","10.1107/S0108270100000512","","","0.71069","MoKa","","0.068","0.053","","0.1575","0.1435","","","","1.064","1.115","1.115","","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2010992","13.0339","0.0017","7.375","0.001","7.4672","0.001","90","","91.923","0.002","90","","717.38","0.17","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","dipotassium dichromate","dipotassium dichromate","","- Cr2 K2 O7 -","- Cr2 K2 O7 -","- Cr8 K8 O28 -","4","0.5","FG1580","Krivovichev, Sergey V.; Kir'yanova, Elena V.; Filatov, Stanislav K.; Burns, Peter C.","β-K~2~Cr~2~O~7~","Acta Crystallographica Section C","2000","56","6","629","630","10.1107/S0108270100003917","","","0.71073","MoKα","","0.032","0.029","","","","0.084","","","","","","1.107","","","","has coordinates,has Fobs","282548","2023-04-10","20:38:56",""
"2010993","6.7397","0.0002","7.7777","0.0003","8.5184","0.0003","78.5397","0.0014","85.6376","0.0019","71.8947","0.0018","415.91","0.03","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","pyrrolidin-2,2-diylbis(phosphonic acid)","","- C4 H11 N O6 P2 -","- C4 H11 N O6 P2 -","- C8 H22 N2 O12 P4 -","2","1","FG1586","Olive, Gilles; Ellis, Dianne D.; Siri, Didier; Le Moigne, François; Lutz, Martin; Spek, Anthony L.; Tordo, Paul; Reboul, Jean-Pierre","Zwitterionic pyrrolidine-2,2-diylbis(phosphonic acid) at 100, 150 and 293K","Acta Crystallographica Section C","2000","56","6","720","722","10.1107/S0108270100003929","","","0.71073","MoKα","","0.026","0.024","","","","0.064","","","","","","1.065","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010994","6.7451","0.0002","7.7855","0.0003","8.5197","0.0003","78.5651","0.0014","85.6151","0.0019","71.8678","0.0019","416.69","0.03","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","pyrrolidin-2,2-diylbis(phosphonic acid)","","- C4 H11 N O6 P2 -","- C4 H11 N O6 P2 -","- C8 H22 N2 O12 P4 -","2","1","FG1586","Olive, Gilles; Ellis, Dianne D.; Siri, Didier; Le Moigne, François; Lutz, Martin; Spek, Anthony L.; Tordo, Paul; Reboul, Jean-Pierre","Zwitterionic pyrrolidine-2,2-diylbis(phosphonic acid) at 100, 150 and 293K","Acta Crystallographica Section C","2000","56","6","720","722","10.1107/S0108270100003929","","","0.71073","MoKα","","0.026","0.024","","","","0.064","","","","","","1.071","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010995","6.7703","0.0002","7.8135","0.0002","8.5263","0.0002","78.7105","0.0012","85.553","0.0016","71.7958","0.0014","420.11","0.02","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","pyrrolidin-2,2-diylbis(phosphonic acid)","","- C4 H11 N O6 P2 -","- C4 H11 N O6 P2 -","- C8 H22 N2 O12 P4 -","2","1","FG1586","Olive, Gilles; Ellis, Dianne D.; Siri, Didier; Le Moigne, François; Lutz, Martin; Spek, Anthony L.; Tordo, Paul; Reboul, Jean-Pierre","Zwitterionic pyrrolidine-2,2-diylbis(phosphonic acid) at 100, 150 and 293K","Acta Crystallographica Section C","2000","56","6","720","722","10.1107/S0108270100003929","","","0.71073","MoKα","","0.026","0.024","","","","0.065","","","","","","1.079","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2010996","8.7242","0.0003","8.7242","0.0003","37.102","0.003","90","","90","","120","","2445.6","0.2","295","2","295","2","","","","","","","","6","P 65","P 65","170","","diaqua(1,7-dioxa-4-thia-10-azacyclododecane)nickel(II) nitrate","","- C8 H21 N3 Ni O10 S -","- C8 H21 N3 Ni O10 S -","- C48 H126 N18 Ni6 O60 S6 -","6","1","FG1589","Marcus, Sebastian T.; Gahan, Lawrence R.; Bernhardt, Paul V.","The Ni^II^, Hg^II^ and Cu^II^ complexes of 12-membered-ring mixed-donor macrocycles","Acta Crystallographica Section C","2000","56","6","655","658","10.1107/S0108270100003942","","","0.71073","MoKα","","0.0504","0.0321","","","","0.0777","","","","","","1.055","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010997","8.245","0.003","11.927","0.002","14.272","0.005","90","","96.6","0.02","90","","1394.2","0.7","275","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","bis(nitrato)(1,4,7-trioxa-10-azacyclododecane)mercury(II)","","- C8 H17 Hg N3 O9 -","- C8 H17 Hg N3 O9 -","- C32 H68 Hg4 N12 O36 -","4","1","FG1589","Marcus, Sebastian T.; Gahan, Lawrence R.; Bernhardt, Paul V.","The Ni^II^, Hg^II^ and Cu^II^ complexes of 12-membered-ring mixed-donor macrocycles","Acta Crystallographica Section C","2000","56","6","655","658","10.1107/S0108270100003942","","","0.71073","MoKα","","0.0416","0.0329","","","","0.0873","","","","","","1.06","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010998","8.6167","0.0009","9.3975","0.0008","10.118","0.001","95.627","0.008","112.107","0.009","99.509","0.009","737.05","0.14","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","aqua(1,7-dioxa-4-thia-10-azacyclododecane)nitratocopper(II) nitrate","","- C8 H21 Cu N5 O8 -","- C8 H21 Cu N5 O8 -","- C16 H42 Cu2 N10 O16 -","2","1","FG1589","Marcus, Sebastian T.; Gahan, Lawrence R.; Bernhardt, Paul V.","The Ni^II^, Hg^II^ and Cu^II^ complexes of 12-membered-ring mixed-donor macrocycles","Acta Crystallographica Section C","2000","56","6","655","658","10.1107/S0108270100003942","","","0.71073","MoKα","","0.0275","0.0243","","","","0.0677","","","","","","1.082","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010999","12.1506","0.0007","15.404","0.0009","15.5477","0.0009","90","","109.199","0.001","90","","2748.2","0.3","183","2","183","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H16 B F15 Zr -","- C30 H16 B F15 Zr -","- C120 H64 B4 F60 Zr4 -","4","1","FR1249","Guzei, Ilia A.; Stockland Jr, Robert A.; Jordan, Richard F.","The bis(η^5^-cyclopentadienyl)methylzirconium(IV) methyltris(pentafluorophenyl)borate ion pair","Acta Crystallographica Section C","2000","56","6","635","636","10.1107/S0108270100001293","","","0.71073","MoKα","","0.0396","0.027","","","","0.068","","","","","","1.002","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011000","16.942","0.001","5.932","0.002","17.265","0.001","90","","108.122","0.005","90","","1649.1","0.6","296","","296","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C21 H18 O2 -","- C21 H18 O2 -","- C84 H72 O8 -","4","1","FR1261","Gerkin, Roger E.","(<i>E</i>)-2-Methyl-5-(1-naphthylmethyl)cinnamic acid","Acta Crystallographica Section C","2000","56","6","674","676","10.1107/S0108270100002778","","","0.71073","MoKα","","","0.057","","","","0.073","","","","","","1.36","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011001","11.4104","0.0002","7.4078","0.0001","16.9198","0.0003","90","","107.473","0.001","90","","1364.17","0.04","150","","150","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","2,2'-dimethoxybiphenyl-5,5'-dimethanol","2,2'-dimethoxybiphenyl-5,5'-dimethanol","","- C16 H18 O4 -","- C16 H18 O4 -","- C64 H72 O16 -","4","1","FR1262","Gerkin, Roger E.","Hydrogen bonds and C—H···O interactions in 2,2'-dimethoxybiphenyl-5,5'-dimethanol at 150K","Acta Crystallographica Section C","2000","56","6","677","678","10.1107/S0108270100002900","","","0.71073","MoKα","","","0.046","","","","0.099","","","","","","1.99","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011002","7.187","0.001","11.261","0.002","12.812","0.003","90","","90","","90","","1036.9","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C12 H10 N2 O2 -","- C12 H10 N2 O2 -","- C48 H40 N8 O8 -","4","1","GD1082","Ejsmont, Krzysztof; Domański, Andrzej; Kyzioł, Janusz; Zaleski, Jacek","4-Hydroxy-<i>ONN</i>-azoxybenzene","Acta Crystallographica Section C","2000","56","6","697","699","10.1107/S0108270100003449","","","0.71073","MoKα","","0.1092","0.0337","","","","0.096","","","","","","0.993","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011003","10.276","0.002","4.677","0.001","11.296","0.002","90","","92.22","0.02","90","","542.49","0.18","190","2","190","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Bis-(2,4-pentanedionato)cobalt(II)","","- C10 H14 Co O4 -","- C10 H14 Co O4 -","- C20 H28 Co2 O8 -","2","0.5","GD1084","John Burgess; John Fawcett; David R. Russell; Syeda R. Gilani","Monomeric bis(2,4-pentanedionato)cobalt(II)","Acta Crystallographica Section C","2000","56","6","649","650","10.1107/S0108270100003176","","","0.71073","MoKα","","0.0626","0.0515","","","","0.1397","","","","","","1.104","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011004","16.2046","0.0016","7.2974","0.0005","13.509","0.0014","90","","90","","90","","1597.5","0.3","293","2","293","2","","","","","","","","7","P c a 21","P 2c -2ac","29","","","","- C7 H8 Hg Mn N4 O2 S4 -","- C7 H8 Hg Mn N4 O2 S4 -","- C28 H32 Hg4 Mn4 N16 O8 S16 -","4","1","GD1089","Wang, Xin-Qiang; Yu, Wen-Tao; Xu, Dong; Lu, Meng-Kai; Yuan, Duo-Rong; Lu, Guang-Tian","Manganese mercury thiocyanate (MMTC) glycol monomethyl ether","Acta Crystallographica Section C","2000","56","6","647","648","10.1107/S0108270100003188","","","0.71073","MoKα","","0.0518","0.0395","","","","0.1005","","","","","","1.041","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011005","10.789","0.003","8.918","0.002","25.847","0.004","90","","91.79","0.02","90","","2485.7","1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(12-hydroxymethyl-5,5,7,12,14-pentamethyl-1,4,8,11- tetraazacyclotetradecane-N-acetato-N,N',N'',N''',O,O')cobalt(III) Chloride Perchlorate Monohydrate","","- C18 H39 Cl2 Co N4 O8 -","- C18 H39 Cl2 Co N4 O8 -","- C72 H156 Cl8 Co4 N16 O32 -","4","1","GD1092","Panneerselvam, Kaliyamoorthy; Lu, Tian-Huey; Chi, Ta-Yung; Tung, Shu-Fang; Chung, Chung-Sun","(12-Hydroxymethyl-5,5,7,12,14-pentamethyl-1,4,8,11-tetraazacyclotetradecane-<i>N</i>-acetato-<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''',<i>O</i>,<i>O</i>')cobalt(III) chloride perchlorate monohydrate","Acta Crystallographica Section C","2000","56","6","659","660","10.1107/S010827010000398X","","","0.71073","MoKα","","0.0881","0.0462","","","","0.1087","","","","","","1.013","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011006","11.788","0.002","6.6204","0.0016","25.057","0.003","90","","90","","90","","1955.5","0.6","293.2","","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C21 H21 N3 O4 S -","- C21 H21 N3 O4 S -","- C84 H84 N12 O16 S4 -","4","1","GD1093","Zhao, Yuekun; Helliwell, Madeleine; Joule, John A.","The conversion of a pyrrole trimer derivative into a 4,5,6,7-tetrahydro-4-(pyrrol-2-yl)indol-7-yltosylaminoindole","Acta Crystallographica Section C","2000","56","6","714","715","10.1107/S0108270100003541","","","1.5418","CuKα","","0.0452","0.038","","","","0.1071","","","","","","1.066","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011007","8.592","0.01","8.845","0.01","11.192","0.01","109.64","0.05","90.56","0.05","103.92","0.05","773.7","1.5","100","5","100","5","","","","","","","","5","P 1","P 1","1","NAD+","β-Nicotinamide Adenine Dinucleotide","","- C21 H35 N7 O18 P2 -","- C21 H35 N7 O18 P2 -","- C21 H35 N7 O18 P2 -","1","1","GS1072","Guillot, Benoit; Jelsch, Christian; Lecomte, Claude","The oxidized form of nicotinamide adenine dinucleotide","Acta Crystallographica Section C","2000","56","6","726","728","10.1107/S0108270100001220","","","0.709","MoKα","","0.019","0.019","","","","0.052","","","","","","1.013","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011008","12.216","0.004","12.463","0.005","16.781","0.007","90","","90","","90","","2554.9","1.7","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Haperforine B1","methyl 4-(3,6-dihydro-2,2-dimethyl-6-oxo-2H-pyran-3-ylideneacetyl)-8- furanoyl-5-(1-hydroxyethyl)-4,8-dimethyl-1-oxaspiro[2.5]octane-2-carboxylate","","- C27 H32 O9 -","- C27 H32 O9 -","- C108 H128 O36 -","4","1","GS1076","Chiaroni, Angèle; Riche, Claude; Khuong-Huu, Qui; Nguyen-Ngoc, Hanh; Nguyen-Viet, Kinh; Khuong-Huu, Françoise","New limonoids from <i>Harrisonia perforata</i> (Blanco) Merr.","Acta Crystallographica Section C","2000","56","6","711","713","10.1107/S0108270100003565","","","1.5418","CuKα","","0.0516","0.0485","","0.1309","","0.1278","","","1.075","","","1.087","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011009","10.148","0.005","11.225","0.007","11.356","0.008","90","","99.44","0.02","90","","1276.1","1.4","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","Haperforin D","methyl 6'-furanoyl-3-hydroxy-4,4,3',6',7a'-pentamethylperhydro-4H-furo[2,1-c]- pyran-2-spiro-1'-perhydroisobenzofuran-7'-spiro-2''-oxirane-3''-carboxylate","","- C27 H34 O10 -","- C27 H34 O10 -","- C54 H68 O20 -","2","1","GS1076","Chiaroni, Angèle; Riche, Claude; Khuong-Huu, Qui; Nguyen-Ngoc, Hanh; Nguyen-Viet, Kinh; Khuong-Huu, Françoise","New limonoids from <i>Harrisonia perforata</i> (Blanco) Merr.","Acta Crystallographica Section C","2000","56","6","711","713","10.1107/S0108270100003565","","","1.5418","CuKα","","0.0703","0.0656","","0.1692","","0.1554","","","1.087","","","1.089","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011010","10.947","0.005","12.185","0.005","8.883","0.005","103.808","0.005","113.331","0.005","76.135","0.005","1042.5","0.9","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H24 N2 O4 S2 -","- C20 H24 N2 O4 S2 -","- C40 H48 N4 O8 S4 -","2","1","JA1020","Kubo, Kanji; Kato, Nobuo; Mori, Akira; Takeshita, Hitoshi","20-Dicyanomethylene-5,8,11,14-tetraoxa-2,17-dithiabicyclo[16.4.1]tricosa-1(23),18,21-triene and its mercury(II) dichloride complex","Acta Crystallographica Section C","2000","56","6","644","646","10.1107/S010827010000305X","","","1.54184","CuKα","","0.0394","0.0358","","","","0.1037","","","","","","1.101","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011011","15.387","0.005","22.349","0.005","14.579","0.005","90","","95.337","0.005","90","","4992","3","296","2","296","2","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C20 H24 Cl2 Hg N2 O4 S2 -","- C20 H24 Cl2 Hg N2 O4 S2 -","- C160 H192 Cl16 Hg8 N16 O32 S16 -","8","2","JA1020","Kubo, Kanji; Kato, Nobuo; Mori, Akira; Takeshita, Hitoshi","20-Dicyanomethylene-5,8,11,14-tetraoxa-2,17-dithiabicyclo[16.4.1]tricosa-1(23),18,21-triene and its mercury(II) dichloride complex","Acta Crystallographica Section C","2000","56","6","644","646","10.1107/S010827010000305X","","","1.54184","CuKα","","0.1434","0.052","","","","0.137","","","","","","1.009","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011012","16.8803","0.0005","16.1855","0.0004","19.3262","0.0006","90","","90","","90","","5280.2","0.3","298","2","298","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","4,13-(1',10'-Decandioxy)hexahelicen","","- C36 H34 O2 -","- C36 H34 O2 -","- C288 H272 O16 -","8","1","JZ1383","Meier, Herbert; Schwertel, Manfred; Schollmeyer, Dieter","Two strained hexahelicenophanes","Acta Crystallographica Section C","2000","56","6","684","686","10.1107/S0108270100003140","","","1.54178","CuKα","","0.0709","0.0571","","0.1664","","0.1557","","","","","","1.047","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011013","18.1447","0.0004","12.3799","0.0003","10.8228","0.0003","90","","90","","90","","2431.12","0.1","298","2","298","2","","","","","","","","3","P n a 21","P 2c -2n","33","","4,13-(1,8 octandioxy)-hexahelicen","","- C34 H30 O2 -","- C34 H30 O2 -","- C136 H120 O8 -","4","1","JZ1383","Meier, Herbert; Schwertel, Manfred; Schollmeyer, Dieter","Two strained hexahelicenophanes","Acta Crystallographica Section C","2000","56","6","684","686","10.1107/S0108270100003140","","","1.54178","CuKα","","0.0398","0.0391","","0.1122","","0.1112","","","","","","1.068","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011014","11.641","0.002","11.955","0.002","3.678","0.001","90","","90","","90","","511.86","0.19","150","","150","","","","","","","","","5","P b a n :2","-P 2ab 2b","50","","4,4'-bipyridinedichloromanganese(II)","","- C10 H8 Cl2 Mn N2 -","- C10 H8 Cl2 Mn N2 -","- C20 H16 Cl4 Mn2 N4 -","2","0.25","JZ1389","Chippindale, Ann M.; Cowley, Andrew R.; Peacock, Katherine J.","(4,4'-Bipyridine)dichloromanganese(II), a two-dimensional coordination polymer","Acta Crystallographica Section C","2000","56","6","651","652","10.1107/S0108270100003474","","","0.71069","MoKα","","","0.033","","","0.038","","","","","1.0537","1.0537","","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2011015","9.324","0.002","25.149","0.003","11.753","0.002","90","","108","0.05","90","","2621.1","1.1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","oxazol-5(4H)-one from Z-(Aib)~4~-OH","benzyl N-[8-(4,4-dimethyl-5-oxooxazol-2-yl)-2,5,5,8-tetramethyl-3,6-dioxo-4,7- diazanon-2-yl]carbamate","","- C24 H34 N4 O6 -","- C24 H34 N4 O6 -","- C96 H136 N16 O24 -","4","1","LN1097","Crisma, Marco; Formaggio, Fernando; Toniolo, Claudio","An oxazol-5(4<i>H</i>)-one from benzyloxycarbonyl-(Aib)~4~-OH","Acta Crystallographica Section C","2000","56","6","695","696","10.1107/S0108270100003413","","","0.71073","MoKα","","0.071","0.043","","","","0.132","","","","","","1.003","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011016","10.1318","0.0002","13.2019","0.0002","14.9565","0.0005","77.207","0.001","80.992","0.002","76.834","0.002","1887.72","0.08","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","(Piperidine-1-carbodithioato-S,S')bis(triphenylphosphine-P)gold(I)","","- C42 H40 Au N P2 S2 -","- C42 H40 Au N P2 S2 -","- C84 H80 Au2 N2 P4 S4 -","2","1","LN1100","Razak, Ibrahim Abdul; Shanmuga Sundara Raj, S.; Fun, Hoong-Kun; Jian, Fangfang; Bei, Fengli; Yang, Xujie; Lu, Lude; Wang, Xin","(Piperidine-1-carbodithioato-<i>S</i>,<i>S</i>')bis(triphenylphosphine-<i>P</i>)gold(I)","Acta Crystallographica Section C","2000","56","6","666","667","10.1107/S0108270100003760","","","0.71073","MoKα","","0.09","0.054","","","","0.124","","","","","","0.89","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011017","12.5502","0.0007","9.5832","0.0005","15.395","0.0008","90","","95.734","0.001","90","","1842.31","0.17","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","[Co(en)~3~](C~2~O~4~)(ClO~4~)(H~2~O)~2~","Tris(ethylenediamine) cobalt (III) oxalato perchlorate dihydrate","","- C8 H28 Cl Co N6 O10 -","- C8 H28 Cl Co N6 O10 -","- C32 H112 Cl4 Co4 N24 O40 -","4","1","LN1103","Cai, Jiwen; Zhang, Yufei; Hu, Xiaopeng; Feng, Xiaolong","Tris(ethylenediamine-<i>N</i>,<i>N</i>')cobalt(III) oxalate perchlorate dihydrate","Acta Crystallographica Section C","2000","56","6","661","663","10.1107/S0108270100004200","","","0.71073","MoKα","","0.0396","0.0306","","","","0.09","","","","","","1.024","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011018","12.52","0.02","6.944","0.001","12.919","0.001","90","","90","","90","","1123.2","1.8","123.2","","","","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C9 H22 B P -","- C9 H22 B P -","- C36 H88 B4 P4 -","4","1","OA1100","Atsushi Ohashi; Tsuneo Imamoto","1-<i>tert</i>-Butyl-2-methylphospholane‒borane and its coupling product 2,2'-bis(1-<i>tert</i>-butylphospholane‒borane)","Acta Crystallographica Section C","2000","56","6","723","725","10.1107/S0108270100004066","","","1.5418","CuKα","","","0.0391","","","","0.0495","","","","","","1.913","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2011019","10.346","0.001","9.796","0.002","20.597","0.001","90","","100.805","0.008","90","","2050.5","0.5","296.2","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C16 H38 B2 P2 -","- C16 H38 B2 P2 -","- C64 H152 B8 P8 -","4","0.5","OA1100","Atsushi Ohashi; Tsuneo Imamoto","1-<i>tert</i>-Butyl-2-methylphospholane‒borane and its coupling product 2,2'-bis(1-<i>tert</i>-butylphospholane‒borane)","Acta Crystallographica Section C","2000","56","6","723","725","10.1107/S0108270100004066","","","1.5418","CuKα","","","0.0479","","","","0.0583","","","","","","1.787","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2011020","7.092","0.008","30.78","0.03","7.126","0.007","90","","116.96","0.12","90","","1386","3","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","cis-(Malonato)[(4R,5R)-4,5-bis(aminomethyl)-2,2-dimethyl- 1,3-dioxolane]platinum(II)","","- C10 H18 N2 O6 Pt -","- C10 H18 N2 O6 Pt -","- C40 H72 N8 O24 Pt4 -","4","2","OB1028","Cho, Sang Woo; Cho, Yongkee; Kim, Dae-Kee; Shin, Whanchul","<i>cis</i>-[(4<i>R</i>,5<i>R</i>)-4,5-Bis(aminomethyl)-2,2-dimethyl-1,3-dioxolane-<i>N</i>,<i>N</i>'](malonato-<i>O</i>,<i>O</i>')platinum(II), an anticancer agent","Acta Crystallographica Section C","2000","56","6","653","654","10.1107/S0108270100003577","","","0.71073","MoKα","","0.058","0.046","","","","0.108","","","","","","1.03","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011021","14.463","0.004","5.805","0.002","20.927","0.007","90","","101.27","0.04","90","","1723.1","1","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","Octa-O-acetyl β,β-thio-Trehalose","","- C28 H38 O18 S -","- C28 H38 O18 S -","- C56 H76 O36 S2 -","2","1","OS1094","Färnbäck, Magnus; Eriksson, Lars; Widmalm, Göran","Octa-<i>O</i>-acetyl-β,β-thiotrehalose","Acta Crystallographica Section C","2000","56","6","700","701","10.1107/S0108270100003681","","","0.71073","MoKα","","0.2942","0.0551","","","","0.1235","","","","","","1.321","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011022","23.343","0.009","4.7027","0.0009","14.935","0.006","90","","104.36","0.05","90","","1588.3","1","293","2","293","2","","","","","","","","3","C 1 2 1","C 2y","5","","Methyl 4-O-β-L-fucopyranosyl α-D-glucopyranoside hemihydrate","","- C13 H25 O10.5 -","- C13 H25 O10.5 -","- C52 H100 O42 -","4","1","OS1102","Eriksson, Lars; Stenutz, Roland; Widmalm, Göran","Methyl 4-<i>O</i>-β-<small>L</small>-fucopyranosyl α-<small>D</small>-glucopyranoside hemihydrate","Acta Crystallographica Section C","2000","56","6","702","704","10.1107/S0108270100003589","","","0.71073","MoKα","","0.051","0.035","","","","0.09","","","","","","1.041","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011023","7.325","0.003","7.982","0.004","13.452","0.006","74.44","0.04","87.05","0.03","80.3","0.03","746.8","0.6","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C18 H13 N5 -","- C18 H13 N5 -","- C36 H26 N10 -","2","1","OS1110","Dahl, Tor","Intermolecular interactions and molecular geometry in molecular complexes of <i>N</i>,<i>N</i>-dimethylaniline: the 1:1 complex with 1,2,4,5-tetracyanobenzene","Acta Crystallographica Section C","2000","56","6","708","710","10.1107/S0108270100003590","","","0.71069","MoKα","","0.0732","0.0427","","","","0.1498","","","","","","1.066","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011024","47.7172","0.0011","10.3463","0.0002","33.7261","0.0008","90","","133.694","0.008","90","","12038.9","1.7","150","2","150","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","o-benzoquinonediimine-dichloro-bis(triphenylphosphine)ruthenium(II)","","- C43.67 H42 Cl2.67 N2 O1.33 P2 Ru -","- C43.3333 H41.3333 Cl2 N2 O1.33333 P2 Ru -","- C520 H496 Cl24 N24 O16 P24 Ru12 -","12","1.5","QA0217","Venegas-Yazigi, Diego; Mirza, Hameed; Lever, A. B. P.; Lough, Alan J.; Costamagna, Juan; Vega, Andrés; Latorre, Ramón","(<i>o</i>-Benzoquinone diimine-<i>N</i>,<i>N</i>')dichlorobis(triphenylphosphine-<i>P</i>)ruthenium(II) 1.33-methanol 0.33-dichloromethane solvate","Acta Crystallographica Section C","2000","56","6","e245","e246","10.1107/S0108270100006144","","","0.71073","MoKα","","0.075","0.041","","","","0.106","","","","","","0.991","","","","has coordinates,has Fobs","194583","2020-10-21","18:00:00",""
"2011025","3.8515","0.0003","11.0201","0.0008","12.7303","0.0009","90","","92.312","0.002","90","","539.88","0.07","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C12 H10 N4 -","- C12 H10 N4 -","- C24 H20 N8 -","2","0.5","QA0228","Shanmuga Sundara Raj, S.; Fun, Hoong-Kun; Zhang, Jing; Xiong, Ren-Geng; You, Xiao-Zeng","Pyridine-4-carbaldehyde azine","Acta Crystallographica Section C","2000","56","6","e274","e275","10.1107/S0108270100007046","","","0.71073","MoKα","","0.079","0.067","","","","0.11","","","","","","1.247","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011026","7.136","0.003","23.71","0.003","25.964","0.004","90","","90","","90","","4393","2","298","1","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","propane-1,3-diammonium bis[(E)-3-(3-nitrophenyl)propenoate]","","- C21 H24 N4 O8 -","- C21 H24 N4 O8 -","- C168 H192 N32 O64 -","8","1","QA0234","Hosomi, Hiroyuki; Ohba, Shigeru; Ito, Yoshikatsu","1,3-Propanediammonium bis(3'-nitro-<i>trans</i>-cinnamate) and <i>trans</i>-1,2-cyclohexanediammonium bis(3'-nitro-<i>trans</i>-cinnamate)","Acta Crystallographica Section C","2000","56","6","e260","e261","10.1107/S0108270100006120","","","0.71073","MoKα","","","0.056","","","","0.167","","","","","","1.03","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2011027","26.919","0.004","7.572","0.003","11.966","0.003","90","","90","","90","","2439","1.2","298","1","","","","","","","","","","4","P b c n","-P 2n 2ab","60","","trans-cyclohexane-1,2-diammonium bis[(E)-3-(3-nitrophenyl)propenoate]","","- C24 H28 N4 O8 -","- C24 H28 N4 O8 -","- C96 H112 N16 O32 -","4","0.5","QA0234","Hosomi, Hiroyuki; Ohba, Shigeru; Ito, Yoshikatsu","1,3-Propanediammonium bis(3'-nitro-<i>trans</i>-cinnamate) and <i>trans</i>-1,2-cyclohexanediammonium bis(3'-nitro-<i>trans</i>-cinnamate)","Acta Crystallographica Section C","2000","56","6","e260","e261","10.1107/S0108270100006120","","","0.71073","MoKα","","","0.074","","","","0.19","","","","","","1.77","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2011028","8.1341","0.0012","13.4171","0.0019","9.2291","0.0014","90","","90","","90","","1007.2","0.3","293","2","293","2","","","","","","","","3","P n a 21","P 2c -2n","33","","","","- C9 H12 N4 -","- C9 H12 N4 -","- C36 H48 N16 -","4","1","QA0267","Xu, An-Wu; Cai, Yue-Peng; Su, Cheng-Yong; Liu, Hong-Ke","Tris(2-cyanoethyl)amine","Acta Crystallographica Section C","2000","56","6","e262","e262","10.1107/S0108270100006156","","","0.71073","MoKα","","0.047","0.033","","","","0.081","","","","","","0.995","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011029","13.658","0.002","14.199","0.003","11.72","0.003","104.92","0.02","112.08","0.02","68.32","0.01","1938.5","0.8","299","","","","","","","","","","","6","P -1","-P 1","2","","","","- C17 H17 Cl2 Cu N3 O5 -","- C17 H17 Cl2 Cu N3 O5 -","- C68 H68 Cl8 Cu4 N12 O20 -","4","2","QA0275","Kani, Yoshiyuki; Ohba, Shigeru; Ito, Sayo; Nishida, Yuzo","Four copper(II) complexes with potentially tetradentate tripodal ligands","Acta Crystallographica Section C","2000","56","6","e233","e235","10.1107/S010827010000603X","","","0.71073","MoKα","","","0.046","","","","0.148","","","","","","0.99","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011030","23.377","0.004","9.204","0.002","16.361","0.003","90","","102.43","0.01","90","","3437.7","1.1","295","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H34 Cl6 Cu3 N6 O2 -","- C28 H34 Cl6 Cu3 N6 O2 -","- C112 H136 Cl24 Cu12 N24 O8 -","4","0.5","QA0275","Kani, Yoshiyuki; Ohba, Shigeru; Ito, Sayo; Nishida, Yuzo","Four copper(II) complexes with potentially tetradentate tripodal ligands","Acta Crystallographica Section C","2000","56","6","e233","e235","10.1107/S010827010000603X","","","0.71073","MoKα","","","0.04","","","","0.131","","","","","","1","","","","has coordinates,has Fobs","219800","2020-10-21","18:00:00",""
"2011031","9.282","0.003","11.592","0.004","19.731","0.003","90","","90.76","0.02","90","","2122.8","1.1","299","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H24 Cl2 Cu N4 O5 -","- C18 H24 Cl2 Cu N4 O5 -","- C72 H96 Cl8 Cu4 N16 O20 -","4","1","QA0275","Kani, Yoshiyuki; Ohba, Shigeru; Ito, Sayo; Nishida, Yuzo","Four copper(II) complexes with potentially tetradentate tripodal ligands","Acta Crystallographica Section C","2000","56","6","e233","e235","10.1107/S010827010000603X","","","0.71073","MoKα","","","0.049","","","","0.197","","","","","","1.32","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011032","11.855","0.003","15.258","0.002","13.186","0.003","90","","105.14","0.02","90","","2302.3","0.9","299","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C19 H26 Cl Cu F6 N4 P -","- C19 H26 Cl Cu F6 N4 P -","- C76 H104 Cl4 Cu4 F24 N16 P4 -","4","1","QA0275","Kani, Yoshiyuki; Ohba, Shigeru; Ito, Sayo; Nishida, Yuzo","Four copper(II) complexes with potentially tetradentate tripodal ligands","Acta Crystallographica Section C","2000","56","6","e233","e235","10.1107/S010827010000603X","","","0.71073","MoKα","","","0.045","","","","0.147","","","","","","0.99","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011033","9.7989","0.0002","15.016","0.0005","17.7189","0.0005","90","","104.595","0.0016","90","","2523.04","0.12","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C28 H16 Mn N10 -","- C28 H16 Mn N10 -","- C112 H64 Mn4 N40 -","4","1","QA0283","Wang, Zhe-Ming; Luo Jun; Sun Bai-Wang; Yan Chun-Hua; Liao Chun-Sheng; Gao Song","<i>cis</i>-Bis(dicyanamido)bis(1,10-phenanthroline)manganese(II) and <i>cis</i>-bis(dicyanamido)bis(1,10-phenanthroline)zinc(II)","Acta Crystallographica Section C","2000","56","6","e242","e244","10.1107/S0108270100006132","","","0.71073","MoKα","","0.088","0.045","","","","0.11","","","","","","1.008","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011034","9.68","0.0003","15.0697","0.0007","17.7166","0.0008","90","","104.628","0.002","90","","2500.63","0.18","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C28 H16 N10 Zn -","- C28 H16 N10 Zn -","- C112 H64 N40 Zn4 -","4","1","QA0283","Wang, Zhe-Ming; Luo Jun; Sun Bai-Wang; Yan Chun-Hua; Liao Chun-Sheng; Gao Song","<i>cis</i>-Bis(dicyanamido)bis(1,10-phenanthroline)manganese(II) and <i>cis</i>-bis(dicyanamido)bis(1,10-phenanthroline)zinc(II)","Acta Crystallographica Section C","2000","56","6","e242","e244","10.1107/S0108270100006132","","","0.71073","MoKα","","0.086","0.045","","","","0.087","","","","","","1.027","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011035","13.659","0.002","10.045","0.002","9.4366","0.0016","90","","108.205","0.018","90","","1229.9","0.4","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Dimethylphenylsulfonium trifluormethansulfonate","","- C9 H11 F3 O3 S2 -","- C9 H11 F3 O3 S2 -","- C36 H44 F12 O12 S8 -","4","1","QA0284","Schulze-Matthäi, Kerstin; Bendig, Jürgen; Neubauer, Petra; Ziemer, Burkhard","Dimethylphenylsulfonium trifluoromethanesulfonate and methyldiphenylsulfonium trifluoromethanesulfonate","Acta Crystallographica Section C","2000","56","6","e257","e258","10.1107/S0108270100006077","","","0.71073","MoKα","","0.049","0.044","","","","0.125","","","","","","1.056","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011036","12.5122","0.0013","9.0284","0.0006","15.3932","0.0014","90","","113.552","0.008","90","","1594","0.3","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Methyldiphenylsulfonium trifluoromethansulfonate","","- C14 H13 F3 O3 S2 -","- C14 H13 F3 O3 S2 -","- C56 H52 F12 O12 S8 -","4","1","QA0284","Schulze-Matthäi, Kerstin; Bendig, Jürgen; Neubauer, Petra; Ziemer, Burkhard","Dimethylphenylsulfonium trifluoromethanesulfonate and methyldiphenylsulfonium trifluoromethanesulfonate","Acta Crystallographica Section C","2000","56","6","e257","e258","10.1107/S0108270100006077","","","0.71073","MoKα","","0.036","0.031","","","","0.082","","","","","","1.066","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011037","17.843","0.004","7.2015","0.0014","33.176","0.007","90","","95.59","0.03","90","","4242.7","1.6","293","2","29","","","","","","","","","2","C 1 2/c 1","-C 2yc","15","tris-(4-Tolyl)phenylmethane","tris-(4-Tolyl)phenylmethane","","- C28 H26 -","- C28 H26 -","- C224 H208 -","8","1","QA0285","Jetti, Ram K. R.; Nangia, Ashwini","[Tris(4-tolyl)methyl]benzene","Acta Crystallographica Section C","2000","56","6","e259","e259","10.1107/S0108270100006090","","","0.71073","MoKα","","0.098","0.057","","","","0.173","","","","","","1.153","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011038","8.96","0.001","8.96","0.001","16.617","0.004","90","","90","","90","","1334","0.4","293","2","293","2","","","","","","","","4","I 4/m c m","-I 4 2c","140","","Potassium Barium Bismuth oxide","","- Ba4 Bi3 K O -","- Ba4 Bi3 K O -","- Ba16 Bi12 K4 O4 -","4","0.125","QA0287","Derrien, Gaelle; Tillard, Monique; Monconduit, Laure; Belin, Claude","Potassium barium bismuth oxide","Acta Crystallographica Section C","2000","56","6","e232","e232","10.1107/S0108270100006855","","","0.71069","MoKα","","0.072","0.046","","","","0.112","","","","","","1.064","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011039","25.0892","0.0018","11.0572","0.0008","22.0033","0.0015","90","","111.395","0.002","90","","5683.4","0.7","100","","100","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(η^5^-(2-(p-tolyl)prop-2-yl)cyclopentadienyl)-tribenzylzirconium","","- C36 H38 Zr -","- C36 H38 Zr -","- C288 H304 Zr8 -","8","2","QA0288","Sassmannshausen, Jörg; Rust, Jörg; Goddard, Richard","Tribenzyl{η^5^-[2-(<i>p</i>-tolyl)prop-2-yl]cyclopentadienyl}zirconium","Acta Crystallographica Section C","2000","56","6","e236","e237","10.1107/S0108270100006089","","","0.71073","MoKα","","0.084","0.044","","","","0.1","","","","","","1.016","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011040","6.9867","0.0001","6.3049","0.0001","25.233","0.0001","90","","91.7544","0.0008","90","","1111","0.02","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Hexaaquacobalt(II) 4-Toluenesulfonate","","- C14 H26 Co O12 S2 -","- C14 H26 Co O12 S2 -","- C28 H52 Co2 O24 S4 -","2","0.5","QA0289","Cabaleiro-Martínez, Santiago; Castro, Jesús; Romero, Jaime; García-Vázquez, José A.; Sousa, Antonio","Hexaaquacobalt(II) bis(4-toluenesulfonate)","Acta Crystallographica Section C","2000","56","6","e249","e250","10.1107/S0108270100006600","","","0.71073","MoKα","","0.041","0.036","","","","0.098","","","","","","1.012","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2011041","9.1481","0.0009","24.877","0.002","7.225","0.001","90","","90.82","0.01","90","","1644.1","0.3","292","1","292","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","n-butylammonium dihydrogenphosphate","","- C4 H14 N O4 P -","- C4 H14 N O4 P -","- C32 H112 N8 O32 P8 -","8","2","QA0290","Fábry, Jan; Císařová, Ivana; Kroupa, Jan","Ferroelastic <i>n</i>-butylammonium dihydrogenphosphate","Acta Crystallographica Section C","2000","56","6","e263","e264","10.1107/S0108270100006326","","","0.71073","MoKα","","0.459","0.0308","","0.0423","","0.0423","","","2.13","2.39","2.39","2.13","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011042","10.4676","0.0018","10.4774","0.0015","10.5727","0.0018","71.878","0.012","64.619","0.012","69.533","0.012","963.5","0.3","193","2","193","2","","","","","","","","3","P -1","-P 1","2","","","","- C10 H10 O5 -","- C10 H10 O5 -","- C40 H40 O20 -","4","2","QA0291","Kennedy, Alan R.; Khalaf, Abedawn I.; Suckling, Colin J.","3-Acetoxycyclohex-4-ene-1,2-dicarboxylic anhydride","Acta Crystallographica Section C","2000","56","6","e265","e266","10.1107/S0108270100006430","","","0.71069","MoKα","","0.069","0.039","","","","0.118","","","","","","1.006","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011043","9.975","0.002","7.186","0.002","24.267","0.006","90","","98.78","0.01","90","","1719.1","0.7","120","2","120","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","mineral hexahydrite","magnesium sulfate hexahydrate","","- H12 Mg O10 S -","- H12 Mg O10 S -","- H96 Mg8 O80 S8 -","8","1","QA0292","Batsanov, Andrei S.","Magnesium sulfate hexahydrate at 120K","Acta Crystallographica Section C","2000","56","6","e230","e231","10.1107/S0108270100006442","","","0.71073","MoKα","","0.03","0.029","","","","0.078","","","","","","1.189","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011044","5.479","0.002","10.84","0.004","11.159","0.003","90","","104.12","0.01","90","","642.7","0.4","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3,5-difluoro-4-nitropyridine N-oxide","","- C5 H2 F2 N2 O3 -","- C5 H2 F2 N2 O3 -","- C20 H8 F8 N8 O12 -","4","1","QA0293","Batsanov, Andrei S.","3,5-Difluoro-4-nitropyridine <i>N</i>-oxide and 3,5-diamino-4-nitropyridine <i>N</i>-oxide monohydrate","Acta Crystallographica Section C","2000","56","6","e269","e270","10.1107/S0108270100006636","","","0.71073","MoKα","","0.064","0.04","","","","0.104","","","","","","1.143","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011045","7","0.001","13.123","0.001","8.263","0.001","90","","90","","90","","759.05","0.15","150","2","150","2","","","","","","","","4","P n a 21","P 2c -2n","33","","3,5-diamino-4-nitropyridine N-oxide monohydrate","","- C5 H8 N4 O4 -","- C5 H8 N4 O4 -","- C20 H32 N16 O16 -","4","1","QA0293","Batsanov, Andrei S.","3,5-Difluoro-4-nitropyridine <i>N</i>-oxide and 3,5-diamino-4-nitropyridine <i>N</i>-oxide monohydrate","Acta Crystallographica Section C","2000","56","6","e269","e270","10.1107/S0108270100006636","","","0.71073","MoKα","","0.042","0.035","","","","0.0933","","","","","","1.086","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011046","9.0719","0.0002","18.9903","0.0008","10.1528","0.0003","90","","103.62","0.002","90","","1699.92","0.1","150","1","150","1","","","","","","","","4","P 1 21 1","P 2yb","4","BINAP oxide","(R)-(+)-2,2'-bis(diphenylphosphinoyl)-1,1'-binaphthyl","","- C44 H32 O2 P2 -","- C44 H32 O2 P2 -","- C88 H64 O4 P4 -","2","1","QA0294","Bunten, Kevin A.; Farrar, David H.; Lough, Alan J.","(<i>R</i>)-(+)-2,2'-Bis(diphenylphosphinoyl)-1,1'-binaphthyl","Acta Crystallographica Section C","2000","56","6","e267","e267","10.1107/S0108270100006508","","","0.71073","MoKα","","0.078","0.052","","","","0.099","","","","","","1.021","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011047","7.431","0.004","7.604","0.003","16.007","0.006","93.61","0.03","95.5","0.04","99.89","0.04","884","0.7","293","2","293","2","","","","","","","","3","P -1","-P 1","2","2-hydroxy-4,6-dimethylacetophenone","2-hydroxy-4,6-dimethylphenylethanone","","- C10 H12 O2 -","- C10 H12 O2 -","- C40 H48 O8 -","4","2","QA0296","Armelao, Lidia; Depaoli, Giovanni; Dolmella, Alessandro","1-(2-Hydroxy-4,6-dimethylphenyl)ethanone","Acta Crystallographica Section C","2000","56","6","e268","e268","10.1107/S0108270100006612","","","0.71073","MoKα","","0.11","0.049","","0.147","0.126","","","","0.913","1.157","1.157","","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011048","12.19","0.002","9.147","0.002","14.612","0.003","90","","104.2","0.02","90","","1579.5","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H14 Cr O4 -","- C18 H14 Cr O4 -","- C72 H56 Cr4 O16 -","4","1","QA0298","Pèpe, Gérard; Hannesschlager, Patrick; Brun, Pierre","Tricarbonyl[(6a,7,8,9,10a-η)-3,3-dimethyl-3<i>H</i>-benzo[<i>f</i>]chromene]chromium","Acta Crystallographica Section C","2000","56","6","e251","e252","10.1107/S0108270100006843","","","0.71073","MoKα","","0.036","0.036","","0.073","","0.073","","","0.979","","","1.048","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011049","7.8786","0.0007","18.417","0.001","12.758","0.001","90","","96.971","0.005","90","","1837.5","0.2","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C22 H22 O4 -","- C22 H22 O4 -","- C88 H88 O16 -","4","1","QA0300","Winicker, Dominik; Bolte, Michael","Diethyl 9,10-dihydro-9,10-ethanoanthracene-11,12-<i>trans</i>-dicarboxylate","Acta Crystallographica Section C","2000","56","6","e271","e272","10.1107/S0108270100006867","","","0.71073","MoKα","","0.059","0.05","","","","0.138","","","","","","1.029","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011050","10.6397","0.0006","8.2558","0.0005","13.0057","0.0007","90","","90","","90","","1142.41","0.11","150","2","150","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C4 Cl2 O3 -","- C4 Cl2 O3 -","- C32 Cl16 O24 -","8","1","QA0304","Blake, Alexander J.; Griffiths, Rhiannon M. T.; Howdle, Steven M.; Wilson, Claire","Dichloromaleic anhydride","Acta Crystallographica Section C","2000","56","6","e273","e273","10.1107/S0108270100007034","","","0.71073","MoKα","","0.026","0.023","","","","0.067","","","","","","1.041","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011051","6.9505","0.0003","21.882","0.0008","12.9619","0.0005","90","","100.239","0.001","90","","1939.99","0.13","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-Acetyl-4-benzoyl-2-methyl-5-phenyl-3,3a-dihydropyrazolo[2,3-c]pyrimidine- 7(6H)-thione","","- C22 H19 N3 O2 S -","- C22 H19 N3 O2 S -","- C88 H76 N12 O8 S4 -","4","1","QA0307","Akkurt, Mehmet; Öztürk, Sema; Fun, Hoong-Kun; Altural, Behzat","3-Acetyl-4-benzoyl-2-methyl-5-phenyl-3,3a-dihydropyrazolo[2,3-<i>c</i>]pyrimidine-7(6<i>H</i>)-thione","Acta Crystallographica Section C","2000","56","6","e276","e277","10.1107/S0108270100007241","","","0.71073","MoKα","","0.143","0.061","","0.152","0.123","","","","0.953","1.107","1.107","","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011052","12.426","0.003","29.446","0.01","7.45","0.009","90","","90","","90","","2726","3","293","2","293","2","","","","","","","","3","P 21 21 2","P 2 2ab","18","Dysobinin","6β-acetoxyazadirone","","- C30 H38 O6 -","- C30 H38 O6 -","- C120 H152 O24 -","4","1","QB0200","Sarkhel, Sanjay; Jain, Girish K.; Singh, Satywan; Subramanya, Hosahalli. S.; Maulik, Prakas R.","Dysobinin, a tetranortriterpenoid","Acta Crystallographica Section C","2000","56","6","e253","e254","10.1107/S0108270100006041","","","0.7093","MoKα","","0.094","0.045","","","","0.127","","","","","","0.971","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011053","16.7683","0.0003","9.7089","0.0002","11.116","0.002","90","","90.9963","0.0011","90","","1809.4","0.3","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","7-Methyl-3,7,11,17-tetraazabicyclo[11.3.1]-heptadeca-1(17),13,15-triene dihydrochloride monohydrate","","- C14 H28 Cl2 N4 O -","- C14 H28 Cl2 N4 O -","- C56 H112 Cl8 N16 O4 -","4","1","QB0201","Lodeiro, Carlos; Bastida, Rufina; Macías, Alejandro; Rodríguez, Adolfo; Saint-Maurice, Andre","Two hydrochlorides of 7-methyl-3,7,11,17-tetraazabicyclo[11.3.1]heptadeca-1(17),13,15-triene","Acta Crystallographica Section C","2000","56","6","e255","e256","10.1107/S0108270100006065","","","0.71073","MoKα","","0.037","0.035","","","","0.112","","","","","","1.096","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011054","10.7592","0.0003","10.8825","0.0003","15.4988","0.0003","90","","93.9033","0.0013","90","","1810.5","0.08","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","7-Methyl-3,7,11,17-tetraazabicyclo[11.3.1]-heptadeca-1(17),13,15-triene trihydrochloride","","- C14 H27 Cl2.826 N4.174 O0.522 -","- C14 H27 Cl2.826 N4.174 O0.522 -","- C56 H108 Cl11.304 N16.696 O2.088 -","4","1","QB0201","Lodeiro, Carlos; Bastida, Rufina; Macías, Alejandro; Rodríguez, Adolfo; Saint-Maurice, Andre","Two hydrochlorides of 7-methyl-3,7,11,17-tetraazabicyclo[11.3.1]heptadeca-1(17),13,15-triene","Acta Crystallographica Section C","2000","56","6","e255","e256","10.1107/S0108270100006065","","","0.71073","MoKα","","0.117","0.054","","","","0.122","","","","","","0.984","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2011055","24.2211","0.0008","10.6752","0.0004","35.1913","0.0012","90","","107.747","0.002","90","","8666.2","0.5","150","2","150","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","(Acetonitrile-N)(o-benzoquinone diimine-N,N')chloro-trans- bis(triphenylphosphine-P)ruthenium(II) hexafluorophosphate 0.25-hydrate","","- C44 H39.5 Cl F6 N3 O0.25 P3 Ru -","- C44 H39 Cl F6 N3 O0.25 P3 Ru -","- C352 H312 Cl8 F48 N24 O2 P24 Ru8 -","8","2","QB0209","Venegas-Yazigi, Diego; Mirza, Hameed; Lever, A. B. P.; Lough, Alan J.; Costamagna, Juan; Latorre, Ramón","(Acetonitrile-<i>N</i>)(<i>o</i>-benzoquinone diimine-<i>N</i>,<i>N</i>')chloro-<i>trans</i>-bis(triphenylphosphine-<i>P</i>)ruthenium(II) hexafluorophosphate 0.25-hydrate","Acta Crystallographica Section C","2000","56","6","e247","e248","10.1107/S0108270100006314","","","0.71073","MoKα","","0.165","0.056","","","","0.118","","","","","","0.875","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2011056","12.033","0.002","12.033","0.002","13.863","0.004","90","","90","","120","","1738.3","0.6","293","2","293","2","","","","","","","","4","R -3 c :H","-R 3 2""c","167","rinneite","tripotassium sodium hexachloroferrate(II)","","- Cl6 Fe K3 Na -","- Cl6 Fe K3 Na -","- Cl36 Fe6 K18 Na6 -","6","0.166667","QB0210","Figgis, Brian N.; Sobolev, Alexandre N.; Kucharski, Edward S.; Broughton, Vanessa","Rinneite, K~3~Na[FeCl~6~], at 293, 84 and 9.5K","Acta Crystallographica Section C","2000","56","6","e228","e229","10.1107/S0108270100006053","","","0.71073","MoKα","","0.017","0.017","","","","0.031","","","","","","1.623","","","","has coordinates,has Fobs","282532","2023-04-10","14:59:13",""
"2011057","11.922","0.001","11.922","0.001","13.761","0.002","90","","90","","120","","1693.9","0.3","84","2","84","2","","","","","","","","4","R -3 c :H","-R 3 2""c","167","rinneite","tripotassium sodium hexachloroferrate(II)","","- Cl6 Fe K3 Na -","- Cl6 Fe K3 Na -","- Cl36 Fe6 K18 Na6 -","6","0.166667","QB0210","Figgis, Brian N.; Sobolev, Alexandre N.; Kucharski, Edward S.; Broughton, Vanessa","Rinneite, K~3~Na[FeCl~6~], at 293, 84 and 9.5K","Acta Crystallographica Section C","2000","56","6","e228","e229","10.1107/S0108270100006053","","","0.71073","MoKα","","0.02","0.018","","","","0.036","","","","","","1.398","","","","has coordinates,has Fobs","282532","2023-04-10","14:59:13",""
"2011058","11.893","0.001","11.893","0.001","13.735","0.002","90","","90","","120","","1682.4","0.3","9.5","0.5","9.5","0.5","","","","","","","","4","R -3 c :H","-R 3 2""c","167","rinneite","tripotassium sodium hexachloroferrate(II)","","- Cl6 Fe K3 Na -","- Cl6 Fe K3 Na -","- Cl36 Fe6 K18 Na6 -","6","0.166667","QB0210","Figgis, Brian N.; Sobolev, Alexandre N.; Kucharski, Edward S.; Broughton, Vanessa","Rinneite, K~3~Na[FeCl~6~], at 293, 84 and 9.5K","Acta Crystallographica Section C","2000","56","6","e228","e229","10.1107/S0108270100006053","","","0.71073","MoKα","","0.02","0.02","","","","0.05","","","","","","1.459","","","","has coordinates,has Fobs","282532","2023-04-10","14:59:13",""
"2011059","17.632","0.0004","18.284","0.0004","22.998","0.0004","90","","91.27","0.0014","90","","7412.4","0.3","100","2","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C36 H26 Cl3 Cr N6 O13 -","- C36 H24 Cl3 Cr N6 O13 -","- C288 H192 Cl24 Cr8 N48 O104 -","8","1","QB0212","Luck, Rudy L.; Gawryszewska, Paula; Riehl, James P.","Tris(1,10-phenanthroline-<i>N</i>,<i>N</i>')chromium(III) triperchlorate hydrate","Acta Crystallographica Section C","2000","56","6","e238","e239","10.1107/S0108270100006107","","","0.71073","MoKα","","","0.075","","","","0.241","","","","","","1.028","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2011060","21.078","0.0004","15.0708","0.0004","15.9811","0.0003","90","","102.823","0.001","90","","4949.98","0.19","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis[copper(I)-di-1,10-phenanthroline)]terephthalate bisperchlorate","","- C56 H36 Cl2 Cu2 N8 O12 -","- C56 H36 Cl2 Cu2 N8 O12 -","- C224 H144 Cl8 Cu8 N32 O48 -","4","0.5","QB0213","Sun, Daofeng; Cao, Rong; Liang, Yucang; Hong, Maochun; Su, Weiping; Weng, Jiabao","μ-Terephthalato-bis[bis(1,10-phenanthroline)copper(I)] diperchlorate","Acta Crystallographica Section C","2000","56","6","e240","e241","10.1107/S0108270100006119","","","0.71073","MoKα","","0.052","0.039","","","","0.106","","","","","","1.042","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011061","11.615","0.002","12","0.001","13.789","0.001","80.03","0.01","84.42","0.01","62.92","0.01","1685","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Bis(ferrocenium) bis[tetrachloroantimonate(III)] trichloroantimony(III)","","- C20 H20 Cl11 Fe2 Sb3 -","- C20 H20 Cl11 Fe2 Sb3 -","- C40 H40 Cl22 Fe4 Sb6 -","2","1","SK1355","Razak, Ibrahim Abdul; Shanmuga Sundara Raj, S.; Fun, Hoong-Kun; Yamin, Bohari M.; Hashim, Norhayati","Bis(ferrocenium) bis[tetrachloroantimonate(III)] trichloroantimony(III)","Acta Crystallographica Section C","2000","56","6","664","665","10.1107/S0108270100002912","","","0.71073","MoKα","","0.086","0.04","","","","0.085","","","","","","0.81","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011062","37.605","0.007","7.7797","0.0006","10.347","0.002","90","","90.82","0.02","90","","3026.8","0.8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Disodium tetrakis(hexanoato-O)zinc(II)","","- C24 H44 Na2 O8 Zn -","- C24 H44 Na2 O8 Zn -","- C96 H176 Na8 O32 Zn4 -","4","0.5","SK1361","Lah, Nina; Rep, Gregor; Šegedin, Primož; Golič, Ljubo; Leban, Ivan","Disodium tetrakis(hexanoato-<i>O</i>)zinc(II)","Acta Crystallographica Section C","2000","56","6","642","643","10.1107/S0108270100002924","","","0.71073","MoKα","","0.115","0.055","","","","0.133","","","","","","0.991","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011063","4.8249","0.0005","13.0267","0.0016","15.5518","0.0011","90","","90.766","0.007","90","","977.38","0.17","295","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H10 Br6 Cu N2 O2 -","- C12 H10 Br6 Cu N2 O2 -","- C24 H20 Br12 Cu2 N4 O4 -","2","0.5","SK1366","Tatar, Leyla; Gökağac, Gülsün; Ülkü, Dinçer","Diamminebis(2,4,6-tribromophenolato-<i>O</i>)copper(II)","Acta Crystallographica Section C","2000","56","6","668","669","10.1107/S0108270100003966","","","1.54184","CuKα","","","0.045","","","","0.057","","","","","","1","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2011064","13.5984","0.0005","9.6927","0.0003","10.3211","0.0004","90","","108.981","0.001","90","","1286.41","0.08","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Self-assembly of 2-pivaloylchloropterin","","- C11 H12 Cl N5 O2 -","- C11 H12 Cl N5 O2 -","- C44 H48 Cl4 N20 O8 -","4","1","SK1368","Goswami, Shyamaprosad; Mukherjee, Reshmi; Ghosh, Kumaresh; Razak, Ibrahim Abdul; Shanmuga Sundara Raj, S.; Fun, Hoong-Kun","Self-assembly of 2-pivaloyl-6-chloropterin","Acta Crystallographica Section C","2000","56","6","716","717","10.1107/S0108270100004121","","","0.71073","MoKα","","0.083","0.055","","","","0.157","","","","","","1.07","","","","has coordinates,has disorder","176760","2020-10-21","18:00:00",""
"2011065","10.24","0.0003","9.7505","0.0002","15.031","0.0004","90","","90","","90","","1500.77","0.07","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C20 H14 N4 -","- C20 H14 N4 -","- C80 H56 N16 -","4","0.5","SK1369","Bei, Fengli; Jian, Fangfang; Yang, Xujie; Lu, Lude; Wang, Xin; Shanmuga Sundara Raj, S.; Fun, Hoong-Kun","1,4-Bis(2-benzimidazolyl)benzene","Acta Crystallographica Section C","2000","56","6","718","719","10.1107/S0108270100003978","","","0.71073","MoKα","","0.111","0.0667","","","","0.1551","","","","","","1.117","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011066","7.2971","0.0004","7.0999","0.0004","27.0085","0.0015","90","","95.62","0.01","90","","1392.55","0.14","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","S-(2-nitrophenyl)-4-toluenethiosulfonate","","- C13 H11 N O4 S2 -","- C13 H11 N O4 S2 -","- C52 H44 N4 O16 S8 -","4","1","SK1372","Low, John Nicolson; Glidewell, Christopher; Wardell, James L.","Conformational preferences in 2-nitrophenylthiolates: <i>S</i>-(2-nitrophenyl) 4-toluenethiosulfonate","Acta Crystallographica Section C","2000","56","6","689","691","10.1107/S0108270100003346","","","0.71073","MoKα","","0.045","0.032","","","","0.083","","","","","","1.002","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011067","13.1835","0.0011","6.505","0.0004","15.2171","0.0009","90","","92.217","0.004","90","","1304.02","0.16","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","S-(4-tolyl) 4-toluenethiosulfonate at 150K","","- C14 H14 O2 S2 -","- C14 H14 O2 S2 -","- C56 H56 O8 S8 -","4","1","SK1374","Ferguson, George; Glidewell, Christopher; Low, John Nicolson; Wardell, James L","A second monoclinic polymorph of <i>S</i>-(4-tolyl) 4-toluenethiosulfonate at 150 and 293K","Acta Crystallographica Section C","2000","56","6","692","694","10.1107/S0108270100003280","","","0.71073","MoKα","","0.05","0.04","","","","0.118","","","","","","1.088","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011068","13.3579","0.0007","6.6176","0.0004","15.2123","0.0011","90","","92.1322","0.0019","90","","1343.79","0.14","293","2","150","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","S-(4-tolyl) 4-toluenethiosulfonate at 293K","","- C14 H14 O2 S2 -","- C14 H14 O2 S2 -","- C56 H56 O8 S8 -","4","1","SK1374","Ferguson, George; Glidewell, Christopher; Low, John Nicolson; Wardell, James L","A second monoclinic polymorph of <i>S</i>-(4-tolyl) 4-toluenethiosulfonate at 150 and 293K","Acta Crystallographica Section C","2000","56","6","692","694","10.1107/S0108270100003280","","","0.71073","MoKα","","0.109","0.049","","","","0.148","","","","","","0.976","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011069","7.1167","0.0007","14.1692","0.0015","12.6473","0.0014","90","","93.753","0.004","90","","1272.6","0.2","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis-(4-nitrophenyl)disulfide","","- C12 H8 N2 O4 S2 -","- C12 H8 N2 O4 S2 -","- C48 H32 N8 O16 S8 -","4","0.5","SK1379","Wardell, James L.; Low, John Nicolson; Glidewell, Christopher","Bis(4-nitrophenyl) disulfide at 150K, a three-dimensional framework built from C—H···O hydrogen bonds and aromatic π···π stacking interactions","Acta Crystallographica Section C","2000","56","6","679","681","10.1107/S0108270100004649","","","0.71073","MoKα","","0.07","0.045","","","","0.107","","","","","","1.082","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011070","10.417","0.003","8.263","0.002","16.5049","0.0012","90","","92.746","0.011","90","","1419","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N-Phenyl-8-oxa-9-aza-1,4,4-trimethylbicyclo[3.2.2]non-6-en-one","","- C16 H19 N O2 -","- C16 H19 N O2 -","- C64 H76 N4 O8 -","4","1","SX1097","Russi, Silvia; Pardo, Helena; Heinzen, Horacio; Dias, Eduardo; Moyna, Patrick; Mariezcurrena, Raúl A.; Suescun, Leopoldo; Mombrú, Alvaro W.","1,4,4-Trimethyl-9-phenyl-8-oxa-9-azabicyclo[3.2.2]non-6-en-2-one","Acta Crystallographica Section C","2000","56","6","672","673","10.1107/S0108270100002729","","","0.71069","MoKα","","0.0989","0.0422","","","","0.1393","","","","","","1.027","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011071","7.2267","0.0006","13.2561","0.0011","13.1906","0.0011","90","","99.189","0.001","90","","1247.41","0.18","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Pentacarbonyl(pyridine-4-thione)tungsten (0)","","- C10 H5 N O5 S W -","- C10 H5 N O5 S W -","- C40 H20 N4 O20 S4 W4 -","4","1","BK1522","Choi, Moon-Gun; Angelici, Robert J.","Pyridine‒pyridine π‒π stacking interactions in pentacarbonyl[pyridine-4(1<i>H</i>)-thione]tungsten(0)","Acta Crystallographica Section C","2000","56","7","808","810","10.1107/S0108270100006168","","","0.71073","MoKα","","0.0289","0.0229","","","","0.0541","","","","","","1.031","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011072","7.4654","0.0015","9.233","0.002","11.895","0.002","103.73","0.03","90.73","0.03","112.98","0.03","728.2","0.3","174","2","174","2","","","","","","","","5","P -1","-P 1","2","","1,2-bis(imidazolidine-2-thione)-1,2-dicyano-digold(I)","","- C8 H12 Au2 N6 S2 -","- C8 H12 Au2 N6 S2 -","- C16 H24 Au4 N12 S4 -","2","1","BK1525","Stocker, Fred B.; Britton, Doyle","1,2-Dicyano-1,2-bis(imidazolidine-2-thione)digold(I) and 2,2-dicyano-1,1-bis(dimethylthiourea)digold(I)","Acta Crystallographica Section C","2000","56","7","798","800","10.1107/S0108270100005783","","","0.71073","MoKα","","0.042","0.036","","0.093","0.089","","","","0.94","1","1","","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011073","13.3922","0.0002","7.817","0.0001","14.9588","0.0003","90","","94.506","0.001","90","","1561.15","0.04","174","2","174","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,1-bis(dimethylthiourea)-2,2-dicyano-digold(I)","","- C8 H16 Au2 N6 S2 -","- C8 H16 Au2 N6 S2 -","- C32 H64 Au8 N24 S8 -","4","1","BK1525","Stocker, Fred B.; Britton, Doyle","1,2-Dicyano-1,2-bis(imidazolidine-2-thione)digold(I) and 2,2-dicyano-1,1-bis(dimethylthiourea)digold(I)","Acta Crystallographica Section C","2000","56","7","798","800","10.1107/S0108270100005783","","","0.71073","MoKα","","0.032","0.026","","0.063","0.061","","","","1.07","1.1","1.1","","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011074","10.352","0.001","20.083","0.002","6.828","0.004","90","","90","","90","","1419.5","0.9","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Catena-poly[[diaqua(phenanthroline-N,N')cadmium(II)-μ-(sulfato- O:O')]","","- C12 H12 Cd N2 O6 S -","- C12 H12 Cd N2 O6 S -","- C48 H48 Cd4 N8 O24 S4 -","4","1","BK1526","Harvey, Miguel; Baggio, Sergio; Suescun, Leopoldo; Baggio, Ricardo F.","<i>catena</i>-Poly[[diaqua(1,10-phenanthroline-<i>N</i>,<i>N</i>')cadmium(II)]-μ-(sulfato-<i>O</i>:<i>O</i>')] and <i>catena</i>-poly[[diaqua(2,9-dimethyl-1,10-phenanthroline-<i>N</i>,<i>N</i>')cadmium(II)]-μ-(sulfato-<i>O</i>:<i>O</i>')]","Acta Crystallographica Section C","2000","56","7","811","813","10.1107/S010827010000617X","","","0.71073","MoKα","","0.032","0.026","","","","0.076","","","","","","0.995","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011075","15.384","0.003","14.826","0.003","6.926","0.001","90","","107.54","0.03","90","","1506.3","0.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C14 H16 Cd N2 O6 S -","- C14 H16 Cd N2 O6 S -","- C56 H64 Cd4 N8 O24 S4 -","4","0.5","BK1526","Harvey, Miguel; Baggio, Sergio; Suescun, Leopoldo; Baggio, Ricardo F.","<i>catena</i>-Poly[[diaqua(1,10-phenanthroline-<i>N</i>,<i>N</i>')cadmium(II)]-μ-(sulfato-<i>O</i>:<i>O</i>')] and <i>catena</i>-poly[[diaqua(2,9-dimethyl-1,10-phenanthroline-<i>N</i>,<i>N</i>')cadmium(II)]-μ-(sulfato-<i>O</i>:<i>O</i>')]","Acta Crystallographica Section C","2000","56","7","811","813","10.1107/S010827010000617X","","","0.71073","MoKα","","0.028","0.026","","","","0.073","","","","","","1.05","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011076","16.456","0.0014","5.5761","0.0009","11.9512","0.0012","90","","94.517","0.007","90","","1093.2","0.2","100","","100","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2,4,8,10-tetraoxa-3,9-diphosphaspiro[5,5]undecane, 3,9,-dimethyl-3,9-dioxide","","- C7 H14 O6 P2 -","- C7 H14 O6 P2 -","- C28 H56 O24 P8 -","4","0.5","BK1533","Elnagar, Hassan Y.; Ranken, Paul F.; Fronczek, Frank R.","A pentaerythritol-derived spirodiphosphonate","Acta Crystallographica Section C","2000","56","7","905","906","10.1107/S0108270100006181","","","0.71073","Mo-Kα","","0.034","0.031","","0.047","","0.047","","","1.983","","","1.911","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011077","12.309","0.004","13.659","0.003","13.611","0.001","89.92","0.01","94.1","0.01","95.01","0.02","2273.8","0.9","100","","100","","","","","","","","","4","P -1","-P 1","2","","tetrabutylammonium-α-acetyl-γ-butyrolactonate","","- C22 H43 N O3 -","- C22 H43 N O3 -","- C88 H172 N4 O12 -","4","2","BM1402","Goddard, Richard; Hütte, Stephan; Reetz, Manfred T.","Tetrabutylammonium α-acetyl-γ-butyrolactonate containing a three-dimensional hydrogen-bonded network","Acta Crystallographica Section C","2000","56","7","878","880","10.1107/S0108270100004959","","","0.71073","MoKα","","0.113","0.0743","","","","0.219","","","","","","1.041","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011078","6.417","0.003","8.963","0.004","11.902","0.006","93.35","0.04","90.89","0.04","92.88","0.04","682.4","0.6","193","2","193","2","","","","","","","","3","P -1","-P 1","2","","","","- C16 H16 N4 -","- C16 H16 N4 -","- C32 H32 N8 -","2","1","BM1407","Nesterov, Vladimir N.; Viltchinskaia, Elena A.","6-Amino-5,5,7-tricyano-3,3a,4,5-tetrahydro-2<i>H</i>-indene-4-spirocyclopentane","Acta Crystallographica Section C","2000","56","7","872","873","10.1107/S0108270100004832","","","0.71073","MoKα","","0.0744","0.0473","","","","0.122","","","","","","1.024","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011079","12.296","0.002","12.296","0.002","12.296","0.002","90","","90","","90","","1859.1","0.5","293","2","293","2","","","","","","","","5","P a -3","-P 2ac 2ab 3","205","Rubidium chromium sulfate dodecahydrate","Chromium alpha-Alums","","- Cr H24 O20 Rb S2 -","- Cr H24 O20 Rb S2 -","- Cr4 H96 O80 Rb4 S8 -","4","0.166667","BR1280","Figgis, Brian N.; Reynolds, Philip A.; Sobolev, Alexandre N.","The structures of the α-alums RbCr(SO~4~)~2~·12H~2~O and CsCr(SeO~4~)~2~·12H~2~O at 293 and 12K","Acta Crystallographica Section C","2000","56","7","731","734","10.1107/S0108270100004960","","","0.71073","MoKα","","0.0424","0.0321","","","","0.0803","","","","","","1.046","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2011080","12.241","0.002","12.241","0.002","12.241","0.002","90","","90","","90","","1834.2","0.5","12","2","12","2","","","","","","","","5","P a -3","-P 2ac 2ab 3","205","Rubidium chromium sulfate dodecahydrate","Chromium alpha-Alums","","- Cr H24 O20 Rb S2 -","- Cr H24 O20 Rb S2 -","- Cr4 H96 O80 Rb4 S8 -","4","0.166667","BR1280","Figgis, Brian N.; Reynolds, Philip A.; Sobolev, Alexandre N.","The structures of the α-alums RbCr(SO~4~)~2~·12H~2~O and CsCr(SeO~4~)~2~·12H~2~O at 293 and 12K","Acta Crystallographica Section C","2000","56","7","731","734","10.1107/S0108270100004960","","","0.71073","MoKα","","0.0226","0.0189","","","","0.0446","","","","","","1.094","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2011081","12.585","0.001","12.585","0.001","12.585","0.001","90","","90","","90","","1993.2","0.3","293","2","293","2","","","","","","","","5","P a -3","-P 2ac 2ab 3","205","Caesium chromium bis(selenate) dodecahydrate","Chromium alpha-Alums","","- Cr Cs H24 O20 Se2 -","- Cr Cs H24 O20 Se2 -","- Cr4 Cs4 H96 O80 Se8 -","4","0.166667","BR1280","Figgis, Brian N.; Reynolds, Philip A.; Sobolev, Alexandre N.","The structures of the α-alums RbCr(SO~4~)~2~·12H~2~O and CsCr(SeO~4~)~2~·12H~2~O at 293 and 12K","Acta Crystallographica Section C","2000","56","7","731","734","10.1107/S0108270100004960","","","0.71073","MoKα","","0.023","0.0199","","","","0.0443","","","","","","1.259","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2011082","12.522","0.003","12.522","0.003","12.522","0.003","90","","90","","90","","1963.5","0.8","12","2","12","2","","","","","","","","5","P a -3","-P 2ac 2ab 3","205","Caesium chromium bis(selenate) dodecahydrate","Chromium alpha-Alums","","- Cr Cs H24 O20 Se2 -","- Cr Cs H24 O20 Se2 -","- Cr4 Cs4 H96 O80 Se8 -","4","0.166667","BR1280","Figgis, Brian N.; Reynolds, Philip A.; Sobolev, Alexandre N.","The structures of the α-alums RbCr(SO~4~)~2~·12H~2~O and CsCr(SeO~4~)~2~·12H~2~O at 293 and 12K","Acta Crystallographica Section C","2000","56","7","731","734","10.1107/S0108270100004960","","","0.71073","MoKα","","0.0203","0.0186","","","","0.0417","","","","","","1.309","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2011083","8.501","0.002","10.426","0.002","11.282","0.002","68.46","0.03","87.3","0.03","67.14","0.03","851.7","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Tetraammonium disodium decavanadate 10-hydrate","Tetraammonium dinatrium decavanadate 10-hydrate","","- H36 N4 Na2 O38 V10 -","- H36 N4 Na2 O38 V10 -","- H36 N4 Na2 O38 V10 -","1","0.5","BR1283","Fratzky, Dietmar; Schneider, Matthias; Rabe, Stefan; Meisel, Manfred","(NH~4~)~4~Na~2~[V~10~O~28~]·10H~2~O","Acta Crystallographica Section C","2000","56","7","740","741","10.1107/S0108270100005448","","","0.71073","MoKα","","0.04","0.036","","","","0.102","","","","","","1.063","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011084","7.4","0.003","18.511","0.005","8.92","0.003","90","","111.91","0.02","90","","1133.6","0.7","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Phenylazoaniline hydrochloride","","- C12 H12 Cl N3 -","- C12 H12 Cl N3 -","- C48 H48 Cl4 N12 -","4","1","BR1286","Yatsenko, A. V.; Chernyshev, V. V.; Kurbakov, A. I.; Schenk, H.","<i>p</i>-Phenylazoaniline hydrochloride from powder data: protonation site and UV‒visible spectra","Acta Crystallographica Section C","2000","56","7","892","894","10.1107/S0108270100005357","","","1.5418","CuKα","","","","","","","","","","1.75","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2011085","11.207","0.002","8.21","0.001","7.696","0.001","90","","90.25","0.01","90","","708.1","0.18","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","cesium potassium manganicyanide","dicesium potassium hexacyanomanganate(III)","","- C6 Cs2 K Mn N6 -","- C6 Cs2 K Mn N6 -","- C12 Cs4 K2 Mn2 N12 -","2","0.5","BR1288","Figgis, Brian N.; Sobolev, Alexandre N.; Kucharski, Edward S.; Broughton, Vanessa","Cs~2~K[Mn(CN)~6~] at 293, 85 and 10K","Acta Crystallographica Section C","2000","56","7","735","737","10.1107/S0108270100005369","","","0.71073","MoKα","","0.025","0.025","","","","0.06","","","","","","1.117","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011086","11.084","0.002","8.213","0.001","7.617","0.001","90","","90.77","0.01","90","","693.33","0.18","85","2","85","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","cesium potassium manganicyanide","dicesium potassium hexacyanomanganate(III)","","- C6 Cs2 K Mn N6 -","- C6 Cs2 K Mn N6 -","- C12 Cs4 K2 Mn2 N12 -","2","0.5","BR1288","Figgis, Brian N.; Sobolev, Alexandre N.; Kucharski, Edward S.; Broughton, Vanessa","Cs~2~K[Mn(CN)~6~] at 293, 85 and 10K","Acta Crystallographica Section C","2000","56","7","735","737","10.1107/S0108270100005369","","","0.71073","MoKα","","0.038","0.031","","","","0.079","","","","","","1.087","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011087","11.074","0.007","8.227","0.002","7.6135","0.0005","90","","90.95","0.04","90","","693.5","0.5","10","2","10","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","cesium potassium manganicyanide","dicesium potassium hexacyanomanganate(III)","","- C6 Cs2 K Mn N6 -","- C6 Cs2 K Mn N6 -","- C12 Cs4 K2 Mn2 N12 -","2","0.5","BR1288","Figgis, Brian N.; Sobolev, Alexandre N.; Kucharski, Edward S.; Broughton, Vanessa","Cs~2~K[Mn(CN)~6~] at 293, 85 and 10K","Acta Crystallographica Section C","2000","56","7","735","737","10.1107/S0108270100005369","","","0.71073","MoKα","","0.032","0.031","","","","0.077","","","","","","1.222","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011088","5.73","0.001","10.213","0.002","12.232","0.002","68.15","0.03","82.08","0.03","86.08","0.03","657.9","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","molybdenum(V) glycinate","Di-μ-O-μ-2-aminoacetate-bis[(2-aminoacetate-N,O)oxo-molybdenum(V)]","","- C12 H26 Mo4 N6 O20 -","- C6 H13 Mo2 N3 O10 -","- C12 H26 Mo4 N6 O20 -","2","1","BR1289","Liu, Guang; Liu, Jian; Wei, Yong-Ge; Liu, Qun; Zhang, Shi-Wei","μ-Glycine-<i>O</i>:<i>O</i>'-di-μ-oxo-bis[(glycinato-<i>N</i>,<i>O</i>)oxomolybdenum(V)]","Acta Crystallographica Section C","2000","56","7","822","823","10.1107/S0108270100006466","","","0.71069","MoKα","","0.0353","0.0313","","","","0.0864","","","","","","1.089","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011089","7.0373","0.0007","10.0928","0.0011","13.1649","0.0013","103.225","0.008","105.45","0.012","103.76","0.009","831.68","0.17","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Aqua(5,6-dimethyl-1,10-phenanthroline)(glycolato)copper(II) nitrate","","- C16 H17 Cu N3 O7 -","- C16 H17 Cu N3 O7 -","- C32 H34 Cu2 N6 O14 -","2","1","DA1111","Medina, Gerardo; Gasque, Laura; Bernès, Sylvain","Aqua(5,6-dimethyl-1,10-phenanthroline-<i>N</i>,<i>N</i>')(glycolato-<i>O</i>,<i>O</i>')copper(II) nitrate","Acta Crystallographica Section C","2000","56","7","766","768","10.1107/S0108270100004777","","","0.71073","MoKα","","0.0429","0.0339","","","","0.0919","","","","","","1.054","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011090","7.5865","0.0009","11.8102","0.0014","12.2307","0.0015","78.612","0.003","84.519","0.002","77.17","0.002","1045.9","0.2","293","2","","","","","","","","","","6","P -1","-P 1","2","","Chloro-(1,5-bis(N-1-methylimidazole-2-methyl)-1,5-diazacyclooctane) cobalt(II) perchlorate","","- C16 H26 Cl2 Co N6 O4 -","- C16 H26 Cl2 Co N6 O4 -","- C32 H52 Cl4 Co2 N12 O8 -","2","1","DA1118","Du, Miao; Shang, Zhi-Liang; Xu, Qiang; Zhang, Ruo-Hua; Leng, Xue-Bing; Bu, Xian-He","[1,5-Bis(1-methyl-1<i>H</i>-imidazol-2-ylmethyl-κ<i>N</i>^3^)-1,5-diazacyclooctane-<i>N</i>,<i>N</i>']chlorocobalt(II) perchlorate","Acta Crystallographica Section C","2000","56","7","769","770","10.1107/S0108270100004789","","","0.71073","MoKα","","","0.0643","","","","0.163","","","","","","1.18","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011091","9.44","0.001","9.366","0.001","9.741","0.001","90","","101.69","0.01","90","","843.39","0.16","293","2","","","","","","","","","","4","P 1 21 1","P 2yb","4","","21α-fluoro-7-norvouacapane-17β,21α-lactone","","- C20 H25 F O3 -","- C20 H25 F O3 -","- C40 H50 F2 O6 -","2","1","DA1124","Ruggiero, Silvana Guilardi; Gambardella, Maria Teresa do Prado; Branco, Marcelo Cardoso; Demuner, Antonio Jacinto; Barbosa, Luis Claudio A.; Piló-Veloso, Dorila","21α-Fluoro-7-norvouacapane-17β,21α-lactone","Acta Crystallographica Section C","2000","56","7","868","869","10.1107/S0108270100004790","","","0.71073","MoKα","","0.048","0.035","","","","0.097","","","","","","1.111","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011092","8.0547","0.0011","17.378","0.002","17.919","0.003","90","","90","","90","","2508.2","0.6","273","2","273","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","6,7-Dihydrodibenz[e,g]azulen-8(5H)-one","","- C18 H14 O -","- C18 H14 O -","- C144 H112 O8 -","8","1","DE1128","Ajees, A. Abdul; Ponnuswamy, M. N.; Parthasarathy, S.; Huq, C. A. M. A.","6,7-Dihydrodibenzo[<i>e</i>,<i>g</i>]azulen-8(5<i>H</i>)-one and 12,13-dihydrobenzo[<i>e</i>]napth[2,1-<i>g</i>]azulen-14(11<i>H</i>)-one","Acta Crystallographica Section C","2000","56","7","824","826","10.1107/S0108270100003954","","","1.54184","CuKα","","0.059","0.036","","","","0.105","","","","","","1.033","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011093","11.8466","0.0012","12.489","0.0015","20.703","0.002","90","","90","","90","","3063.1","0.6","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","12,13-Dihydrobenzo[e]napth[2,1-g]azulen-14(11H)-one","","- C22 H16 O -","- C22 H16 O -","- C176 H128 O8 -","8","1","DE1128","Ajees, A. Abdul; Ponnuswamy, M. N.; Parthasarathy, S.; Huq, C. A. M. A.","6,7-Dihydrodibenzo[<i>e</i>,<i>g</i>]azulen-8(5<i>H</i>)-one and 12,13-dihydrobenzo[<i>e</i>]napth[2,1-<i>g</i>]azulen-14(11<i>H</i>)-one","Acta Crystallographica Section C","2000","56","7","824","826","10.1107/S0108270100003954","","","1.54184","CuKα","","0.058","0.037","","","","0.11","","","","","","1.033","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011094","14.7505","0.0009","5.7579","0.0003","24.941","0.002","90","","104.358","0.003","90","","2052.1","0.2","150","","150","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C12 H15 N O -","- C12 H15 N O -","- C96 H120 N8 O8 -","8","1","DE1130","Gerkin, Roger E.","(3<i>R</i>*,4<i>R</i>*)-3-Isopropyl-4-phenylazetidin-2-one at 150K","Acta Crystallographica Section C","2000","56","7","848","849","10.1107/S0108270100005874","","","0.71073","MoKα","","","0.042","","","","0.088","","","","","","1.95","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011095","32.1141","0.0006","10.3464","0.0002","6.579","0.0001","90","","94.679","0.001","90","","2178.69","0.07","291","","150","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C13 H14 O3 -","- C13 H14 O3 -","- C104 H112 O24 -","8","1","DE1131","Gerkin, Roger E.","4,8-Dimethoxy-1-naphthalenemethanol","Acta Crystallographica Section C","2000","56","7","846","847","10.1107/S0108270100005023","","","0.71073","MoKα","","","0.048","","","","0.126","","","","","","1.98","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011096","14.79","0.014","5.681","0.009","11.187","0.011","90","","90","","90","","940","2","293","","293","","","","","","","","","3","P n a 21","P 2c -2n","33","2-Aminofluorene","2-Aminofluorene","","- C13 H11 N -","- C13 H11 N -","- C52 H44 N4 -","4","1","DE1132","Steiner, Thomas","N—H···π hydrogen bonding in 2-aminofluorene","Acta Crystallographica Section C","2000","56","7","874","875","10.1107/S0108270100005035","","","0.71073","MoKα","","0.065","0.043","","","","0.128","","","","","","1.032","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011097","7.766","0.002","11.67","0.002","14.385","0.002","90","","90","","90","","1303.7","0.4","153","","153","","","","","","","","","4","P n m a","-P 2ac 2n","62","tetraethylammonium hydroxide tetrahydrate","tetraethylammonium hydroxide-water (1/4)","","- C8 H29 N O5 -","- C8 H29 N O5 -","- C32 H116 N4 O20 -","4","0.5","DE1137","Wiebcke, Michael; Felsche, Jürgen","NEt~4~OH·4H~2~O containing infinite hydroxide‒water ribbons","Acta Crystallographica Section C","2000","56","7","901","902","10.1107/S0108270100005886","","","0.71073","MoKα","","0.1324","0.0473","","","","0.1407","","","","","","0.93","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011098","7.856","0.007","5.963","0.005","14.94","0.011","90","","100.69","0.07","90","","687.7","1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","thiosalicylic acid","2-mercaptobenzoic acid","","- C7 H6 O2 S -","- C7 H6 O2 S -","- C28 H24 O8 S4 -","4","1","DE1138","Steiner, Thomas","S—H···S hydrogen-bond chain in thiosalicylic acid","Acta Crystallographica Section C","2000","56","7","876","877","10.1107/S0108270100005898","","","0.71073","MoKα","","0.081","0.0567","","","","0.171","","","","","","1.026","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011099","16.146","0.003","8.66","0.002","19.096","0.004","90","","93.74","0.03","90","","2664.4","1","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","verticine","cevane-3β,6α,20-triol ethanol hydrate","","- C56 H98 N2 O8 -","- C56 H98 N2 O8 -","- C112 H196 N4 O16 -","2","1","DE1140","Zhang, Jin-Nan; Lin, Ge; Ho, Yee-Ping; Li, Ping; Chow, Albert H. L.","Verticine ethanol hydrate (2/1/1)","Acta Crystallographica Section C","2000","56","7","907","909","10.1107/S010827010000264X","","","0.71073","MoKα","","0.053","0.05","","","","0.12","","","","","","1.124","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011100","7.177","0.002","42.67","0.002","5.09","0.002","90","","90","","90","","1558.8","0.8","296.2","","296.2","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","1,15-pentadecanediol","","","- C15 H32 O2 -","- C15 H32 O2 -","- C60 H128 O8 -","4","1","DE1141","Nakamura, Naotake; Uno, Kenjiro; Watanabe, Ryoji; Ikeya, Tatsuhiro; Ogawa, Yoshihiro","1,15-Pentadecanediol","Acta Crystallographica Section C","2000","56","7","903","904","10.1107/S0108270100006272","","","1.5418","CuKα","","0.0787","0.0487","","0.0658","","0.0582","","","1.387","","","1.516","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2011101","9.483","0.002","11.042","0.002","9.394","0.002","104.14","0.02","101.45","0.02","114.03","0.02","820.4","0.4","298","","298","","","","","","","","","2","P -1","-P 1","2","","3a,9a-trans-9,9a-trans-4,4-dimethyl-9- phenyl-2,3,3a,4,9,9a-hexahydrobenzo[f]indene","","- C21 H24 -","- C21 H24 -","- C42 H48 -","2","1","FG1579","Hashizume, Daisuke; Takashima, Naoki; Oikawa, Takashi; Ishii, Hideki; Niwa, Haruki; Iwasaki, Fujiko","2,3,3a,4,9,9a-Hexahydro-9-phenylbenzo[<i>f</i>]indene derivatives","Acta Crystallographica Section C","2000","56","7","827","829","10.1107/S0108270100004091","","","0.71073","MoKα","","0.077","0.046","","","","0.149","","","","","","1.025","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011102","9.0001","0.0008","19.287","0.002","8.9918","0.0008","96.654","0.008","101.494","0.007","97.908","0.008","1498.4","0.3","100","","100","","","","","","","","","3","P -1","-P 1","2","","3a,4-trans-3a,9a-cis-9,9a-trans-4-methoxy-9- phenyl-2,3,3a,4,9,9a-hexahydrobenzo[f]indene","","- C20 H22 O -","- C20 H22 O -","- C80 H88 O4 -","4","2","FG1579","Hashizume, Daisuke; Takashima, Naoki; Oikawa, Takashi; Ishii, Hideki; Niwa, Haruki; Iwasaki, Fujiko","2,3,3a,4,9,9a-Hexahydro-9-phenylbenzo[<i>f</i>]indene derivatives","Acta Crystallographica Section C","2000","56","7","827","829","10.1107/S0108270100004091","","","0.71073","MoKα","","0.062","0.042","","","","0.121","","","","","","1.04","","","","has coordinates,has Fobs","192292","2020-10-21","18:00:00",""
"2011103","9.044","0.003","10.665","0.002","17.879","0.005","90","","114.07","0.05","90","","1574.6","1","150","","150","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","μ-oxo-bis{oxo{2,2'-[propane-1,3-diylbis(nitrilomethylidyne)]diphenolato} rhenium(V)}","","- C34 H32 N4 O7 Re2 -","- C34 H32 N4 O7 Re2 -","- C68 H64 N8 O14 Re4 -","2","0.5","FG1587","Kooijman, Huub; Bommel, Kjeld J. C. van; Verboom, Willem; Reinhoudt, David N.; Kroon, Jan; Spek, Anthony L.","Polymorphs and pseudo-polymorphs of μ-oxo-bis{[<i>N</i>,<i>N</i>'-bis(salicylidene)propane-1,3-diamine]oxorhenium(V)}","Acta Crystallographica Section C","2000","56","7","749","757","10.1107/S0108270100004108","","","0.71073","MoKα","","0.037","0.032","","","","0.077","","","","","","1.075","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011104","12.634","0.003","12.832","0.003","19.406","0.004","90","","90","","90","","3146.1","1.2","150","","150","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","μ-oxo-bis{oxo{2,2'-[propane-1,3-diylbis(nitrilomethylidyne)]diphenolato} rhenium(V)}","","- C34 H32 N4 O7 Re2 -","- C34 H32 N4 O7 Re2 -","- C136 H128 N16 O28 Re8 -","4","0.5","FG1587","Kooijman, Huub; Bommel, Kjeld J. C. van; Verboom, Willem; Reinhoudt, David N.; Kroon, Jan; Spek, Anthony L.","Polymorphs and pseudo-polymorphs of μ-oxo-bis{[<i>N</i>,<i>N</i>'-bis(salicylidene)propane-1,3-diamine]oxorhenium(V)}","Acta Crystallographica Section C","2000","56","7","749","757","10.1107/S0108270100004108","","","0.71073","MoKα","","0.054","0.048","","","","0.112","","","","","","1.217","","","","has coordinates,has disorder,has Fobs","200213","2020-10-21","18:00:00",""
"2011105","10.137","0.01","18.733","0.015","16.131","0.011","90","","126.43","0.06","90","","2465","4","150","","150","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","μ-oxo-bis{oxo{2,2'-[propane-1,3-diylbis(nitrilomethylidyne)]diphenolato} rhenium(V)} chloroform solvate (1:4)","","- C38 H36 Cl12 N4 O7 Re2 -","- C38 H36 Cl12 N4 O7 Re2 -","- C76 H72 Cl24 N8 O14 Re4 -","2","0.5","FG1587","Kooijman, Huub; Bommel, Kjeld J. C. van; Verboom, Willem; Reinhoudt, David N.; Kroon, Jan; Spek, Anthony L.","Polymorphs and pseudo-polymorphs of μ-oxo-bis{[<i>N</i>,<i>N</i>'-bis(salicylidene)propane-1,3-diamine]oxorhenium(V)}","Acta Crystallographica Section C","2000","56","7","749","757","10.1107/S0108270100004108","","","0.71073","MoKα","","0.125","0.068","","","","0.185","","","","","","1.033","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011106","9.0223","0.0012","10.4856","0.0015","10.7375","0.0017","79.75","0.012","89.256","0.011","81.82","0.011","989.4","0.3","150","","150","","","","","","","","","6","P -1","-P 1","2","","μ-oxo-bis{oxo{2,2'-[propane-1,3-diylbis(nitrilomethylidyne)]diphenolato} rhenium(V)} chloroform solvate (1:2)","","- C36 H34 Cl6 N4 O7 Re2 -","- C36 H34 Cl6 N4 O7 Re2 -","- C36 H34 Cl6 N4 O7 Re2 -","1","0.5","FG1587","Kooijman, Huub; Bommel, Kjeld J. C. van; Verboom, Willem; Reinhoudt, David N.; Kroon, Jan; Spek, Anthony L.","Polymorphs and pseudo-polymorphs of μ-oxo-bis{[<i>N</i>,<i>N</i>'-bis(salicylidene)propane-1,3-diamine]oxorhenium(V)}","Acta Crystallographica Section C","2000","56","7","749","757","10.1107/S0108270100004108","","","0.71073","MoKα","","0.033","0.028","","","","0.07","","","","","","1.047","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011107","8.9642","0.0016","10.053","0.003","10.669","0.003","91.23","0.02","91.685","0.018","97.913","0.017","951.6","0.4","150","","150","","","","","","","","","6","P -1","-P 1","2","","μ-oxo-bis{oxo{2,2'-[propane-1,3-diylbis(nitrilomethylidyne)]diphenolato} rhenium(V)} dichloromethane solvate (1:2)","","- C36 H36 Cl4 N4 O7 Re2 -","- C36 H36 Cl4 N4 O7 Re2 -","- C36 H36 Cl4 N4 O7 Re2 -","1","0.5","FG1587","Kooijman, Huub; Bommel, Kjeld J. C. van; Verboom, Willem; Reinhoudt, David N.; Kroon, Jan; Spek, Anthony L.","Polymorphs and pseudo-polymorphs of μ-oxo-bis{[<i>N</i>,<i>N</i>'-bis(salicylidene)propane-1,3-diamine]oxorhenium(V)}","Acta Crystallographica Section C","2000","56","7","749","757","10.1107/S0108270100004108","","","0.71073","MoKα","","0.051","0.049","","","","0.137","","","","","","1.06","","","","has coordinates,has disorder,has Fobs","200214","2020-10-21","18:00:00",""
"2011108","10.1085","0.0008","11.2053","0.0008","14.0447","0.0007","90","","91.367","0.005","90","","1590.37","0.19","150","","150","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","μ-oxo-bis{oxo{2,2'-[propane-1,3-diylbis(nitrilomethylidyne)]diphenolato} rhenium(V)} hydrate (1:2)","","- C34 H36 N4 O9 Re2 -","- C34 H36 N4 O9 Re2 -","- C68 H72 N8 O18 Re4 -","2","0.5","FG1587","Kooijman, Huub; Bommel, Kjeld J. C. van; Verboom, Willem; Reinhoudt, David N.; Kroon, Jan; Spek, Anthony L.","Polymorphs and pseudo-polymorphs of μ-oxo-bis{[<i>N</i>,<i>N</i>'-bis(salicylidene)propane-1,3-diamine]oxorhenium(V)}","Acta Crystallographica Section C","2000","56","7","749","757","10.1107/S0108270100004108","","","0.71073","MoKα","","0.053","0.047","","","","0.101","","","","","","1.01","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011109","9.198","0.004","12.771","0.001","9.88","0.005","90","","113.09","0.02","90","","1067.6","0.7","295","2","295","2","","","","","","","","6","P 1 21 1","P 2yb","4","","cis(6,13-dimethyl-1,4,8,11-tetraazacyclotetradecan-6,13-diamine)nickel(II) perchlorate","","- C12 H30 Cl2 N6 Ni O8 -","- C12 H30 Cl2 N6 Ni O8 -","- C24 H60 Cl4 N12 Ni2 O16 -","2","1","FG1588","Bernhardt, Paul V.","Ni^II^ and Zn^II^ complexes of the hexadentate macrocyclic ligand <i>cis</i>-6,13-dimethyl-1,4,8,11-tetraazacyclotetradecane-6,13-diamine","Acta Crystallographica Section C","2000","56","7","744","746","10.1107/S0108270100003930","","","0.71073","MoKα","","0.046","0.0436","","","","0.1173","","","","","","1.084","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2011110","9.075","0.001","12.891","0.001","9.963","0.003","90","","112.438","0.009","90","","1077.3","0.4","295","2","295","2","","","","","","","","6","P 1 21 1","P 2yb","4","","cis(6,13-dimethyl-1,4,8,11-tetraazacyclotetradecan-6,13-diamine)zinc(II) perchlorate","","- C12 H30 Cl2 N6 O8 Zn -","- C12 H30 Cl2 N6 O8 Zn -","- C24 H60 Cl4 N12 O16 Zn2 -","2","1","FG1588","Bernhardt, Paul V.","Ni^II^ and Zn^II^ complexes of the hexadentate macrocyclic ligand <i>cis</i>-6,13-dimethyl-1,4,8,11-tetraazacyclotetradecane-6,13-diamine","Acta Crystallographica Section C","2000","56","7","744","746","10.1107/S0108270100003930","","","0.71073","MoKα","","0.1849","0.0596","","","","0.1745","","","","","","0.987","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2011111","9.7364","0.0005","10.2509","0.0005","10.9197","0.0006","106.141","0.0013","111.259","0.0014","107.593","0.002","871.17","0.08","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","trans-Bis(thioacetato-S)bis(triphenylphosphine-P)nickel(II)","","- C40 H36 Ni O2 P2 S2 -","- C40 H36 Ni O2 P2 S2 -","- C40 H36 Ni O2 P2 S2 -","1","0.5","FG1594","Deivaraj, Theivanayagam C.; Vittal, Jagadese J.","<i>trans</i>-Bis(thioacetato-<i>S</i>)bis(triphenylphosphine-<i>P</i>)nickel(II)","Acta Crystallographica Section C","2000","56","7","775","776","10.1107/S0108270100004893","","","0.71073","MoKα","","0.062","0.043","","","","0.106","","","","","","1.028","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011112","13.3126","0.0005","14.3251","0.0005","18.9767","0.0007","90","","95.819","0.003","90","","3600.3","0.2","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C41 H41 I N2 P2 -","- C41 H41 I N2 P2 -","- C164 H164 I4 N8 P8 -","4","1","FG1596","Ellis, Dianne D.; Spek, Anthony L.; Imhoff, Pieter; Elsevier, Cornelis J.","{[(<i>N</i>-Methyl-<i>p</i>-toluidino)diphenylphosphoranylidene]methyl}(<i>N</i>-methyl-<i>p</i>-toluidino)diphenylphosphonium iodide","Acta Crystallographica Section C","2000","56","7","836","837","10.1107/S0108270100004170","","","0.71073","MoKα","","0.0851","0.0471","","","","0.1208","","","","","","1.031","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011113","7.5837","0.0004","11.2598","0.0005","12.8491","0.0007","94.403","0.004","103.025","0.004","98.284","0.004","1051","0.1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C16 H25 Cl4 N O Te -","- C16 H25 Cl4 N O Te -","- C32 H50 Cl8 N2 O2 Te2 -","2","1","FG1599","Zukerman-Schpector, J.; Camillo, Robinson L.; Comasseto, João V.; Cunha, Rodrigo L. O. R.; Caracelli, I.","Benzyltriethylammonium 2,2,2,4-tetrachloro-2,5-dihydro-1,2λ^5^-oxatellurole","Acta Crystallographica Section C","2000","56","7","897","898","10.1107/S0108270100005515","","","0.71073","MoKα","","0.025","0.022","","","","0.059","","","","","","1.068","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011114","9.0197","0.0006","17.918","0.002","21.375","0.003","95.641","0.012","97.375","0.011","93.083","0.009","3401.6","0.7","143","2","143","2","","","","","","","","5","P -1","-P 1","2","","tetraallyl (2,2'-bipyridyl)-rac-3,3,7,7-tetramethyl-trans-5-palladatricyclo [4.1.0.0^2,4^]heptane-1,2,4,6-tetracarboxylate","","- C36 H40 N2 O8 Pd -","- C36 H40 N2 O8 Pd -","- C144 H160 N8 O32 Pd4 -","4","2","FG1601","Bats, Jan W.; Rivas Nass, Andreas; Hashmi, A. Stephen K.","Tetraallyl (2,2'-bipyridyl)-<i>rac</i>-3,3,7,7-tetramethyl-<i>trans</i>-5-palladatricyclo[4.1.0.0^2,^^4^]heptane-1,2,4,6-tetracarboxylate above and below the phase-transition temperature of 194K","Acta Crystallographica Section C","2000","56","7","814","817","10.1107/S0108270100006193","","","0.71073","MoKα","","0.079","0.0459","","","","0.1009","","","","","","1.212","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011115","8.9583","0.0008","11.3245","0.0018","17.906","0.003","83.438","0.016","88.482","0.014","72.118","0.016","1717.4","0.5","205","2","205","2","","","","","","","","5","P -1","-P 1","2","","tetraallyl (2,2'-bipyridyl)-rac-3,3,7,7-tetramethyl-trans-5-palladatricyclo [4.1.0.0^2,4^]heptane-1,2,4,6-tetracarboxylate","","- C36 H40 N2 O8 Pd -","- C36 H40 N2 O8 Pd -","- C72 H80 N4 O16 Pd2 -","2","1","FG1601","Bats, Jan W.; Rivas Nass, Andreas; Hashmi, A. Stephen K.","Tetraallyl (2,2'-bipyridyl)-<i>rac</i>-3,3,7,7-tetramethyl-<i>trans</i>-5-palladatricyclo[4.1.0.0^2,^^4^]heptane-1,2,4,6-tetracarboxylate above and below the phase-transition temperature of 194K","Acta Crystallographica Section C","2000","56","7","814","817","10.1107/S0108270100006193","","","0.71073","MoKα","","0.0585","0.0422","","","","0.1009","","","","","","1.306","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2011116","8.111","0.003","10.013","0.001","13.277","0.003","101.22","0.01","102.85","0.02","102.01","0.01","994.9","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","Pefloxacinium methanesulfonate 0.10 hydrate","4-(3-Carboxy-1-ethyl-6-fluoro-1,4-dihydro-4-oxo-7-quinolyl)-1- methylpiperazinium methanesulfonate 0.10 hydrate","","- C18 H24.2 F N3 O6.1 S -","- C18 H24.2 F N3 O6.1 S -","- C36 H48.4 F2 N6 O12.2 S2 -","2","1","FR1263","Parvez, Masood; Arayne, M. Saeed; Sultana, Najma; Siddiqi, Ahsan Zamir","Pefloxacinium methanesulfonate 0.10-hydrate","Acta Crystallographica Section C","2000","56","7","910","912","10.1107/S0108270100004340","","","1.54178","CuKα","","0.047","0.04","","","","0.111","","","","","","1.1","","","","has coordinates,has Fobs","194474","2020-10-21","18:00:00",""
"2011117","8.478","0.001","10.406","0.001","21.336","0.001","90","","95.701","0.009","90","","1873","0.3","296","","296","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","enol tautomer of 4-(phenylsulfonyl)-spiro[cyclopentane-1, 9'-[9H]fluorene]-2, 3- dione","","","- C23 H16 O4 S -","- C23 H16 O4 S -","- C92 H64 O16 S4 -","4","1","FR1267","Gerkin, Roger E.","Hydrogen bonds and C—H···O interactions in the enol tautomer of 4-(phenylsulfonyl)spiro[cyclopentane-1,9'-[9<i>H</i>]fluorene]-2,3-dione","Acta Crystallographica Section C","2000","56","7","843","845","10.1107/S0108270100004595","","","0.71073","MoKα","","","0.046","","","","0.083","","","","","","1.44","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011118","25.1353","0.0012","25.1353","0.0012","6.2139","0.0004","90","","90","","90","","3925.8","0.4","180","2","180","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","2,2-Dimethyl-3,4-dihydro-6-hydroxy-(2H)-benzo-(1,2-b)-pyran","","- C11 H14 O2 -","- C11 H14 O2 -","- C176 H224 O32 -","16","1","FR1268","Jha, Amitabh; Malhotra, Sanjay; Parmar, Virinder S.; Errington, William","6-Hydroxy-2,2-dimethyl-3,4-dihydro-2<i>H</i>-benzo[<i>b</i>]pyran","Acta Crystallographica Section C","2000","56","7","899","900","10.1107/S0108270100005813","","","0.71073","MoKα","","0.082","0.047","","","","0.115","","","","","","1.024","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011119","7.5402","0.0006","10.4339","0.0012","10.816","0.0011","113.796","0.008","91.867","0.008","103.108","0.009","750.92","0.14","296","","296","","","","","","","","","4","P -1","-P 1","2","3-Fluoro-2-[1-(1-naphthyl)ethyl]benzoic acid.","","","- C19 H15 F O2 -","- C19 H15 F O2 -","- C38 H30 F2 O4 -","2","1","FR1271","Gerkin, Roger E.","Hydrogen bonding and C—H···<i>X</i> interactions in 3-fluoro-2-[1-(1-naphthyl)ethyl]benzoic acid","Acta Crystallographica Section C","2000","56","7","850","852","10.1107/S0108270100005199","","","0.71073","MoKα","","","0.05","","","","0.067","","","","","","1.7","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011120","44.486","0.005","12.1755","0.0013","16.995","0.002","90","","108.958","0.002","90","","8705.8","1.7","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","11,12,24,25-Tetrahydro-28,34-dimethoxy-3,6,16,19,31,37-hexamethyl- 1,21[1',3']:8,14[1"",3""]-dibenzeno-10H,23H-tetrabenzo[f,h,o,z][1,5,10,14]- tetraoxacyclooctadecin]","","- C50 H50 Cl Li O7 -","- C50 H48 Cl Li O7 -","- C400 H384 Cl8 Li8 O56 -","8","1","FR1274","Helgeson, Roger C.; Knobler, Carolyn B.; Maverick, Emily F.; Trueblood, Kenneth N.; Deceased 7 May 1998","The lithium chloride complex of the <i>anti</i> isomer of the bridged spherand C~50~H~48~O~6~","Acta Crystallographica Section C","2000","56","7","795","797","10.1107/S0108270100005722","","","0.71073","MoKα","","","0.074","","","","0.241","","","","","","0.929","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2011121","11.3705","0.0002","9.7132","0.0002","19.0382","0.0003","90","","90","","90","","2102.65","0.07","150","","150","","","","","","","","","3","P b c a","-P 2ac 2ab","61","2-(2-methylbenzyl)malonic acid","","","- C11 H12 O4 -","- C11 H12 O4 -","- C88 H96 O32 -","8","1","FR1275","Gerkin, Roger E.","Hydrogen bonds and C—H···O interactions in 2-(2-methylbenzyl)malonic acid at 150K","Acta Crystallographica Section C","2000","56","7","853","854","10.1107/S0108270100006235","","","0.71073","MoKα","","","0.048","","","","0.085","","","","","","1.97","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011122","8.087","0.001","11.354","0.002","6.622","0.002","101.15","0.02","96.64","0.02","102.79","0.01","573.7","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","0.5C6 H18 N2 2+, As2 H5 O10 Zn2 1-","N,N,N',N'-tetramethylethylenediammonium (arsenate)diaqua(hydrogen arsenate)dizinc(II)","","- C3 H14 As2 N O10 Zn2 -","- C3 H14 As2 N O10 Zn2 -","- C6 H28 As4 N2 O20 Zn4 -","2","1","GD1075","Hajem, Amen Allah; Trojette, Basma; Driss, Ahmed; Jouini, Tahar","Layered zincoarsenate templated by <i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylethylene-diamine molecules","Acta Crystallographica Section C","2000","56","7","793","794","10.1107/S0108270100005370","","","0.71069","MoKα","","0.03","0.027","","","","0.077","","","","","","1.12","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011123","5.2281","0.0007","5.5511","0.0007","12.009","0.001","94.59","0.01","90.36","0.01","94.91","0.01","346.1","0.07","85","2","85","2","","","","","","","","5","P -1","-P 1","2","","Lithium phosphoenolpyruvate monohydrate","","- C3 H6 Li O7 P -","- C3 H6 Li O7 P -","- C6 H12 Li2 O14 P2 -","2","1","GD1096","Zych, Tomasz; Turowska-Tyrk, Ilona; Lis, Tadeusz","Lithium phosphoenolpyruvate monohydrate at 85K","Acta Crystallographica Section C","2000","56","7","818","819","10.1107/S010827010000620X","","","0.71073","MoKα","","0.039","0.026","","0.085","","0.079","","","1.16","","","1.2","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011124","7.8655","0.0002","14.8464","0.0004","16.4602","0.0004","108.059","0.0014","102.035","0.0014","90.0908","0.0014","1782.73","0.08","150","2","150","2","","","","","","","","5","P -1","-P 1","2","Bis(1,1-dimethyl-3-oxobutyl)diiodostannane","Diiodobis(4-methylpentan-2-onato-C^4^,O)tin(IV)","","- C12 H22 I2 O2 Sn -","- C12 H22 I2 O2 Sn -","- C48 H88 I8 O8 Sn4 -","4","2","GD1099","Howie, R. Alan; Wardell, James L.","Diiodobis(4-methylpentan-2-onato-<i>C</i>^4^,<i>O</i>)tin(IV): a comparison with diiodobis(3-methoxy-3-oxopropyl-<i>C</i>,<i>O</i>)tin(IV)","Acta Crystallographica Section C","2000","56","7","806","807","10.1107/S0108270100005989","","","0.71073","MoKα","","0.066","0.042","","","","0.1","","","","","","0.998","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011125","7.3994","0.0003","9.9179","0.0004","11.3987","0.0006","83.841","0.002","82.063","0.002","79.433","0.003","811.56","0.06","100","1","100","1","","","","","","","","4","P -1","-P 1","2","","meso-6,13-Diamino-6,13-dimethyl-1,4,8,11- tetraazacyclotetradecane‒2,2'-biphenol (1/2)","","- C36 H50 N6 O4 -","- C36 H50 N6 O4 -","- C36 H50 N6 O4 -","1","0.5","GG1003","Lough, Alan J.; Gregson, Richard M.; Ferguson, George; Glidewell, Christopher","Chains of fused rings in the hydrogen-bonded structure of <i>meso</i>-6,13-diamino-6,13-dimethyl-1,4,8,11-tetraazacyclotetradecane‒2,2'-biphenol (1/2)","Acta Crystallographica Section C","2000","56","7","859","861","10.1107/S0108270100005527","","","0.71073","MoKα","","0.063","0.0452","","","","0.1169","","","","","","1.045","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011126","5.4859","0.0002","6.9595","0.0004","12.5211","0.0007","98.6245","0.0017","93.561","0.004","92.174","0.003","471.19","0.04","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","1,4-bis(4-chlorophenylsulfonyl)-2,5-dimethylbenzene","","- C20 H16 Cl2 O4 S2 -","- C20 H16 Cl2 O4 S2 -","- C20 H16 Cl2 O4 S2 -","1","0.5","GG1006","Wardell, James L; Low, John N; Glidewell, Christopher","Hydrogen-bonded molecular ladders in 1,4-bis(4-chlorophenylsulfonyl)-2,5-dimethylbenzene","Acta Crystallographica Section C","2000","56","7","862","864","10.1107/S0108270100005928","","","0.71073","MoKα","","0.055","0.039","","","","0.104","","","","","","1.073","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011127","20.893","0.003","9.01","0.002","33.399","0.005","90","","91.04","0.01","90","","6286.2","1.9","203","2","203","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","nonacarbonyl-1κ^3^C,2κ^3^C,3κ^3^C-dicyclohexylphosphine-3κP-μ-hydrido- 1:2κ^2^H-μ-phenylthio-1:2κ^2^S-triangulo-triosmium","","- C27 H29 O9 Os3 P S -","- C27 H29 O9 Os3 P S -","- C216 H232 O72 Os24 P8 S8 -","8","1","GS1077","Flörke, Ulrich; Egold, Hans; Schraa, Markus","Hydrido-sulfido-bridged triangular Os~3~ cluster compounds with different phosphine ligand substitution patterns","Acta Crystallographica Section C","2000","56","7","760","762","10.1107/S0108270100004571","","","0.71073","MoKα","","0.103","0.045","","","","0.077","","","","","","0.924","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011128","10.214","0.002","12.997","0.002","14.409","0.001","69.16","0.01","80.58","0.01","76.62","0.01","1732.2","0.5","203","2","203","2","","","","","","","","6","P -1","-P 1","2","","nonacarbonyl-1κ^3^C,2κ^2^C,3κ^4^C-dicyclohexylphosphine-2κP-μ-hydrido- 1:2κ^2^H-μ-(2-naphthylthio)-1:2κ^2^S-triangulo-triosmium","","- C31 H31 O9 Os3 P S -","- C31 H31 O9 Os3 P S -","- C62 H62 O18 Os6 P2 S2 -","2","1","GS1077","Flörke, Ulrich; Egold, Hans; Schraa, Markus","Hydrido-sulfido-bridged triangular Os~3~ cluster compounds with different phosphine ligand substitution patterns","Acta Crystallographica Section C","2000","56","7","760","762","10.1107/S0108270100004571","","","0.71073","MoKα","","0.057","0.04","","","","0.104","","","","","","1.029","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011129","7.8295","0.0006","19.3334","0.0018","8.1244","0.001","90","","116.019","0.008","90","","1105.2","0.2","293","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C22 H22 N4 Ni O4 -","- C22 H22 N4 Ni O4 -","- C44 H44 N8 Ni2 O8 -","2","0.5","GS1082","Zukerman-Schpector, J.; Trindade, Antonio Carlos; Dunstan, P. O.","Adducts of nickel(II) acetylacetonate chelating with heterocyclic bases: 3-cyanopyridine and 4-cyanopyridine","Acta Crystallographica Section C","2000","56","7","763","765","10.1107/S0108270100004662","","","0.71073","MoKα","","0.201","0.045","","","","0.115","","","","","","0.953","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011130","6.2795","0.0006","9.912","0.001","10.392","0.001","64.96","0.01","86.441","0.008","73.333","0.009","560.1","0.11","293","2","","","","","","","","","","5","P -1","-P 1","2","","","","- C22 H22 N4 Ni O4 -","- C22 H22 N4 Ni O4 -","- C22 H22 N4 Ni O4 -","1","0.5","GS1082","Zukerman-Schpector, J.; Trindade, Antonio Carlos; Dunstan, P. O.","Adducts of nickel(II) acetylacetonate chelating with heterocyclic bases: 3-cyanopyridine and 4-cyanopyridine","Acta Crystallographica Section C","2000","56","7","763","765","10.1107/S0108270100004662","","","0.71073","MoKα","","0.076","0.035","","","","0.084","","","","","","1.055","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011131","18.4434","0.0014","6.859","0.0005","11.5334","0.0009","90","","107.488","0.002","90","","1391.58","0.18","160","2","160","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","9,10-diacetylanthracene","","- C18 H14 O4 -","- C18 H14 O4 -","- C72 H56 O16 -","4","1","GS1083","Jones, Simon; .; Atherton, J. C. Christian; Elsegood, Mark R. J.; Clegg, William","Dimethyl 9,10-anthracenedicarboxylate: a centrosymmetric <i>transoid</i> molecule","Acta Crystallographica Section C","2000","56","7","881","883","10.1107/S0108270100004972","","","0.71073","MoKα","","0.0452","0.0375","","","","0.1047","","","","","","1.064","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011132","8.845","0.002","9.931","0.002","27.325","0.005","90","","90","","90","","2400.2","0.8","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","methyl {1-[2,3-O-isopropylidene-5-O-(4-nitrobenzoyl)-α-D- ribofuranosyl]-4-methoxycarbonyl-1,2,3-triazol-5-yl} acetate","","- C22 H24 N4 O11 -","- C22 H24 N4 O11 -","- C88 H96 N16 O44 -","4","1","JZ1388","Leban, Ivan; Štimac, Anton; Kobe, Jože; Giester, Gerald","Methyl {1-[2,3-<i>O</i>-isopropylidene-5-<i>O</i>-(4-nitrobenzoyl)-α-<small>D</small>-ribofuranosyl]-4-methoxycarbonyl-1<i>H</i>-1,2,3-triazol-5-yl}acetate","Acta Crystallographica Section C","2000","56","7","890","891","10.1107/S0108270100005394","","","0.71073","MoKα","","0.0557","0.0491","","","","0.1221","","","","","","1.088","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011133","17.635","0.005","8.418","0.002","22.591","0.005","90","","100.5","0.03","90","","3297.5","1.5","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","(3R*,3'R*)-1,1'-Dimethyl-3,3'-biindoline-2,2'-dithione","","- C18 H16 N2 S2 -","- C18 H16 N2 S2 -","- C144 H128 N16 S16 -","8","1","JZ1394","Baumeister, Ute; Hartung, Helmut; Spitzner, Roland; Felicetti, Michael; Schroth, Werner","(3<i>R</i>*,3'<i>R</i>*)-1,1'-Dimethyl-3,3'-biindoline-2,2'-dithione","Acta Crystallographica Section C","2000","56","7","830","831","10.1107/S0108270100004194","","","0.71073","MoKα","","0.1","0.042","","","","0.106","","","","","","0.991","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011134","11.543","0.002","13.996","0.005","9.918","0.0007","90","","90","","90","","1602.3","0.6","293","2","293","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","bis[iodo(1-methyl-1,3-imidazolium-2-thiolato-S)]mercury(II)","","- C8 H12 Hg I2 N4 S2 -","- C8 H12 Hg I2 N4 S2 -","- C32 H48 Hg4 I8 N16 S8 -","4","1","JZ1398","Pavlović, Gordana; Popović, Zora; Soldin, Željka; Matković-Čalogović, Dubravka","Diiodobis(1-methyl-1,3-imidazolium-2-thiolato-<i>S</i>)mercury(II)","Acta Crystallographica Section C","2000","56","7","801","803","10.1107/S0108270100005825","","","0.71073","MoKα","","0.064","0.043","","","","0.116","","","","","","1.023","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011135","9.168","0.002","15.111","0.003","13.962","0.003","90","","101.98","0.02","90","","1892.1","0.7","304","2","304","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-(1,3-Benzimidazol-2-io)-6-(1,3-benzimidazol-2-yl)pyridine perchlorate monohydrate","","- C19 H16 Cl N5 O5 -","- C19 H16 Cl N5 O5 -","- C76 H64 Cl4 N20 O20 -","4","1","LN1095","Boča, Miroslav; Valigura, Dušan; Svoboda, Ingrid; Fuess, Hartmut; Linert, Wolfgang","2-[6-(1<i>H</i>-Benzimidazol-2-yl)-2-pyridyl]-1<i>H</i>-benzimidazol-3-ium perchlorate monohydrate","Acta Crystallographica Section C","2000","56","7","838","839","10.1107/S0108270100004376","","","0.71093","MoKα","","0.063","0.041","","","","0.125","","","","","","1.023","","","","has coordinates,has disorder","176760","2020-10-21","18:00:00",""
"2011136","9.8389","0.0003","11.2975","0.0005","14.234","0.0005","90","","100.988","0.002","90","","1553.17","0.1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H8 Cu N8 -","- C16 H8 Cu N8 -","- C64 H32 Cu4 N32 -","4","1","LN1104","Wang, Zhe-Ming; Luo, Jun; Sun, Bai-Wang; Yan, Chun-Hua; Gao, Song; Liao, Chun-Sheng","<i>catena</i>-Poly[[dicyanamido(1,10-phenanthroline)copper(II)]-μ-dicyanamido]","Acta Crystallographica Section C","2000","56","7","786","788","10.1107/S0108270100004984","","","0.71073","MoKα","","0.0773","0.0439","","","","0.1203","","","","","","1.015","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011137","9.192","0.002","10.726","0.004","10.904","0.002","61.3","0.03","70.01","0.02","87.69","0.03","876.1","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H40 N12 O8 Zn2 -","- C28 H40 N12 O8 Zn2 -","- C28 H40 N12 O8 Zn2 -","1","0.5","NA1444","Tomić, Zoran D.; Jaćimović, Željko K.; Leovac, Vukadin M.; Češljević, Valeria I.","Transition metal complexes with pyrazole-derived ligands. XI. [Zn(μ-<i>L</i>)(H<i>L</i>)(OAc)]~2~ (H<i>L</i> is 4-acetyl-3-amino-5-methylpyrazole)","Acta Crystallographica Section C","2000","56","7","777","779","10.1107/S0108270100004881","","","0.71073","MoKα","","0.062","0.042","","0.104","","0.098","","","","","","1.017","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011138","18.17","0.004","10.53","0.003","6.972","0.002","90","","90","","90","","1334","0.6","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Lena-3h","","","- C11 H13 N5 O5 -","- C11 H13 N5 O5 -","- C44 H52 N20 O20 -","4","1","NA1458","Taycher, Hellena; Shteiman, Vitaly; Botoshansky, Mark; Kaftory, Menahem","3,5-Dimethyl-6-(4-nitroanilino)-2,3,4,5-tetrahydro-1,3,5-triazine-2,4-dione, (II), 3,5-dimethyl-6-(<i>N</i>-methyl-4-nitroanilino)-2,3,4,5-tetrahydro-1,3,5-triazine-2,4-dione, (III), and 1,3,5-trimethyl-6-(4-nitrophenylimino)-1,3,5-triazinane-2,4-dione, (IV)","Acta Crystallographica Section C","2000","56","7","832","835","10.1107/S0108270100004303","","","0.71069","MoKα","","0.0676","0.0487","","","","0.1297","","","","","","1.194","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011139","11.333","0.0012","16.025","0.0014","7.162","0.0007","90","","95.587","0.005","90","","1294.5","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Lena-3b","","","- C12 H13 N5 O4 -","- C12 H13 N5 O4 -","- C48 H52 N20 O16 -","4","1","NA1458","Taycher, Hellena; Shteiman, Vitaly; Botoshansky, Mark; Kaftory, Menahem","3,5-Dimethyl-6-(4-nitroanilino)-2,3,4,5-tetrahydro-1,3,5-triazine-2,4-dione, (II), 3,5-dimethyl-6-(<i>N</i>-methyl-4-nitroanilino)-2,3,4,5-tetrahydro-1,3,5-triazine-2,4-dione, (III), and 1,3,5-trimethyl-6-(4-nitrophenylimino)-1,3,5-triazinane-2,4-dione, (IV)","Acta Crystallographica Section C","2000","56","7","832","835","10.1107/S0108270100004303","","","0.7107","MoKα","","0.1106","0.0482","","","","0.1406","","","","","","0.734","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011140","8.253","0.006","8.493","0.003","10.084","0.002","78.79","","88.52","","74.95","","669.3","0.6","293","2","293","2","","","","","","","","4","P -1","-P 1","2","Lenaa3","2-(4'-nitrophenylimino)-1,3,5-trimethyl-1,3,5-triazine-4,6,-dione","","- C12 H13 N5 O4 -","- C12 H13 N5 O4 -","- C24 H26 N10 O8 -","2","1","NA1458","Taycher, Hellena; Shteiman, Vitaly; Botoshansky, Mark; Kaftory, Menahem","3,5-Dimethyl-6-(4-nitroanilino)-2,3,4,5-tetrahydro-1,3,5-triazine-2,4-dione, (II), 3,5-dimethyl-6-(<i>N</i>-methyl-4-nitroanilino)-2,3,4,5-tetrahydro-1,3,5-triazine-2,4-dione, (III), and 1,3,5-trimethyl-6-(4-nitrophenylimino)-1,3,5-triazinane-2,4-dione, (IV)","Acta Crystallographica Section C","2000","56","7","832","835","10.1107/S0108270100004303","","","0.71093","MoKα","","0.0644","0.0484","","","","0.1442","","","","","","0.907","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011141","11.127","0.0006","9.195","0.0009","13.094","0.0011","90","","101.264","0.005","90","","1313.88","0.19","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Lenac3","2-(4'-nitrophenylimino)-1,3,5-trimethyl-1,3,5-triazine-4,6,-dione","","- C12 H13 N5 O4 -","- C12 H13 N5 O4 -","- C48 H52 N20 O16 -","4","1","NA1458","Taycher, Hellena; Shteiman, Vitaly; Botoshansky, Mark; Kaftory, Menahem","3,5-Dimethyl-6-(4-nitroanilino)-2,3,4,5-tetrahydro-1,3,5-triazine-2,4-dione, (II), 3,5-dimethyl-6-(<i>N</i>-methyl-4-nitroanilino)-2,3,4,5-tetrahydro-1,3,5-triazine-2,4-dione, (III), and 1,3,5-trimethyl-6-(4-nitrophenylimino)-1,3,5-triazinane-2,4-dione, (IV)","Acta Crystallographica Section C","2000","56","7","832","835","10.1107/S0108270100004303","","","0.7107","MoKα","","0.0747","0.0502","","","","0.1423","","","","","","1.049","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011142","20.3597","0.0007","9.94","0.0003","12.0064","0.0004","90","","112.336","0.001","90","","2247.5","0.13","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(2-aminopyridine-N)zinc dibenzoate","","- C24 H22 N4 O4 Zn -","- C24 H22 N4 O4 Zn -","- C96 H88 N16 O16 Zn4 -","4","0.5","NA1461","Shanmuga Sundara Raj, S.; Fun, Hoong-Kun; Zhao, Pu-Su; Jian, Fang-Fang; Lu, Lu-De; Yang, Xu-Jie; Wang, Xin","Bis(2-aminopyridine-<i>N</i>)bis(benzoato-<i>O</i>)zinc","Acta Crystallographica Section C","2000","56","7","742","743","10.1107/S0108270100003462","","","0.71073","MoKα","","0.087","0.061","","","","0.111","","","","","","1.108","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011143","5.9217","0.0008","15.3265","0.0015","15.9824","0.0014","90","","95.188","0.01","90","","1444.6","0.3","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","4-Phenyl-3,5-bis(2-pyridyl)-4H-1,2,4-triazole","","- C18 H13 N5 -","- C18 H13 N5 -","- C72 H52 N20 -","4","1","NA1465","Zhu, Dun-Ru; Xu, Yan; Zhang, Yong; Wang, Tian-Wei; You, Xiao-Zeng","4-Phenyl-3,5-bis(2-pyridyl)-4<i>H</i>-1,2,4-triazole","Acta Crystallographica Section C","2000","56","7","895","896","10.1107/S0108270100005473","","","0.71073","MoKα","","0.071","0.042","","","","0.109","","","","","","1.006","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011144","11.225","0.003","10.951","0.001","8.43","0.002","90","","103.5","0.01","90","","1007.6","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,1,3,3-tetramethyl guanidinium phosphate","","- C5 H16 N3 O4 P -","- C5 H16 N3 O4 P -","- C20 H64 N12 O16 P4 -","4","1","NA1466","Criado, A.; Diánez, M.J.; Pérez-Garrido, S.; Fernandes, I. M. L.; Belsley, M.; de Matos Gomes, E.","1,1,3,3-Tetramethylguanidinium dihydrogenorthophosphate","Acta Crystallographica Section C","2000","56","7","888","889","10.1107/S0108270100005187","","","0.71069","MoKα","","0.0403","0.0338","","0.1052","0.1012","","","","1.08","1.121","1.121","","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011145","7.146","0.002","19.751","0.004","7.408","0.001","90","","106.12","0.02","90","","1004.5","0.4","294","2","294","2","","","","","","","","4","I 1 a 1","I -2ya","9","","7-Chloro-3,6-dimethyl-1H-indene-2-carbaldehyde","","- C12 H11 Cl O -","- C12 H11 Cl O -","- C48 H44 Cl4 O4 -","4","1","NA1467","Pani, Marcella; Mugnoli, Angelo; Sottofattori, Enzo","7-Chloro-3,6-dimethyl-1<i>H</i>-indene-2-carbaldehyde","Acta Crystallographica Section C","2000","56","7","840","842","10.1107/S010827010000442X","","","0.7107","MoKα","","0.0407","0.0382","","","","0.0951","","","","","","1.071","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011146","8.641","0.003","11.6","0.003","8.046","0.001","92.11","","103.77","0.03","92.06","","782","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Tri-aqua(zinc(II) 1,10-phenanthroline sulfate), hydrate","","- C12 H16 N2 O8 S Zn -","- C12 H16 N2 O8 S Zn -","- C24 H32 N4 O16 S2 Zn2 -","2","1","NA1468","Harvey, Miguel; Baggio, Sergio; Mombrú, Alvaro; Baggio, Ricardo; Tri-aqua(zinc(II) 1,10-phenanthroline sulfate), hydrate","Three new Zn^II^ sulfate complexes","Acta Crystallographica Section C","2000","56","7","771","774","10.1107/S0108270100004753","","","0.71073","MoKα","","0.034","0.032","","","","0.09","","","","","","1.034","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011147","8.8044","0.0015","10.4281","0.0013","8.7719","0.0012","103.738","0.012","99.385","0.014","113.357","0.011","687.7","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Bis(zinc(II) 2,9-dimethyl-1,10-phenanthroline sulfate)","","- C28 H24 N4 O8 S2 Zn2 -","- C28 H24 N4 O8 S2 Zn2 -","- C28 H24 N4 O8 S2 Zn2 -","1","0.5","NA1468","Harvey, Miguel; Baggio, Sergio; Mombrú, Alvaro; Baggio, Ricardo; Bis(zinc(II) 2,9-dimethyl-1,10-phenanthroline sulfate)","Three new Zn^II^ sulfate complexes","Acta Crystallographica Section C","2000","56","7","771","774","10.1107/S0108270100004753","","","0.7107","MoKα","","0.035","0.033","","","","0.096","","","","","","1.077","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011148","15.421","0.003","12.701","0.003","6.694","0.001","90","","102.13","0.03","90","","1281.8","0.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Di-aqua(zinc(II) bipyridil sulfate)","","- C10 H12 N2 O6 S Zn -","- C10 H12 N2 O6 S Zn -","- C40 H48 N8 O24 S4 Zn4 -","4","0.5","NA1468","Harvey, Miguel; Baggio, Sergio; Mombrú, Alvaro; Baggio, Ricardo","Three new Zn^II^ sulfate complexes","Acta Crystallographica Section C","2000","56","7","771","774","10.1107/S0108270100004753","","","0.71073","MoKα","","0.056","0.029","","","","0.085","","","","","","1.018","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011149","19.7025","0.0009","7.766","0.002","16.7929","0.0006","90","","90","","90","","2569.5","0.7","293","2","293","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","triethylammonium cis-tetrachlorodi(4-ethylpyridine)molybdenum(III)","","- C20 H34 Cl4 Mo N3 -","- C20 H34 Cl4 Mo N3 -","- C80 H136 Cl16 Mo4 N12 -","4","1","NA1469","Modec, Barbara; Brenčič, Jurij V.; Golič, Ljubo","A 4-ethylpyridine complex of tetrachloromolybdenum(III) and its oxidation product","Acta Crystallographica Section C","2000","56","7","780","782","10.1107/S0108270100004911","","","0.71073","MoKα","","0.047","0.029","","","","0.059","","","","","","1.027","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011150","16.1077","0.0008","7.6691","0.0004","7.1566","0.0004","90","","98.012","0.004","90","","875.44","0.08","293","","293","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","trans-tetrachlorodi(4-ethylpyridine)molybdenum(IV)","","- C14 H18 Cl4 Mo N2 -","- C14 H18 Cl4 Mo N2 -","- C28 H36 Cl8 Mo2 N4 -","2","0.25","NA1469","Modec, Barbara; Brenčič, Jurij V.; Golič, Ljubo","A 4-ethylpyridine complex of tetrachloromolybdenum(III) and its oxidation product","Acta Crystallographica Section C","2000","56","7","780","782","10.1107/S0108270100004911","","","0.71073","MoKα","","0.029","0.017","","","","0.028","","","1.317","","","1.005","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2011151","10.878","0.002","11.598","0.003","17.077","0.002","73.19","0.02","81.944","0.019","66.91","0.02","1896.3","0.7","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C80 H108 O6 Sn4 -","- C80 H108 O6 Sn4 -","- C80 H108 O6 Sn4 -","1","0.5","NA1470","Reuter, Hans; Pawlak, Rüdiger","Hydrolysis products of diorganotin dihalides. I. Bis[1,3-dihydroxo-1,1,3,3-tetrakis(2-methyl-2-phenylpropyl)distannoxane]","Acta Crystallographica Section C","2000","56","7","804","805","10.1107/S0108270100006016","","","0.71073","MoKα","","0.039","0.028","","","","0.072","","","","","","1.029","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011152","8.1698","0.0004","14.3745","0.0007","14.9238","0.0008","90","","99.649","0.001","90","","1727.81","0.15","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","cis-Dichloro(5,8-dioxa-2,11-dithia[12]-o-cyclophane)palladium(II)","","- C14 H20 Cl2 O2 Pd S2 -","- C14 H20 Cl2 O2 Pd S2 -","- C56 H80 Cl8 O8 Pd4 S8 -","4","1","OA1097","Yoon, Il; Yoo, Byeong Soon; Lee, Shim Sung; Kim, Bong Gon","<i>cis</i>-Dichloro(5,8-dioxa-2,11-dithia[12]-<i>o</i>-cyclophane)palladium(II)","Acta Crystallographica Section C","2000","56","7","758","759","10.1107/S0108270100004364","","","0.71073","MoKα","","0.0353","0.0317","","","","0.0817","","","","","","1.05","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011153","21.004","0.005","13.061","0.003","14.441","0.004","90","","98.266","0.011","90","","3920.5","1.7","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","4,5-Bis(4-methoxyphenyl)-2-(3-nitrophenyl)-1H-imidazole","","- C23 H19 N3 O4 -","- C23 H19 N3 O4 -","- C184 H152 N24 O32 -","8","2","OA1099","Inouye, Yoshinobu; Sakaino, Yoshiko","Red, orange and yellow crystals of 4,5-bis(4-methoxyphenyl)-2-(3-nitrophenyl)-1<i>H</i>-imidazole","Acta Crystallographica Section C","2000","56","7","884","887","10.1107/S0108270100005205","","","0.71073","MoKα","","0.346","0.0864","","0.3798","","0.2213","","","0.92","","","1.067","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2011154","15.331","0.003","18.419","0.003","8.8318","0.0014","90","","97.401","0.008","90","","2473.2","0.7","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4,5-Bis(4-methoxyphenyl)-2-(3-nitrophenyl)-1H-imidazole t-butanol solvate","","- C27 H29 N3 O5 -","- C27 H29 N3 O5 -","- C108 H116 N12 O20 -","4","1","OA1099","Inouye, Yoshinobu; Sakaino, Yoshiko","Red, orange and yellow crystals of 4,5-bis(4-methoxyphenyl)-2-(3-nitrophenyl)-1<i>H</i>-imidazole","Acta Crystallographica Section C","2000","56","7","884","887","10.1107/S0108270100005205","","","0.71073","MoKα","","0.1886","0.064","","0.3018","","0.1928","","","0.893","","","0.869","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011155","9.51","0.002","13.236","0.004","9.168","0.002","104.651","0.013","92.624","0.015","85.83","0.02","1113.1","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","4,5-Bis(4-methoxyphenyl)-2-(3-nitrophenyl)-1H-imidazole 0.5-dioxane solvate","","- C25 H23 N3 O5 -","- C25 H23 N3 O5 -","- C50 H46 N6 O10 -","2","1","OA1099","Inouye, Yoshinobu; Sakaino, Yoshiko","Red, orange and yellow crystals of 4,5-bis(4-methoxyphenyl)-2-(3-nitrophenyl)-1<i>H</i>-imidazole","Acta Crystallographica Section C","2000","56","7","884","887","10.1107/S0108270100005205","","","0.71073","MoKα","","0.1035","0.0535","","0.1688","","0.1386","","","1.002","","","1.061","","","","has coordinates,has disorder","176760","2020-10-21","18:00:00",""
"2011156","9.614","0.002","29.011","0.005","8.984","0.002","90","","91.933","0.01","90","","2504.3","0.9","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4,5-Bis(4-methoxyphenyl)-2-(3-nitrophenyl)-1H-imidazole benzene solvate","","- C29 H25 N3 O4 -","- C29 H25 N3 O4 -","- C116 H100 N12 O16 -","4","1","OA1099","Inouye, Yoshinobu; Sakaino, Yoshiko","Red, orange and yellow crystals of 4,5-bis(4-methoxyphenyl)-2-(3-nitrophenyl)-1<i>H</i>-imidazole","Acta Crystallographica Section C","2000","56","7","884","887","10.1107/S0108270100005205","","","0.71073","MoKα","","0.1735","0.0638","","0.3171","","0.1907","","","0.88","","","0.941","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2011157","7.1543","0.0007","9.9408","0.0011","12.946","0.001","90","","90","","90","","920.71","0.15","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","K2 Ti Si3 O9, H2O","dipotassium titanium trisilicate hydrate","","- H2 K2 O10 Si3 Ti -","- H2 K2 O10 Si3 Ti -","- H8 K8 O40 Si12 Ti4 -","4","1","OS1103","Zou, Xiaodong; Dadachov, Mike S.","K~2~TiSi~3~O~9~·H~2~O","Acta Crystallographica Section C","2000","56","7","738","739","10.1107/S010827010000545X","","","0.71073","MoKα","","0.036","0.029","","","","0.068","","","","","","0.993","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011158","9.2007","0.0009","12.2973","0.0017","30.421","0.003","90","","93.26","0.012","90","","3436.4","0.7","213","2","213","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C36 H30 Cl2 O6 P2 Pd -","- C36 H30 Cl2 O6 P2 Pd -","- C144 H120 Cl8 O24 P8 Pd4 -","4","1","QA0303","Sabounchei, S. J.; Naghipour, A.; Bickley, Jamie F.","<i>cis</i>-Dichlorobis(triphenyphosphite-<i>P</i>)palladium(II)","Acta Crystallographica Section C","2000","56","7","e280","e280","10.1107/S0108270100007642","","","0.71073","MoKα","","0.082","0.044","","","","0.107","","","","","","0.861","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011159","19.0603","0.0005","16.596","0.0004","15.4192","0.0003","90","","90","","90","","4877.5","0.2","100","1","100","1","","","","","","","","7","A b a 2","A 2 -2ab","41","","Bis(acetonitrile-N)(o-benzoquinone diimine-N,N')-trans-bis(triphenyl- phosphine-P)ruthenium(II) hexafluorophosphate methanol solvate","","- C47 H46 F12 N4 O P4 Ru -","- C47 H46 F12 N4 O P4 Ru -","- C188 H184 F48 N16 O4 P16 Ru4 -","4","","QA0305","Venegas-Yazigi, Diego; Mirza, Hameed; Lever, A. B. P.; Lough, Alan J.; Costamagna, Juan; Latorre, Ramón","Bis(acetonitrile-<i>N</i>)(<i>o</i>-benzoquinone diimine-<i>N</i>,<i>N</i>')-<i>trans</i>-bis(triphenylphosphine-<i>P</i>)ruthenium(II) bis(hexafluorophosphate) methanol solvate","Acta Crystallographica Section C","2000","56","7","e281","e282","10.1107/S0108270100007654","","","0.71073","MoKα","","0.033","0.027","","","","0.073","","","","","","1.068","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2011160","13.8864","0.0002","18.4943","0.0007","6.9664","0.0009","90","","90","","90","","1789.1","0.2","100","1","100","1","","","","","","","","5","P c c a","-P 2a 2ac","54","","N-glicyl-2-hydroxibenzaldiminate potasium salt","","- C9 H8 K N O3 -","- C9 H8 K N O3 -","- C72 H64 K8 N8 O24 -","8","1","QA0306","Paredes-García, Verónica; Venegas-Yazigi, Diego; Lough, Alan J.; Latorre, Ramón","Potassium <i>N</i>-(6-oxocyclohexa-1,3-dien-5-ylidenemethyl)glycinate","Acta Crystallographica Section C","2000","56","7","e283","e283","10.1107/S0108270100007666","","","0.71073","MoKα","","0.049","0.034","","","","0.091","","","","","","1.051","","","","has coordinates,has Fobs","194580","2020-10-21","18:00:00",""
"2011161","8.9944","0.0009","16.257","0.002","10.519","0.001","90","0.009","103.08","0.01","90","0.009","1498.2","0.3","293","","293","","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","2,2'-bi(9,9-dipropylfluorene)","","- C38 H42 -","- C38 H42 -","- C76 H84 -","2","0.5","QA0308","Suchod, Bernadette; Stéphan, Olivier; Kervella, Yann","2,2'-Bi(9,9-di-<i>n</i>-propylfluorene)","Acta Crystallographica Section C","2000","56","7","e297","e297","10.1107/S010827010000768X","","","0.71073","MoKα","","0.087","0.076","","0.047","","0.045","","","1.127","","","1.183","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011162","7.582","0.001","19.19","0.003","8.143","0.001","90","","109.95","0.01","90","","1113.7","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Phthalimido-3-iodo propane","","- C11 H10 I N O2 -","- C11 H10 I N O2 -","- C44 H40 I4 N4 O8 -","4","1","QA0309","Chandramohan, Kattamuri; Ravikumar, Krishnan; Rajendar, Shenigarapu","<i>N</i>-(3-Iodopropyl)phthalimide","Acta Crystallographica Section C","2000","56","7","e298","e299","10.1107/S0108270100007691","","","0.71073","MoKα","","0.048","0.036","","0.099","","0.092","","","1.139","","","1.183","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011163","13.4315","0.0001","10.3779","0.0002","10.256","0.0002","90","","106.216","0.001","90","","1372.72","0.04","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(6-Bromo-4-oxo-3,4-dihydropteridin-2-yl)-2,2-dimethylpropanamide","","- C11 H12 Br N5 O2 -","- C11 H12 Br N5 O2 -","- C44 H48 Br4 N20 O8 -","4","1","QA0311","Shanmuga Sundara Raj, S.; Razak, Ibrahim Abdul; Fun, Hoong-Kun; Goswami, Shyamaprosad; Mukherjee, Reshmi; Adak, Avijit","<i>N</i>-(6-Bromo-4-oxo-3,4-dihydropteridin-2-yl)-2,2-dimethylpropanamide","Acta Crystallographica Section C","2000","56","7","e302","e303","10.1107/S0108270100007861","","","0.71073","MoKα","","0.096","0.054","","","","0.128","","","","","","0.935","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2011164","7.537","0.004","13.602","0.008","12.779","0.005","90","","94.57","0.02","90","","1305.9","1.2","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","6-Dimethoxymethyl-1-methoxycarbonylbicyclo[3.1.0]hex-2-ene-2-carboxylic acid","","- C12 H16 O6 -","- C12 H16 O6 -","- C48 H64 O24 -","4","1","QA0312","Niwayama, Satomi; Holt, Elizabeth M.","6-Dimethoxymethyl-1-methoxycarbonylbicyclo[3.1.0]hex-2-ene-2-carboxylic acid","Acta Crystallographica Section C","2000","56","7","e300","e301","10.1107/S0108270100007757","","","0.71073","MoKα","","0.095","0.067","","","","0.233","","","","","","0.992","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011165","12.2892","0.0004","13.1612","0.0005","19.3696","0.0007","95.512","0.001","103.177","0.001","116.801","0.001","2650.47","0.17","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","N,N-bis(2-hydroxyethyl)dithiocarbamatobis(triphenylphosphine) Copper(I) Triphenylphosphine","","- C59 H55 Cu N O2 P3 S2 -","- C59 H55 Cu N O2 P3 S2 -","- C118 H110 Cu2 N2 O4 P6 S4 -","2","1","QA0313","Jian, Fangfang; Bei, Fengli; Lu, Lude; Yang, Xujie; Wang, Xin; Razak, Ibrahim Abdul; Shanmuga Sundara Raj, S.; Fun, Hoong-Kun","[<i>N</i>,<i>N</i>-Bis(2-hydroxyethyl)dithiocarbamato-<i>S</i>]bis(triphenylphosphine-<i>P</i>)copper(I) triphenylphosphine solvate","Acta Crystallographica Section C","2000","56","7","e288","e289","10.1107/S0108270100007873","","","0.71073","MoKα","","0.128","0.057","","","","0.139","","","","","","0.86","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2011166","20.709","0.004","9.968","0.002","23.66","0.005","90","","101.04","0.03","90","","4793.7","1.7","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","tetrakis(ethylenediammonium) tetra-μ-hydrogenphosphato-di-μ-hydroxo- tetra-μ-phosphato-bis(aquacobalt)hexakis(oxovanadium) trihydrate","","- C8 H56 Co N8 O45 P8 V6 -","- C8 H40 Co N8 O45 P8 V6 -","- C32 H160 Co4 N32 O180 P32 V24 -","4","0.5","QA0314","Luan, Guo-You; Wang, En-Bo; You, Wan-Sheng; Xu, Lin; He, Qin-Lin","A hydrated ethylenediammonium salt of a new polymeric polyoxoanion: (H~2~en)~4~[Co(H~2~O)~2~(OH)~2~(VO)~6~(HPO~4~)~4~(PO~4~)~4~]·3H~2~O","Acta Crystallographica Section C","2000","56","7","e284","e285","10.1107/S0108270100007769","","","0.71073","MoKα","","0.054","0.046","","0.137","0.134","","","","1.123","1.211","1.211","","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011167","7.842","0.002","11.458","0.003","8.824","0.002","90","","114.26","0.03","90","","722.9","0.4","180","2","180","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2,4,6,2',4',6'-Hexamethyl-4H,4'H[4,4']bipyranyl","","- C16 H22 O2 -","- C16 H22 O2 -","- C32 H44 O4 -","2","0.5","QA0317","Ziemer, Burkhard; Grubert, Lutz","2,2',4,4',6,6'-Hexamethyl-4,4'-bi[4<i>H</i>-pyranyl]","Acta Crystallographica Section C","2000","56","7","e304","e304","10.1107/S0108270100007885","","","0.71073","MoKα","","0.054","0.044","","","","0.119","","","","","","1.039","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2011168","16.015","0.003","10.219","0.003","24.275","0.005","90","","93.94","0.03","90","","3963.4","1.6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Di-μ-diethylamido-N:N-bis[chlorodimethyltin(IV)]","","- C12 H32 Cl2 N2 Sn2 -","- C12 H32 Cl2 N2 Sn2 -","- C96 H256 Cl16 N16 Sn16 -","8","1","QA0318","Barreca, Davide; Benetollo, Franco; Garon, Simona; Tondello, Eugenio; Zanella, Pierino","The chloro(diethylamino)dimethyltin dimer","Acta Crystallographica Section C","2000","56","7","e290","e291","10.1107/S0108270100007897","","","0.71073","MoKα","","0.056","0.056","","","","0.14","","","","","","1.209","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011169","8.4691","0.0009","10.3985","0.0008","12.4538","0.0015","90","","90","","90","","1096.8","0.2","150","","150","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(1R,4bS,8aR)-(1,2,3,4b,5,6,7,8,8a,9a-Decahydro-4,9a-diazafluoren-1-yl)methanol","","- C12 H20 N2 O -","- C12 H20 N2 O -","- C48 H80 N8 O4 -","4","1","QA0321","Kooijman, Huub; Spek, Anthony L.","(1<i>R</i>,4b<i>S</i>,8a<i>R</i>)-(1,2,3,4b,5,6,7,8,8a,9a-Decahydro-4,9a-diazafluoren-1-yl)methanol","Acta Crystallographica Section C","2000","56","7","e295","e296","10.1107/S0108270100007678","","","0.71073","MoKα","","0.089","0.05","","","","0.104","","","","","","0.993","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011170","13.3847","0.0001","18.2966","0.0003","8.978","0.0001","90","","105.296","0.001","90","","2120.78","0.05","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Dicyclohexylammonium) 2,4-dichlorophenoxyacetate","","- C20 H29 Cl2 N O3 -","- C20 H29 Cl2 N O3 -","- C80 H116 Cl8 N4 O12 -","4","1","QA0322","Subramanian, Ramis Rao; Anandan, Shanmuga S.; Kwek, Kuan Hiang; Low, Kum Sang; Shanmuga Sundara Raj, S.; Fun, Hoong-Kun; Razak, Ibrahim Abdul; Hanna, John V.; Ng, Seik Weng","Dicyclohexylammonium 2,4-dichlorophenoxyacetate and (2,4-dichlorophenoxyacetato-<i>O</i>,<i>O</i>')bis(triphenylphosphine-<i>P</i>)silver(I)","Acta Crystallographica Section C","2000","56","7","e292","e294","10.1107/S0108270100007903","","","0.71073","MoKα","","0.09","0.063","","","","0.198","","","","","","1.064","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011171","13.45","0.0002","25.8202","0.0004","11.7071","0.0002","90","","96.79","0.001","90","","4037.15","0.11","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis(triphenylphosphine)(2,4-dichlorophenoxyacetato)silver(I)","","- C44 H35 Ag Cl2 O3 P2 -","- C44 H35 Ag Cl2 O3 P2 -","- C176 H140 Ag4 Cl8 O12 P8 -","4","1","QA0322","Subramanian, Ramis Rao; Anandan, Shanmuga S.; Kwek, Kuan Hiang; Low, Kum Sang; Shanmuga Sundara Raj, S.; Fun, Hoong-Kun; Razak, Ibrahim Abdul; Hanna, John V.; Ng, Seik Weng","Dicyclohexylammonium 2,4-dichlorophenoxyacetate and (2,4-dichlorophenoxyacetato-<i>O</i>,<i>O</i>')bis(triphenylphosphine-<i>P</i>)silver(I)","Acta Crystallographica Section C","2000","56","7","e292","e294","10.1107/S0108270100007903","","","0.71073","MoKα","","0.057","0.042","","","","0.11","","","","","","0.972","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2011172","10.455","0.002","12.41","0.002","10.592","0.002","90","","115.077","0.01","90","","1244.7","0.4","100","","100","","","","","","","","","6","P 1 21 1","P 2yb","4","","phenylmethyl 5-(6,8-diaza-6-(2-diethoxyphosphono) acetyl)-7-oxo-3-thiabicyclo [3.3.0] oct-2-yl) pentanoate","","- C23 H33 N2 O7 P S -","- C23 H33 N2 O7 P S -","- C46 H66 N4 O14 P2 S2 -","2","1","QA0325","Amspacher, David R.; Blanchard, Carol Z.; Saraiva, Marcelo C.; Waldrop, Grover L.; Strongin, Robert M.; Fronczek, Frank R.","Benzyl 5-{2-[2-(diethoxyphosphinoyl)acetyl]-3-oxo-7-thia-2,4-diazabicyclo[3.3.0]oct-6-yl}pentanoate, a novel biotin derivative","Acta Crystallographica Section C","2000","56","7","e305","e306","10.1107/S0108270100007915","","","0.71073","Mo-Kα","","0.057","0.04","","","","0.101","","","","","","1.12","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011173","13.824","0.005","13.824","0.005","13.824","0.005","90","","90","","90","","2641.8","1.7","293","2","293","2","","","","","","","","5","F m -3 m","-F 4 2 3","225","","tetramethylammonium hexamolybdate hydrate","","- C8 H26 Mo6 N2 O20 -","- C8 H25.98 Mo6 N2 O20 -","- C32 H103.92 Mo24 N8 O80 -","4","0.0208333","QB0194","Strukan, Neven; Cindrić, Marina; Devčić, Maja; Giester, Gerald; Kamenar, Boris","Bis(tetramethylammonium) hexamolybdate hydrate, [(CH~3~)~4~N]~2~[Mo~6~O~19~]·H~2~O","Acta Crystallographica Section C","2000","56","7","e278","e279","10.1107/S0108270100007630","","","0.71069","MoKα","","0.031","0.025","","","","0.064","","","","","","1.194","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011174","10.642","0.003","11.719","0.002","10.977","0.003","90","","108.04","0.02","90","","1301.7","0.6","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","1a,2a-Epoxy-24(R)-acyloxycholesta-4,6-dien-3-one hydrate","","- C29 H44 O5 -","- C29 H44 O5 -","- C58 H88 O10 -","2","1","QB0203","Rajalakshmi, K.; Pattabhi, Vasantha; Venkatesan, C. S.; Nadamuni, G.; Srikrishna, A.","24(<i>R</i>)-Acetyloxy-1α,2α-epoxycholesta-4,6-dien-3-one hydrate","Acta Crystallographica Section C","2000","56","7","e307","e308","10.1107/S0108270100007927","","","1.5418","CuKα","","0.072","0.056","","","","0.162","","","","","","1.123","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011175","10.005","0.005","16.449","0.005","8.186","0.005","90","0.2","105.8","0.2","90","0.2","1296.3","1.7","298","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H15 N O3 -","- C16 H15 N O3 -","- C64 H60 N4 O12 -","4","1","QB0205","Thinapong, Pongchan; Rangsiman, Orapin; Tuchinda, Patoomratana; Munyoo, Bamroong; Pohmakotr, Manat; Reutrakul, Vichai","9,10-Dimethoxy-4-methyl-1,2-dihydro-1-azaanthracen-2-one (kalasinamide), a new azaanthracene alkaloid","Acta Crystallographica Section C","2000","56","7","e309","e310","10.1107/S0108270100008064","","","0.7093","MoKα","","0.068","0.053","","","","0.163","","","","","","1.069","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011176","11.226","0.002","17.836","0.002","12.932","0.002","90","","111.32","0.01","90","","2412.1","0.7","296","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis[methylenebis(diphenylphosphine)-P,P']nickel(II) diperchlorate","","- C50 H44 Cl2 Ni O8 P4 -","- C50 H44 Cl2 Ni O8 P4 -","- C100 H88 Cl4 Ni2 O16 P8 -","2","0.5","QB0214","Li, Yi-Zhi; Liu, Jia-Cheng; Wang, Zhi-Ping; Li, Qin-Xi; Sun, Gang-Chun; Wang, Liu-Fang; Xia, Chun-Gu","Bis[methylenebis(diphenylphosphine)-<i>P</i>,<i>P</i>']nickel(II) diperchlorate","Acta Crystallographica Section C","2000","56","7","e286","e287","10.1107/S0108270100007824","","","0.71069","MoKα","","","0.033","","","","0.044","","","","","","1.22","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2011177","14.067","0.001","10.1759","0.0007","15.755","0.001","90","","90","","90","","2255.2","0.3","173","2","173","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","catena-poly[[bis(2,2'-bipyridyl-1κ^2^N,N')-μ-cyano-1:2κ^2^N:C-dicyano- 2κ^2^C-dinickel(II)]-μ-cyano-C:N]","","- C24 H16 N8 Ni2 -","- C24 H16 N8 Ni2 -","- C96 H64 N32 Ni8 -","4","0.5","SK1357","Juraj Černák; Abboud, Khalil A.","Ni(bipy)~2~Ni(CN)~4~, a new type of one-dimensional square tetracyano complex","Acta Crystallographica Section C","2000","56","7","783","785","10.1107/S0108270100004996","","","0.71073","MoKα","","0.09","0.046","","","","0.142","","","","","","1.007","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011178","16.4027","0.0006","8.76805","0.00019","19.5576","0.0004","90","","90","","90","","2812.77","0.13","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C10 H17 La O10 -","- C10 H17 La O10 -","- C80 H136 La8 O80 -","8","1","SK1364","Benmerad, Belkacem; Guehria-Laidoudi, Achoura; Balegroune, Fadila; Birkedal, Henrik; Chapuis, Gervais","Polymeric aqua(glutarato)(hydrogen glutarato)lanthanum(III) monohydrate","Acta Crystallographica Section C","2000","56","7","789","792","10.1107/S010827010000500X","","","0.71073","MoKα","","0.0326","0.028","","","","0.0494","","","","","","1.188","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011179","4.8297","0.0002","7.9967","0.0005","11.0644","0.0006","89.022","0.003","80.294","0.003","78.5","0.003","412.69","0.04","100","1","100","1","","","","","","","","5","P -1","-P 1","2","","Ethane-1,2-diphosphonic acid‒4,4'-bipyridyl‒water (1/1/2)","","- C12 H20 N2 O8 P2 -","- C12 H20 N2 O8 P2 -","- C12 H20 N2 O8 P2 -","1","0.5","SK1384","Glidewell, Christopher; Ferguson, George; Lough, Alan J.","A structural hierarchy in the hydrogen-bonded adduct ethane-1,2-diphosphonic acid‒4,4'-bipyridyl‒water (1/1/2): an <i>N</i>-component <i>N</i>-dimensional structure (<i>N</i> = 3) with substructures having <i>N</i> = 1 and 2","Acta Crystallographica Section C","2000","56","7","855","858","10.1107/S0108270100004650","","","0.71073","MoKα","","0.064","0.0457","","","","0.1249","","","","","","1.1","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011180","13.114","0.001","12.7121","0.0019","20.959","0.003","90","","105.594","0.007","90","","3365.4","0.8","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Trans-1,2-bis(2-nitroanilino)cyclohexane","","- C18 H20 N4 O4 -","- C18 H20 N4 O4 -","- C144 H160 N32 O32 -","8","2","SK1388","Ward, Mark F.; Wardell, Solange M. S. V.; Wardell, James L.; Low, John N.; Glidewell, Christopher","Hydrogen-bonded molecular ladders in <i>trans</i>-1,2-bis(2-nitroanilino)cyclohexane","Acta Crystallographica Section C","2000","56","7","865","867","10.1107/S0108270100006260","","","0.71073","MoKα","","0.2831","0.0668","","","","0.1403","","","","","","0.862","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011181","7.139","0.002","26.763","0.002","6.815","0.002","90","","90","","90","","1302.1","0.5","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C11 H11 Cl Fe O5 -","- C11 H11 Cl Fe O5 -","- C44 H44 Cl4 Fe4 O20 -","4","1","SX1099","Russi, Silvia; Suescun, Leopoldo; Mombrú, Alvaro; Pardo, Helena; Mariezcurrena, Raúl A.; Cavalli, Gabriel; Seoane, Gustavo","(<i>S</i>)-Tricarbonyl[(1,2,3,4-η)-(5<i>R</i>,6<i>S</i>)-1-chloro-5,6-dimethoxycyclohexa-1,3-diene]iron(0)","Acta Crystallographica Section C","2000","56","7","820","821","10.1107/S0108270100006399","","","0.7107","MoKα","","0.048","0.044","","","","0.119","","","","","","1.062","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011182","11.686","0.012","11.671","0.006","16.667","0.018","90","","120.8","0.04","90","","1953","3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","octasodium hexatungstomanganate(IV) octadecahydrate","","- H36 Mn Na8 O42 W6 -","- Mn Na8 O42 W6 -","- Mn2 Na16 O84 W12 -","2","0.5","TA1280","Nolan, Annette L.; Burns, Robert C.; Lawrance, Geoffrey A.; Craig, Donald C.","Octasodium hexatungstomanganate(IV) octadecahydrate","Acta Crystallographica Section C","2000","56","7","729","730","10.1107/S010827010000408X","","","0.71069","MoKα","","0.047","0.038","","0.123","","0.12","","","","","","0.963","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011183","9.837","0.0008","12.382","0.0009","12.1515","0.0009","90","","97.212","0.002","90","","1468.36","0.19","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","tetrakis[1,1,2,2(η^5^)-methylcyclopentadienyl]di-μ-isopropxy- 1:2κ^2^O-diyttrium(III)(Y-Y)","","- C30 H42 O2 Y2 -","- C30 H42 O2 Y2 -","- C60 H84 O4 Y4 -","2","0.5","TA1289","Li, Huanrong; Yao, Yingming; Shen, Qi; Weng, Linhong","Di-μ-isopropoxy-bis[bis(η^5^-methylcyclopentadienyl)yttrium(III)]","Acta Crystallographica Section C","2000","56","7","747","748","10.1107/S0108270100004133","","","0.71073","MoKα","","0.044","0.036","","","","0.099","","","","","","1.086","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011184","10.867","0.003","24.284","0.004","5.427","0.002","90","","90","","90","","1432.2","0.7","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","2,6-diphenyl-thiopyran-4-one","","- C17 H16 O S -","- C17 H16 O S -","- C68 H64 O4 S4 -","4","0.5","VJ1103","T. Narasimhamurthy; R.V. Krishnakumar; J.C.N.Benny; K.Pandiarajan; M.A.Viswamitra","2,6-Diphenylthiapyran-4-one","Acta Crystallographica Section C","2000","56","7","870","871","10.1107/S0108270100004765","","","1.5418","CuKα","","0.0473","0.0429","","","","0.1225","","","","","","1.167","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011185","14.9965","0.0007","4.217","0.0003","26.022","0.001","90","","90","","90","","1645.64","0.15","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","7-aza-IAA","7-azaindole-3-acetic acid","","- C9 H8 N2 O2 -","- C9 H8 N2 O2 -","- C72 H64 N16 O16 -","8","2","AV1034","Antolić, Snježana; Kojić-Prodić, Biserka; Magnus, Volker","1<i>H</i>-Pyrrolo[2,3-<i>b</i>]pyridine-3-acetic acid as a molecular probe for use in auxin physiology","Acta Crystallographica Section C","2000","56","8","1026","1027","10.1107/S0108270100007101","","","1.54184","CuKα","","0.106","0.041","","","","0.104","","","","","","0.908","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011186","6.6305","0.0004","9.2888","0.0003","10.9828","0.0006","90","","104.837","0.005","90","","653.87","0.06","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","3-Nitro-1,2,4-triazolyl-1-nitromethane","3-Nitro-1-nitromethyl-1H-1,2,4-triazole","","- C3 H3 N5 O4 -","- C3 H3 N5 O4 -","- C12 H12 N20 O16 -","4","1","AV1037","Vasiliev, Alexander D.; Astachov, Alexander M.; Golubtsova, Oksana A.; Kruglyakova, Ludmila A.; Stepanov, Rudolf S.","3-Nitro-1-nitromethyl-1<i>H</i>-1,2,4-triazole","Acta Crystallographica Section C","2000","56","8","999","1000","10.1107/S010827010000665X","","","1.54051","CuKα","","0.038","0.032","","","","0.087","","","","","","1.029","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011187","7.5608","0.0002","9.0632","0.0002","12.7245","0.0003","69.481","0.001","82.764","0.001","76.229","0.002","792.29","0.03","150","","150","","","","","","","","","4","P -1","-P 1","2","3-(3-aminophthalimido)phthalic acid dihydrate","","","- C16 H14 N2 O8 -","- C16 H14 N2 O8 -","- C32 H28 N4 O16 -","2","1","BK1528","Dobson, Allison J.; Gerkin, Roger E.","Hydrogen bonding and C—H···O interactions in 3-(3-aminophthalimido)phthalic acid dihydrate","Acta Crystallographica Section C","2000","56","8","1021","1023","10.1107/S0108270100007083","","","0.71073","MoKα","","","0.049","","","","0.125","","","","","","1.98","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011188","9.138","0.001","10.793","0.002","8.249","0.001","90.76","0.01","94.26","0.01","65.75","0.01","739.6","0.19","210","2","210","2","","","","","","","","3","P -1","-P 1","2","","","","- C18 H10 F6 -","- C18 H10 F6 -","- C36 H20 F12 -","2","1","BK1534","Swenson, Dale C.; Gao, Xiaobang; Burton, Donald J.","(1<i>E</i>,3<i>E</i>,5<i>E</i>)-1,2,3,4,5,6-Hexafluoro-1,6-diphenylhexatriene","Acta Crystallographica Section C","2000","56","8","1040","1041","10.1107/S0108270100007502","","","0.71073","MoKα","","0.0802","0.0393","","","","0.1219","","","","","","1.045","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011189","15.7883","0.0008","3.9239","0.0002","22.6063","0.0011","90","","105.767","0.001","90","","1347.8","0.12","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N-[(E,2E)-3-(4-methoxyphenyl)-2-propenylidene]-3-nitroaniline","","- C16 H14 N2 O3 -","- C16 H14 N2 O3 -","- C64 H56 N8 O12 -","4","1","BM1393","Vladimir N. Nesterov; Tatiana V. Timofeeva; Oleg Ya. Borbulevych; Mikhail Yu. Antipin; Ronald D. Clark","A combinatorial chemistry approach to new materials for non-linear optics. I. Five Schiff bases","Acta Crystallographica Section C","2000","56","8","971","975","10.1107/S0108270100002845","","","0.71073","MoKα","","0.0777","0.0543","","0.1412","","0.1263","","","0.89","","","1.024","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011190","10.413","0.002","7.599","0.0015","36.01","0.007","90","","90","","90","","2849.4","1","298","2","298","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","N-[(E,2E)-3-(4-methoxyphenyl)-2-propenylidene]-4-nitroaniline","","- C16 H14 N2 O3 -","- C16 H14 N2 O3 -","- C128 H112 N16 O24 -","8","1","BM1393","Vladimir N. Nesterov; Tatiana V. Timofeeva; Oleg Ya. Borbulevych; Mikhail Yu. Antipin; Ronald D. Clark","A combinatorial chemistry approach to new materials for non-linear optics. I. Five Schiff bases","Acta Crystallographica Section C","2000","56","8","971","975","10.1107/S0108270100002845","","","0.71073","MoKα","","0.1622","0.0502","","0.2785","","0.1063","","","1.015","","","1.159","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011191","6.791","0.0014","10.204","0.002","12.185","0.002","113.2","0.03","98.97","0.03","95.53","0.03","754.9","0.3","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","N-{(E,2E)-3-[4-(dimethylamino)phenyl]-2-propenylidene}-3-nitroaniline","","- C17 H17 N3 O2 -","- C17 H17 N3 O2 -","- C34 H34 N6 O4 -","2","1","BM1393","Vladimir N. Nesterov; Tatiana V. Timofeeva; Oleg Ya. Borbulevych; Mikhail Yu. Antipin; Ronald D. Clark","A combinatorial chemistry approach to new materials for non-linear optics. I. Five Schiff bases","Acta Crystallographica Section C","2000","56","8","971","975","10.1107/S0108270100002845","","","0.71073","MoKα","","0.1367","0.0401","","0.1961","","0.0936","","","0.987","","","1.135","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011192","6.165","0.0012","7.273","0.0015","17.158","0.003","90.7","0.03","100.1","0.03","91.37","0.03","757.1","0.3","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","N-{(E,2E)-3-[4-(dimethylamino)phenyl]-2-propenylidene}-4-nitroaniline","","- C17 H17 N3 O2 -","- C17 H17 N3 O2 -","- C34 H34 N6 O4 -","2","1","BM1393","Vladimir N. Nesterov; Tatiana V. Timofeeva; Oleg Ya. Borbulevych; Mikhail Yu. Antipin; Ronald D. Clark","A combinatorial chemistry approach to new materials for non-linear optics. I. Five Schiff bases","Acta Crystallographica Section C","2000","56","8","971","975","10.1107/S0108270100002845","","","0.71073","MoKα","","0.2117","0.0621","","0.2208","","0.1069","","","0.988","","","1.224","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011193","8.438","0.002","9.609","0.002","10.546","0.002","72.95","0.03","86.13","0.03","89.81","0.03","815.5","0.3","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","N-{(E,2E)-3-[4-(dimethylamino)phenyl]-2-propenylidene}-2-methyl- -4-nitroaniline","","- C18 H19 N3 O2 -","- C18 H19 N3 O2 -","- C36 H38 N6 O4 -","2","1","BM1393","Vladimir N. Nesterov; Tatiana V. Timofeeva; Oleg Ya. Borbulevych; Mikhail Yu. Antipin; Ronald D. Clark","A combinatorial chemistry approach to new materials for non-linear optics. I. Five Schiff bases","Acta Crystallographica Section C","2000","56","8","971","975","10.1107/S0108270100002845","","","0.71073","MoKα","","0.182","0.0802","","0.3166","","0.2005","","","1.011","","","1.143","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011194","7.349","0.0015","9.252","0.0019","12.523","0.003","108.01","0.03","93.48","0.03","94.4","0.03","804.2","0.3","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","molecular complex of 4-methoxycinnamaldehyde with 2,4-dinitroaniline","","- C16 H15 N3 O6 -","- C16 H15 N3 O6 -","- C32 H30 N6 O12 -","2","1","BM1394","Nesterov, Vladimir N.; Timofeeva, Tatiana V.; Antipin, Mikhail Yu.; Clark, Ronald D.","A combinatorial chemistry approach to new materials for nonlinear optics. II. 4,4-Dimethylaminocinnamaldehyde and a molecular complex of 4-methoxycinnamaldehyde with 2,4-dinitroaniline","Acta Crystallographica Section C","2000","56","8","976","978","10.1107/S0108270100006351","","","0.71073","MoKα","","0.088","0.047","","","","0.156","","","","","","1.023","","","","has coordinates,has Fobs","176428","2020-10-21","18:00:00",""
"2011195","10.04","0.006","7.733","0.003","25.62","0.013","90","","90","","90","","1989.1","1.7","298","2","298","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","4,4-dimethylaminocinnamaldehyde","","- C11 H13 N O -","- C11 H13 N O -","- C88 H104 N8 O8 -","8","1","BM1394","Nesterov, Vladimir N.; Timofeeva, Tatiana V.; Antipin, Mikhail Yu.; Clark, Ronald D.","A combinatorial chemistry approach to new materials for nonlinear optics. II. 4,4-Dimethylaminocinnamaldehyde and a molecular complex of 4-methoxycinnamaldehyde with 2,4-dinitroaniline","Acta Crystallographica Section C","2000","56","8","976","978","10.1107/S0108270100006351","","","0.71073","MoKα","","0.173","0.123","","","","0.257","","","","","","1.141","","","","has coordinates,has Fobs","277836","2022-09-14","17:02:02",""
"2011196","9.9534","0.001","10.53","0.003","13.837","0.002","90","0.02","110.942","0.01","90","0.02","1354.4","0.5","273","2","273","2","","","","","","","","3","P 1 21 1","P 2yb","4","","(24R)-cycloartane-24,25-diol-3-one","","- C30 H50 O3 -","- C30 H50 O3 -","- C60 H100 O6 -","2","1","BM1401","Bhattacharyya, Kinkini; Kar, Tanusree; Palmer, Rex A.; Potter, Brian S.; Inada, Akira","(24<i>R</i>)-24,25-Dihydroxycycloartan-3-one","Acta Crystallographica Section C","2000","56","8","979","980","10.1107/S0108270100004820","","","1.5418","CuKα","","0.0409","0.0399","","","","0.1136","","","","","","1.032","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011197","6.8157","0.0008","8.3508","0.001","14.725","0.002","90","","100.119","0.01","90","","825.06","0.18","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Bis(diethanolamine)bis(isothiocyanato)nickel(II)","Bis(2,2-́iminodiethanol)bis(isothiocyanato)nickel(II)","","- C10 H22 N4 Ni O4 S2 -","- C10 H22 N4 Ni O4 S2 -","- C20 H44 N8 Ni2 O8 S4 -","2","0.5","BM1413","Yilmaz, Veysel T.; Karadağ, Ahmet; Thöne, Carsten; Herbst-Irmer, Regine","<i>trans</i>-Bis(diethanolamine)bis(isothiocyanato)nickel(II)","Acta Crystallographica Section C","2000","56","8","948","949","10.1107/S0108270100007289","","","0.71073","MoKα","","0.0628","0.0335","","","","0.0711","","","","","","0.929","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011199","12.613","0.002","18.855","0.003","11.3048","0.0019","90.467","0.018","100.365","0.015","87.202","0.013","2641.5","0.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Bis-(2,10-phenanthroline-N,N')-(thiosulfato-O,S)-nickel(II) hydrate, methanol solvate","","- C25.4 H23.44 N4 Ni O5.32 S2 -","- C25.403 H16 N4 Ni O5.3225 S2 -","- C101.612 H64 N16 Ni4 O21.29 S8 -","4","2","DA1130","Freire, Eleonora; Baggio, Sergio; Baggio, Ricardo; Mariezcurrena, Raúl","Bis(1,10-phenanthroline-<i>N</i>,<i>N</i>')(thiosulfato-<i>O</i>,<i>S</i>)nickel(II)‒water‒methanol (1/0.92/1.4) and bis(2,2'-bipyridyl-<i>N</i>,<i>N</i>')(thiosulfato-<i>O</i>,<i>S</i>)nickel(II)‒water‒methanol (1/2/0.55)","Acta Crystallographica Section C","2000","56","8","926","929","10.1107/S0108270100006880","","","0.7107","MoKα","","0.09","0.042","","","","0.164","","","","","","0.954","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2011200","20.754","0.004","20.895","0.004","14.402","0.003","90","","132.919","0.012","90","","4573.7","1.8","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis-(2,2'-bipyridyl-N,N')-(thiosulfato-O,S)-nickel(II), hydrate, methanol solvate","","- C20.55 H22.2 N4 Ni O5.55 S2 -","- C20.548 H22.192 N4 Ni O5.548 S2 -","- C164.384 H177.536 N32 Ni8 O44.384 S16 -","8","1","DA1130","Freire, Eleonora; Baggio, Sergio; Baggio, Ricardo; Mariezcurrena, Raúl","Bis(1,10-phenanthroline-<i>N</i>,<i>N</i>')(thiosulfato-<i>O</i>,<i>S</i>)nickel(II)‒water‒methanol (1/0.92/1.4) and bis(2,2'-bipyridyl-<i>N</i>,<i>N</i>')(thiosulfato-<i>O</i>,<i>S</i>)nickel(II)‒water‒methanol (1/2/0.55)","Acta Crystallographica Section C","2000","56","8","926","929","10.1107/S0108270100006880","","","0.71073","MoKα","","0.142","0.064","","","","0.183","","","","","","0.971","","","","has coordinates,has Fobs","206183","2020-10-21","18:00:00",""
"2011201","8.114","0.002","22.474","0.004","16.642","0.003","90","","96.08","0.02","90","","3017.7","1.1","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Di-μ-bromo-bis[bromo(di-2-pyridylmethanediol-N,O,N')cadmium(II)] trihydrate","","- C22 H26 Br4 Cd2 N4 O7 -","- C22 H26 Br4 Cd2 N4 O7 -","- C88 H104 Br16 Cd8 N16 O28 -","4","0.5","DA1134","Zhu, Huai-Gang; Yang, Guang; Chen, Xiao-Ming","Di-μ-bromo-bis[bromo(di-2-pyridylmethanediol-<i>N</i>,<i>O</i>,<i>N</i>')cadmium(II)] trihydrate","Acta Crystallographica Section C","2000","56","8","969","970","10.1107/S010827010000754X","","","0.71073","MoKα","","0.067","0.04","","","","0.08","","","","","","1.066","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011202","8.483","0.002","15.994","0.003","10.988","0.002","90","","104.5","0.03","90","","1443.3","0.5","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Triphenylmethanol - triphenylphosphinoxide","","- C37 H31 O2 P -","- C37 H30.98 O2 P -","- C74 H61.96 O4 P2 -","2","0.5","DE1126","Steiner, Thomas","Triphenylmethanol‒triphenylphosphine oxide (1/1)","Acta Crystallographica Section C","2000","56","8","1033","1034","10.1107/S0108270100007423","","","0.71073","MoKα","","0.1162","0.0686","","","","0.1604","","","","","","1.19","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011203","7.577","0.002","8.03","0.002","13.464","0.003","76.6","0.03","89.17","0.03","82.6","0.03","790.2","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","bis(μ~2~-hexamethylenetetramine)bis(aquadi(μ~2~-bromo)- cadmium)diaquadibromocadmium dihydrate","","- C12 H36 Br6 Cd3 N8 O6 -","- C12 H36 Br6 Cd3 N8 O6 -","- C12 H36 Br6 Cd3 N8 O6 -","1","0.5","DE1139","Tong, Ming-Liang; Zheng, Shao-Liang; Chen, Xiao-Ming","Bis(μ-hexamethylenetetramine)bis(aquadibromocadmium)diaquadibromocadmium dihydrate","Acta Crystallographica Section C","2000","56","8","960","962","10.1107/S0108270100007435","","","0.71073","MoKα","","0.0703","0.0433","","","","0.1037","","","","","","1.025","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011204","12.1918","0.0006","6.5318","0.0003","22.0382","0.0008","90","","93.985","0.003","90","","1750.76","0.13","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Ranitidine","N-(2-{[5-(Dimethylaminomethyl)-2-furanyl]methylthio}ethyl)-N' -methyl-2-nitro-1,1-ethanediamine hydrochloride","","- C13 H23 Cl N4 O3 S -","- C13 H23 Cl N4 O3 S -","- C52 H92 Cl4 N16 O12 S4 -","4","1","FG1581","Hempel, Andrew; Camerman, Norman; Mastropaolo, Donald; Camerman, Arthur","Ranitidine hydrochloride, a polymorphic crystal form","Acta Crystallographica Section C","2000","56","8","1048","1049","10.1107/S010827010000785X","","","0.71073","MoKα","","0.0785","0.0416","","","","0.1304","","","","","","0.802","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011205","6.4268","0.0003","14.342","0.0012","10.7559","0.0006","90","","90.618","0.004","90","","991.35","0.11","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-[(4-Hydroxyphenyl)iminomethyl]thiophene","","- C11 H9 N O S -","- C11 H9 N O S -","- C44 H36 N4 O4 S4 -","4","1","FR1266","Kazak, Canan; Aygün, Muhittin; Turgut, Günseli; Odabaşoĝlu, Mustafa; Özbey, Süheyla; Büyükgüngör, Orhan","2-[(4-Hydroxyphenyl)iminomethyl]thiophene","Acta Crystallographica Section C","2000","56","8","1044","1045","10.1107/S0108270100007770","","","1.5418","CuKα","","0.048","0.046","","","","0.125","","","","","","1.051","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011206","9.647","0.006","12.675","0.006","16.359","0.005","90","","93.77","0.04","90","","1996","1.7","170","2","170","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","clemizoledichlorocobalt(II)","Dichloro[1-(p-chlorophenylmethyl)-2-(1-pyrrolidinylmethyl)benzimidazole- N,N'']Cobalt(II)","","- C19 H20 Cl3 Co N3 -","- C19 H20 Cl3 Co N3 -","- C76 H80 Cl12 Co4 N12 -","4","1","FR1273","Parvez, Masood; Braitenbach, Kristin","Clemizoledichlorocobalt(II)","Acta Crystallographica Section C","2000","56","8","919","920","10.1107/S0108270100005710","","","0.71069","MoKα","","0.188","0.043","","","","0.136","","","","","","0.979","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2011207","8.9719","0.0002","10.7632","0.0002","10.8399","0.0002","92.9965","0.001","90.1788","0.001","113.367","0.0009","959.28","0.03","193","","193","","","","","","","","","3","P -1","-P 1","2","diethyl 5, 6, 5',6'-tetramethylbiphenyl-2, 2'-dicarboxylate #","","","- C22 H26 O4 -","- C22 H26 O4 -","- C44 H52 O8 -","2","1","FR1277","Gerkin, Roger E.","C—H···O interactions in diethyl 5,5',6,6'-tetramethylbiphenyl-2,2'-dicarboxylate at 193K","Acta Crystallographica Section C","2000","56","8","1024","1025","10.1107/S0108270100007022","","","0.71073","MoKα","","","0.05","","","","0.125","","","","","","1.94","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011208","6.1716","0.0009","11.7924","0.0014","13.2197","0.0014","97.731","0.01","97.109","0.012","97.353","0.012","935.7","0.2","173","","173","2","","","","","","","","3","P -1","-P 1","2","2,4-bis(α,α-dimethylbenzyl)phenol","","","- C24 H26 O -","- C24 H26 O -","- C48 H52 O2 -","2","1","FR1283","Bryan, Jeffrey C.","2,4-Bis(α,α-dimethylbenzyl)phenol","Acta Crystallographica Section C","2000","56","8","1046","1047","10.1107/S0108270100007782","","","0.71073","MoKα","","0.055","0.04","","","","0.11","","","","","","1.07","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011209","7.451","0.003","19.709","0.006","18.587","0.008","90","","90","","90","","2729.5","1.8","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","3,6,9,16,19,22-hexaazatricyclo[22.2.2.2^11,14^]triaconta-11,13,24,26,27, 29-hexaene pentahydrate","","- C24 H48 N6 O5 -","- C24 H48 N6 O5 -","- C96 H192 N24 O20 -","4","0.5","GD1091","He, Wei-jiang; Ye, Zi-feng; Xu, Yan; Guo, Zi-jian; Zhu, Long-Gen","3,6,9,16,19,22-Hexaazatricyclo[22.2.2.2^11,14^]triaconta-11,13,24,26(1),27,29-hexaene pentahydrate","Acta Crystallographica Section C","2000","56","8","1019","1020","10.1107/S0108270100007095","","","0.71073","MoKα","","0.0879","0.0638","","","","0.1966","","","","","","1.027","","","","has coordinates,has disorder,has Fobs","203508","2020-10-21","18:00:00",""
"2011210","12.525","0.002","12.736","0.002","10.033","0.002","94.64","0.01","102.51","0.01","109.32","0.01","1454.1","0.5","298","","","","","","","","","","","5","P -1","-P 1","2","","","","- C50 H84 Cu3 N2 O12 -","- C50 H84 Cu3 N2 O12 -","- C50 H84 Cu3 N2 O12 -","1","0.5","GD1098","Kani, Yoshiyuki; Tsuchimoto, Masanobu; Ohba, Shigeru; Matsushima, Hideaki; Tokii, Tadashi","<i>catena</i>-Poly[[tetrakis(μ-3,3-dimethylbutyrato-<i>O</i>:<i>O</i>')dicopper(II)]-μ-3,3-dimethylbutyrato-<i>O</i>:<i>O</i>'-[bis(2,6-dimethylpyridine-<i>N</i>)copper(II)]-μ-3,3-dimethylbutyrato-<i>O</i>:<i>O</i>'] and tetrakis(μ-2,2-dimethylpropanoato-<i>O</i>:<i>O</i>')bis[(2,6-dimethylpyridine-<i>N</i>)copper(II)]","Acta Crystallographica Section C","2000","56","8","923","925","10.1107/S0108270100006697","","","0.71073","MoKα","","","0.045","","","","0.115","","","","","","1.08","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011211","10.986","0.004","11.195","0.005","9.564","0.004","107.66","0.04","97.15","0.04","61.82","0.03","987.7","0.8","298","","","","","","","","","","","5","P -1","-P 1","2","","","","- C34 H54 Cu2 N2 O8 -","- C34 H54 Cu2 N2 O8 -","- C34 H54 Cu2 N2 O8 -","1","0.5","GD1098","Kani, Yoshiyuki; Tsuchimoto, Masanobu; Ohba, Shigeru; Matsushima, Hideaki; Tokii, Tadashi","<i>catena</i>-Poly[[tetrakis(μ-3,3-dimethylbutyrato-<i>O</i>:<i>O</i>')dicopper(II)]-μ-3,3-dimethylbutyrato-<i>O</i>:<i>O</i>'-[bis(2,6-dimethylpyridine-<i>N</i>)copper(II)]-μ-3,3-dimethylbutyrato-<i>O</i>:<i>O</i>'] and tetrakis(μ-2,2-dimethylpropanoato-<i>O</i>:<i>O</i>')bis[(2,6-dimethylpyridine-<i>N</i>)copper(II)]","Acta Crystallographica Section C","2000","56","8","923","925","10.1107/S0108270100006697","","","0.71073","MoKα","","","0.048","","","","0.152","","","","","","1.05","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2011212","15.59","0.002","10.889","0.002","11.87","0.001","90","","95.982","0.01","90","","2004.1","0.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C17 H24 Cl2 N4 Sn -","- C17 H24 Cl2 N4 Sn -","- C68 H96 Cl8 N16 Sn4 -","4","0.5","GG1001","Casas, José S.; García-Martínez, Emilia; García-Tasende, Soledad; Sánchez, Agustín; Sordo, José; Vázquez-López, Ezequiel M.; Vidarte, María José","Dichlorobis(3,5-dimethylpyrazole-<i>N</i>^2^)methylphenyltin(IV)","Acta Crystallographica Section C","2000","56","8","932","933","10.1107/S0108270100007058","","","0.71073","MoKα","","0.0516","0.0273","","","","0.0626","","","","","","1.02","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011213","22.736","0.005","30.654","0.006","8.799","0.002","90","","90","","90","","6132","2","150","2","","","","","","","","","","10","P n a 21","P 2c -2n","33","","","","- C49 H60 As4 Cl F12 N4 O5 P2 Re Ru -","- C49 H60 As4 Cl F12 N4 O5 P2 Re Ru -","- C196 H240 As16 Cl4 F48 N16 O20 P8 Re4 Ru4 -","4","1","GG1004","Coe, Benjamin J.; McDonald, Christopher I.; Coles, Simon J.; Hursthouse, Michael B.","<i>fac</i>,<i>trans</i>-[(2,2'-Bipyridine-<i>N</i>,<i>N</i>')tricarbonylrhenium(I)]-μ-(4,4'-bipyridine)-<i>N</i>:<i>N</i>'-{chlorobis[1,2-phenylenebis(dimethylarsine)]ruthenium(II)} bis(hexafluorophosphate) diacetone solvate","Acta Crystallographica Section C","2000","56","8","963","965","10.1107/S0108270100008076","","","0.71073","MoKα","","","0.0514","","","","0.1147","","","","","","0.989","","","","has coordinates,has disorder,has Fobs","198632","2020-10-21","18:00:00",""
"2011214","12.983","0.001","11.435","0.001","17.028","0.002","90","","95.35","0.02","90","","2517","0.4","296.2","","296.2","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C30 H27 O2 P -","- C30 H27 O2 P -","- C120 H108 O8 P4 -","4","1","GS1084","Muthuraman, Meiyappan; Nicoud, Jean-François; Masse, René; Desiraju, Gautam R.","Benzyltriphenylphosphonium glutaconaldehyde","Acta Crystallographica Section C","2000","56","8","986","988","10.1107/S0108270100005862","","","0.5608","AgKα","","0.054","0.054","","0.051","","0.051","","","1.996","","","2","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011215","5.386","0.0005","11.47","0.002","27.539","0.003","90","","90","","90","","1701.3","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Piv-Proψ[CH2-NH-O]Gly-NH^i^Pr","(S)-N-(tert-butylcarbonyl)-2-[[O-(N-isopropylacetamidyl)] -hydroxylaminomethylene]-pyrrolidine","","- C15 H29 N3 O3 -","- C15 H29 N3 O3 -","- C60 H116 N12 O12 -","4","1","GS1085","Corbier, Catherine; Didierjean, Claude; Thévenet, Laurent; Vanderesse, Regis; Marraud, Michel","Piv-Proψ[CH~2~‒NH‒O]Gly‒NH^<i>i^</i>Pr","Acta Crystallographica Section C","2000","56","8","995","996","10.1107/S0108270100006478","","","1.5406","CuKα","","0.059","0.0541","","","","0.1573","","","","","","1.063","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011216","16.024","0.003","17.073","0.003","16.067","0.003","90","","106.75","0.03","90","","4209.1","1.5","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C47 H66 N2 O4 -","- C47 H66 N2 O4 -","- C188 H264 N8 O16 -","4","1","GS1087","Leverd, Pascal C.; Weber, Dirk; Habicher, Wolf D.; Nierlich, Martine","Inclusion of HNEt~3~^+^ in an acyclic tetraphenolate","Acta Crystallographica Section C","2000","56","8","997","998","10.1107/S0108270100006582","","","0.71073","MoKα","","0.0906","0.0508","","","","0.123","","","","","","0.997","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011217","21.387","0.005","7.9328","0.001","15.184","0.003","90","","90.657","0.01","90","","2575.9","0.9","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","Cerous sodium nitrate monohydrate","disodium cerium pentanitrate monohydrate","","- Ce N5 Na2 O16 -","- Ce N5 Na2 O16 -","- Ce8 N40 Na16 O128 -","8","2","GS1089","Audebrand, Nathalie; Louër, Daniel","Cerous sodium nitrate monohydrate, Na~2~Ce(NO~3~)~5~·H~2~O","Acta Crystallographica Section C","2000","56","8","913","915","10.1107/S0108270100006211","","","0.71073","MoKα","","0.088","0.026","","","","0.062","","","","","","1.032","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011218","14.345","0.001","5.6905","0.0007","18.714","0.001","90","","96.064","0.009","90","","1519.1","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","YC-1","1-Benzyl-3-(5'-hydroxymethyl-2-furyl)indazole","","- C19 H16 N2 O2 -","- C19 H16 N2 O2 -","- C76 H64 N8 O8 -","4","1","GS1090","Sopková-de Oliveira Santos, Jana; Collot, Valérie; Bureau, Isabelle; Rault, Sylvain","YC-1, an activation inductor of soluble guanylyl cyclase","Acta Crystallographica Section C","2000","56","8","1035","1036","10.1107/S0108270100007393","","","0.71073","MoKα","","0.0683","0.0448","","","","0.1395","","","","","","1.06","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011219","11.0434","0.0005","11.0028","0.0003","12.746","0.0006","90","0.001","90","0.001","90","0.001","1548.75","0.11","298","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H23 N O4 -","- C16 H23 N O4 -","- C64 H92 N4 O16 -","4","1","GS1091","Kassem, Tarek; Rolland, Valérie; Martinez, Jean; Rolland, Marc","Two key chiral intermediates in a new 4-hydroxyisoleucine synthesis","Acta Crystallographica Section C","2000","56","8","1037","1039","10.1107/S010827010000740X","","","0.71073","MoKα","","","0.041","","","","0.058","","","","","","1.319","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011220","8.261","0.0003","12.5168","0.0005","14.9291","0.0003","90","0.001","90","0.001","90","0.001","1543.69","0.09","298","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H23 N O3 -","- C16 H23 N O3 -","- C64 H92 N4 O12 -","4","1","GS1091","Kassem, Tarek; Rolland, Valérie; Martinez, Jean; Rolland, Marc","Two key chiral intermediates in a new 4-hydroxyisoleucine synthesis","Acta Crystallographica Section C","2000","56","8","1037","1039","10.1107/S010827010000740X","","","0.71073","MoKα","","","0.039","","","","0.06","","","","","","1.309","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011221","14.453","0.003","10.3993","0.0013","25.371","0.002","90","","94.366","0.001","90","","3802.2","1","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22 H17 Cl Cu N2 O2 -","- C22 H17 Cl Cu N2 O2 -","- C176 H136 Cl8 Cu8 N16 O16 -","8","1","GS1092","Elerman, Yalc̨ın; Kara, Hülya; Özcan, Sabahat; Kendi̇, Engin","(Benzoylacetonato)chloro(1,10-phenanthroline)copper(II)","Acta Crystallographica Section C","2000","56","8","950","951","10.1107/S0108270100007411","","","1.5418","CuKα","","0.0565","0.0526","","","","0.1574","","","","","","1.064","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011222","18.5099","0.0002","15.0831","0.0002","18.5766","0.0002","90","","90.5023","0.0006","90","","5186.14","0.1","110","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C110 H126 N6 O24 Ru -","- C110 H126 N6 O24 Ru -","- C220 H252 N12 O48 Ru2 -","2","1","GS1094","Galardon, Erwan; Lukas, Michael; Le Maux, Paul; Toupet, Loïc; Roisnel, Thierry; Simonneaux, Gerard","Bis[(<i>R</i>)-1-phenylethyl isocyanido](5,10,15,20-tetrakis{2,6-bis[(<i>S</i>)-2,2-dimethyl-1,3-dioxolan-4-ylmethyloxy]phenyl}porphyrin)ruthenium(II) at 110K","Acta Crystallographica Section C","2000","56","8","955","956","10.1107/S0108270100007952","","","0.71069","MoKα","","0.049","0.039","","","","0.103","","","","","","1.025","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011223","7.152","0.002","8.806","0.003","14.004","0.004","90","","95.6","0.02","90","","877.8","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Triaqua(oxalato-O,O')oxovanadium(IV) dihydrate","","- C2 H10 O10 V -","- C2 H10 O10 V -","- C8 H40 O40 V4 -","4","1","JZ1392","Belaj, Ferdinand; Basch, Angelika; Udo Muster","Triaqua(oxalato-<i>O</i>,<i>O</i>')oxovanadium(IV) dihydrate","Acta Crystallographica Section C","2000","56","8","921","922","10.1107/S0108270100006491","","","0.71069","MoKα","","0.036","0.031","","","","0.081","","","","","","1.064","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011224","7.0662","0.0016","22.083","0.003","40.141","0.005","90","","90","","90","","6263.7","1.8","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","Methyl 3β-acetoxy-12-oxo-18β-olean-28-oate","","- C33 H52 O5 -","- C33 H52 O5 -","- C264 H416 O40 -","8","2","JZ1393","Gzella, Andrzej","Triterpenoide. XX. 3β-Acetoxy-12-oxo-18β-olean- und 3β-Acetoxy-12,19-dioxo-9(11),13(18)-oleandien-28-säure-methylester","Acta Crystallographica Section C","2000","56","8","983","985","10.1107/S0108270100005801","","","1.54178","CuKα","","0.088","0.044","","","","0.13","","","","","","1.077","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011225","7.9348","0.0008","15.8841","0.001","12.148","0.0008","90","","99.041","0.007","90","","1512.1","0.2","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","Methyl 3β-acetoxy-12,19-dioxoolean-9(11),13(18)-dien-28-oate","","- C33 H46 O6 -","- C33 H46 O6 -","- C66 H92 O12 -","2","1","JZ1393","Gzella, Andrzej","Triterpenoide. XX. 3β-Acetoxy-12-oxo-18β-olean- und 3β-Acetoxy-12,19-dioxo-9(11),13(18)-oleandien-28-säure-methylester","Acta Crystallographica Section C","2000","56","8","983","985","10.1107/S0108270100005801","","","1.54178","CuKα","","0.034","0.032","","","","0.092","","","","","","1.06","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011226","4.8995","0.001","11.33","0.0013","23.82","0.003","90","","90","","90","","1322.3","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(4S,5S)-(+)-4-Hydroxymethyl-2,5-diphenyloxazoline","","- C16 H15 N O2 -","- C16 H15 N O2 -","- C64 H60 N4 O8 -","4","1","JZ1397","Gzella, Andrzej; Rozwadowska, Maria D.","(4<i>S</i>,5<i>S</i>)-(+)-4-Hydroxymethyl-2,5-diphenyloxazoline","Acta Crystallographica Section C","2000","56","8","981","982","10.1107/S0108270100006818","","","1.54178","CuKα","","0.032","0.0289","","","","0.0817","","","","","","1.076","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011227","16.611","0.003","16.611","0.003","10.6471","0.0013","90","","90","","120","","2544.2","0.7","293","2","293","2","","","","","","","","4","R 3 :H","R 3","146","2'-Deoxy-5-methylisocytidine","2-amino-1-(2-deoxy-β-D-erythro-pentofuranosyl)-5-methylpyrimidin-4(1H)-one","","- C10 H15 N3 O4 -","- C10 H15 N3 O4 -","- C90 H135 N27 O36 -","9","1","JZ1402","Seela, Frank; He, Yang; Reuter, Hans; Heithoff, Eva-Maria","2'-Deoxy-5-methylisocytidine","Acta Crystallographica Section C","2000","56","8","989","991","10.1107/S0108270100006247","","","0.71073","MoKα","","0.044","0.039","","","","0.096","","","","","","1.053","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011228","7.804","0.0003","7.9946","0.0003","8.987","0.0003","106.331","0.003","108.534","0.003","105.041","0.003","471.17","0.03","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H12 N10 Ni O4 S2 -","- C12 H12 N10 Ni O4 S2 -","- C12 H12 N10 Ni O4 S2 -","1","0.5","","Abul-Haj, Mohammad; Quirós, Miguel; Salas, Juan M.","Diaquabis{4,5-dihydro-[1,2,4]triazolo-[2,3-a]pyrimidin-5-one-N^3^} bis(thiocyanato-N)nickel(II)","Acta Crystallographica, Section C","2000","56","","934","935","10.1107/S0108270100007198","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2011229","20.012","0.008","8.929","0.003","16.473","0.005","90","","93.34","0.04","90","","2938.5","1.8","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Dimethyl (1-Methyl-5-benzimidazolyl)aminomethylenepropanedioate Monohydrate","","- C14 H17 N3 O5 -","- C14 H17 N3 O5 -","- C112 H136 N24 O40 -","8","1","NA1459","Kettmann, Viktor; Lokaj, Jan; Kratky, Christoph; Milata, Viktor; Hodul, Pavol","Dimethyl (1-methyl-1,3-benzimidazol-5-yl)aminomethylenepropanedioate monohydrate","Acta Crystallographica Section C","2000","56","8","1007","1008","10.1107/S0108270100006995","","","0.71073","MoKα","","0.1367","0.0609","","0.1749","","0.1435","","","","","","1.011","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011230","9.0967","0.0014","8.8122","0.0013","12.5396","0.0014","90","","94.91","0.01","90","","1001.5","0.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis(4-Pyridineethanesulfonato-N) Tetraaquazinc","","- C14 H24 N2 O10 S2 Zn -","- C14 H24 N2 O10 S2 Zn -","- C28 H48 N4 O20 S4 Zn2 -","2","0.5","NA1464","Zeng, Xi-Rui; Xiong, Ren-Geng; Xu, Yan; Liu, Yong-Jiang; You, Xiao-Zeng","Tetraaquabis[2-(4-pyridyl)ethanesulfonato-<i>N</i>]zinc(II)","Acta Crystallographica Section C","2000","56","8","943","944","10.1107/S0108270100007964","","","0.71073","MoKα","","0.037","0.0329","","","","0.0915","","","","","","1.041","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011231","7.713","0.002","10.653","0.003","12.535","0.003","108.08","0.05","101.01","0.04","101.51","0.06","923.4","0.6","293","3","293","3","","","","","","","","6","P -1","-P 1","2","","[2,6-diacetylpyridine bis(S-methylisothiosemicarbazone)]iodonickel(II)","","- C13 H18 I N7 Ni S2 -","- C13 H18 I N7 Ni S2 -","- C26 H36 I2 N14 Ni2 S4 -","2","1","NA1472","Leovac, Vukadin M.; Bogdanović, Goran A.; Češljević, Valerija I.; Divjaković, Vladimir","Transition metal complexes with thiosemicarbazide-based ligands. XV. A square-pyramidal Ni^<b>II^</b> complex with an asymmetric coordination of 2,6-diacetylpyridine bis(<i>S</i>-methylisothiosemicarbazone)","Acta Crystallographica Section C","2000","56","8","936","938","10.1107/S0108270100007228","","","0.71073","MoKα","","0.0338","0.027","","0.0733","","0.0701","","","","","","1.356","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011232","26.23","0.005","5.881","0.0012","11.448","0.002","90","","90","","90","","1766","0.6","293","2","293","2","","","","","","","","5","P c a 21","P 2c -2ac","29","VENLAFAXINE HYDROCHLORIDE","1-[2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]cyclohexanol hydrochloride (Venlafaxine Hydrochloride)","","- C17 H28 Cl N O2 -","- C17 H28 Cl N O2 -","- C68 H112 Cl4 N4 O8 -","4","1","","Vega, Daniel; Fernández, Daniel; Echeverría, Gustavo","1-[2-(1-Hydroxycyclohexyl)-2-(4-methoxyphenyl)ethyl]dimethylammonium chloride (venlafaxine hydrochloride)","Acta Crystallographica Section C Crystal Structure Communications","2000","56","8","1009","1010","10.1107/S0108270100007009","","","0.71073","MoKα","","0.0917","0.0434","","","","0.1491","","","","","","1.046","","","","has coordinates","246016","2020-10-21","18:00:00",""
"2011233","14.5439","0.0002","9.7314","0.0003","9.0181","0.0003","90","","110.938","0.001","90","","1192.07","0.06","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1,2-dibenzoylhydrazine","","- C14 H12 N2 O2 -","- C14 H12 N2 O2 -","- C56 H48 N8 O8 -","4","0.5","NA1474","Shanmuga Sundara Raj, S; Yamin, Bohari M; Boshaala, Ahmed M.A.; Tarafder, M.T.H; Fun, Hoong-Kun","1,2-Dibenzoylhydrazine","Acta Crystallographica Section C","2000","56","8","1011","1012","10.1107/S0108270100007010","","","0.71073","MoKα","","0.0801","0.0534","","","","0.164","","","","","","0.959","","","","has coordinates,has Fobs","266859","2021-07-01","07:43:50",""
"2011234","7.306","0.002","7.759","0.002","13.141","0.003","89.28","0.02","79.34","0.02","75.63","0.02","708.7","0.3","213","","213","","","","","","","","","4","P -1","-P 1","2","tetraethylammonium hydroxide pentahydrate","tetraethylammonium hydroxide-water (1/5)","","- C8 H31 N O6 -","- C8 H31 N O6 -","- C16 H62 N2 O12 -","2","1","NA1475","Wiebcke, Michael; Felsche, Jürgen","NEt~4~OH·5H~2~O containing hydroxide‒water layers","Acta Crystallographica Section C","2000","56","8","1050","1052","10.1107/S0108270100007976","","","0.71073","MoKα","","0.092","0.04","","","","0.108","","","","","","0.976","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011235","11.9398","0.0006","11.8595","0.0006","11.3972","0.0006","90","","116.389","0.001","90","","1445.68","0.13","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","p-Methoxybenzaldehyde Benzoylhydrazone Monohydrate","","- C15 H16 N2 O3 -","- C15 H16 N2 O3 -","- C60 H64 N8 O12 -","4","1","NA1476","Shanmuga Sundara Raj, S.; Fun, Hoong-Kun; Lu, Zhong-Lin; Xiao, Wen; Gong, Xiao-Yang; Gen, Chang-Ming","<i>p</i>-Methoxybenzaldehyde benzoylhydrazone monohydrate","Acta Crystallographica Section C","2000","56","8","1013","1014","10.1107/S010827010000799X","","","0.71073","MoKα","","0.0992","0.0529","","","","0.1198","","","","","","0.925","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011236","7.679","0.004","7.004","0.005","10.372","0.005","90","","107.43","0.04","90","","532.2","0.5","293","2","293","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","O-Isopropyl N-(2-furoyl)thiocarbamate","","- C9 H11 N O3 S -","- C9 H11 N O3 S -","- C18 H22 N2 O6 S2 -","2","0.5","NA1477","Morales, Angel Dago; Novoa de Armas, Héctor; Blaton, Norbert M.; Peeters, Oswald M.; De Ranter, Camiel J.; Márquez, Heidy; Hernández, Ramón Pomés","<i>O</i>-Isopropyl <i>N</i>-(2-furoyl)thiocarbamate","Acta Crystallographica Section C","2000","56","8","1042","1043","10.1107/S0108270100007514","","","0.71073","MoKα","","0.169","0.055","","","","0.134","","","","","","0.979","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011237","7.513","0.0002","26.9091","0.0005","7.9141","0.0001","90","","90","","90","","1599.98","0.06","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","3-Methoxy-4-hydroxyl-benzaldehyde 4,5-Diaza-9-fluorenylidenehydrazone","","- C19 H14 N4 O2 -","- C19 H14 N4 O2 -","- C76 H56 N16 O8 -","4","1","NA1478","Shanmuga Sundara Raj, S.; Fun, Hoong-Kun; Lu, Zhong-Lin; Xiao, Wen; Gong, Xiao-Yang; Gen, Chang-Ming","4-Hydroxy-3-methoxybenzaldehyde 4,5-diazafluoren-9-ylidenehydrazone","Acta Crystallographica Section C","2000","56","8","1015","1016","10.1107/S0108270100007988","","","0.71073","MoKα","","0.0593","0.0405","","","","0.0932","","","","","","0.931","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011238","13.1846","0.0006","13.1846","0.0006","8.8493","0.0006","90","","90","","90","","1538.31","0.14","193","2","193","2","","","","","","","","6","I -4","I -4","82","","Tetrakis(3,4-ethylenedioxy-2-thienyl)silane carbon tetrachloride solvate","","- C25 H20 Cl4 O8 S4 Si -","- C25 H20 Cl4 O8 S4 Si -","- C50 H40 Cl8 O16 S8 Si2 -","2","0.25","OA1098","Han, Bong-Hwan; Choi, Moon-Gun","Tetrakis(3,4-ethylenedioxy-2-thienyl)silane carbon tetrachloride solvate","Acta Crystallographica Section C","2000","56","8","1001","1003","10.1107/S0108270100006740","","","0.71073","MoKα","","0.03","0.028","","","","0.074","","","","","","1.005","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011239","6.449","0.002","8.638","0.002","28.414","0.017","90","","90.48","0.04","90","","1582.8","1.1","273","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","PCH3ON2","4-phenyl-2-[4-Methoxyphenyldiazenyl]phenol","","- C19 H16 N2 O2 -","- C19 H16 N2 O2 -","- C76 H64 N8 O8 -","4","1","OB1031","Jiménez-Cruz, Federico; Pérez-Caballero, Guadalupe; Hernández-Ortega, Simón; Rubio-Arroyo, Manuel","2-(4-Methoxyphenylazo)-4-phenylphenol","Acta Crystallographica Section C","2000","56","8","1028","1029","10.1107/S0108270100007307","","","0.71073","MoKα","","0.1232","0.0482","","","","0.1268","","","","","","0.767","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011240","16.5579","0.0019","10.9208","0.0013","16.5426","0.0019","90","","114.748","0.008","90","","2716.6","0.6","293","2","303","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","1,3-bis(diphenylphosphino)propanetrichlorooxorhenium(V)","","- C27 H26 Cl3 O P2 Re -","- C27 H26 Cl3 O P2 Re -","- C108 H104 Cl12 O4 P8 Re4 -","4","1","OS1104","Suescun, Leopoldo; Mombrú, Alvaro W.; Mariezcurrena, Raúl A.; Pardo, Helena; Russi, Silvia; Kremer, Carlos; Rivero, Mario; Kremer, Eduardo","[1,3-Bis(diphenylphosphino)propane]trichlorooxorhenium(V)","Acta Crystallographica Section C","2000","56","8","930","931","10.1107/S0108270100006983","","","0.71069","MoKα","","0.0396","0.0261","","","","0.0717","","","","","","1.049","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011241","9.082","0.001","9.789","0.002","5.741","0.008","104.92","0.01","93.2","0.01","109.06","0.01","460.6","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2,2-dimethyl-1,3-propanediammonium chromate","","- C5 H16 Cr N2 O4 -","- C5 H16 Cr N2 O4 -","- C10 H32 Cr2 N4 O8 -","2","1","QA0286","Chebbi, Hammouda; Hajem, Amen Allah; Driss, Ahmed","Chromate de 2,2-diméthylpropylènediammonium","Acta Crystallographica Section C","2000","56","8","e333","e334","10.1107/S0108270100009677","","","0.71069","MoKα","","0.048","0.035","","","","0.088","","","","","","1.117","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011242","13.7053","0.0012","13.9751","0.0012","14.4614","0.0012","80.665","0.002","87.283","0.002","87.942","0.002","2729","0.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","(4,6-Dimercapto-1,3,5-triazine-2-thiolato-S^2^)tris(triphenylphosphine-P)gold(I) dimethylformamide solvate","","- C60 H54 Au N4 O P3 S3 -","- C60 H52 Au N4 O P3 S3 -","- C120 H104 Au2 N8 O2 P6 S6 -","2","1","QA0302","Zhao, Yingjun; Su, Weiping; Cao, Rong; Hong, Maochun","(4,6-Dimercapto-1,3,5-triazine-2-thiolato-<i>S</i>^2^)tris(triphenylphosphine-<i>P</i>)gold(I) dimethylformamide solvate","Acta Crystallographica Section C","2000","56","8","e331","e332","10.1107/S0108270100009665","","","0.71073","MoKα","","0.062","0.045","","","","0.113","","","","","","0.967","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2011243","10.73","0.002","9.659","0.002","15.287","0.003","90","","92.49","0.02","90","","1582.9","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(2-Hydroxy-4-methylphenyl)bis(4-methylphenyl)phosphine Oxide","","- C19 H17 O2 P -","- C19 H17 O2 P -","- C76 H68 O8 P4 -","4","1","QA0310","Bélanger-Gariépy, Francine; Dartiguenave, Michèle; Loiseau, Frédérique; Beauchamp, André L.","(2-Hydroxy-5-methylphenyl)diphenylphosphine oxide","Acta Crystallographica Section C","2000","56","8","e338","e339","10.1107/S0108270100008878","","","1.54178","CuKα","","0.039","0.035","","0.104","","0.103","","","1.045","","","1.092","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011244","10.359","0.001","12.693","0.002","10.102","0.007","97.49","0.03","91.42","0.02","94.96","0.01","1311.1","0.9","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C31 H36 Hf -","- C31 H36 Hf -","- C62 H72 Hf2 -","2","1","QA0315","Swenson, Dale C.; Guo, Zhaoyu; Crowther, Donna J.; Baenziger, Norman C.; Jordan, Richard F.","Tribenzyl(η^5^-pentamethylcyclopentadienyl)hafnium(IV)","Acta Crystallographica Section C","2000","56","8","e313","e314","10.1107/S010827010000888X","","","0.71073","MoKα","","0.036","0.029","","","","0.079","","","","","","1.068","","","","has coordinates,has disorder","176760","2020-10-21","18:00:00",""
"2011245","20.647","0.002","11.835","0.001","17.275","0.002","90","","96.253","0.005","90","","4196.2","0.7","293","2","293","2","","","","","","","","7","C 1 c 1","C -2yc","9","","Chloro(η^6^-p-cymene)(2-methyl-5-oxo-7-phenyl-5,6-dihydro-2H-1,2,4-triazepin- 3-thiolato-κ^2^N^4^,S)ruthenium","","- C21 H24 Cl N3 O Ru S -","- C21 H24 Cl N3 O Ru S -","- C168 H192 Cl8 N24 O8 Ru8 S8 -","8","2","QA0323","Aitali, Mustapha; Ait Itto, My Youssef; Hasnaoui, Aisa; Riahi, Abdelkhalek; Karim, Abdellah; García-Granda, Santiago; Gutiérrez-Rodríguez, Angel","Chloro(η^6^-<i>p</i>-cymene)(2-methyl-5-oxo-7-phenyl-5,6-dihydro-2<i>H</i>-1,2,4-triazepine-3-thiolato-κ^2^<i>N</i>^4^,<i>S</i>)ruthenium(II)","Acta Crystallographica Section C","2000","56","8","e315","e316","10.1107/S0108270100008891","","","1.54184","CuKα","","0.051","0.049","","","","0.119","","","","","","1.033","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011246","13.0428","0.0006","15.053","0.0011","21.0245","0.0015","90","","103.05","0.004","90","","4021.2","0.5","100","1","100","1","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","Aquabis(benzonitrile)(o-benzoquinone diimine)(triphenylphosphine)ruthenium(II) bis(tetrafluoroborate) hydrate","","- C38 H35 B2 F8 N4 O2 P Ru -","- C38 H35 B2 F8 N4 O2 P Ru -","- C152 H140 B8 F32 N16 O8 P4 Ru4 -","4","1","QA0326","Venegas-Yazigi, Diego; Lever, A. B. P.; Lough, Alan J.; Vega, Andrés; Paredes-García, Verónica; Costamagna, Juan; Latorre, Ramón","Aquabis(benzonitrile)(<i>o</i>-benzoquinone diimine)(triphenylphosphine)ruthenium(II) bis(tetrafluoroborate) hydrate","Acta Crystallographica Section C","2000","56","8","e323","e324","10.1107/S0108270100009215","","","0.71073","MoKα","","0.099","0.056","","","","0.167","","","","","","1.022","","","","has coordinates,has Fobs","191022","2020-10-21","18:00:00",""
"2011247","6.308","0.004","6.892","0.004","10.875","0.007","74.57","0.01","73.78","0.01","64.41","0.01","403.6","0.4","173","","173","2","","","","","","","","3","P -1","-P 1","2","","cis-4-cyclohexene-1,2-dicarboxylic acid","","- C8 H10 O4 -","- C8 H10 O4 -","- C16 H20 O8 -","2","1","QA0328","Bolte, Michael; Degen, Alexander","Redetermination of <i>cis</i>-4-cyclohexene-1,2-dicarboxylic acid at 173K","Acta Crystallographica Section C","2000","56","8","e340","e340","10.1107/S0108270100008908","","","0.71073","MoKα","","0.085","0.052","","","","0.127","","","","","","1.078","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011248","19.401","0.008","22.383","0.009","20.805","0.009","90","","107.89","0.04","90","","8598","6","193","2","193","2","","","","","","","","8","C 1 2 1","C 2y","5","","{2,2'-[(R,R)-Cyclohexane-1,2-diylbis(nitrilomethylidyne)]bis(6-tert-butyl-4- (triphenylphosphoniomethyl)phenolato-O,N,N',O'}copper(II) dichloride hexakis(deuterochloroform) solvate","","- C72 H68 Cl20 Cu D6 N2 O2 P2 -","- C72 H68 Cl20 Cu D6 N2 O2 P2 -","- C288 H272 Cl80 Cu4 D24 N8 O8 P8 -","4","1","QA0329","Pajunen, Aarne; Mutikainen, Ilpo; Haikarainen, Anssi; Sipilä, Jussi; Pietikäinen, Pekka","{2,2'-[(<i>R</i>,<i>R</i>)-Cyclohexane-1,2-diylbis(nitrilomethylidyne)]bis[6-<i>tert</i>-butyl-4-(triphenylphosphoniomethyl)phenolato]-<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>'}copper(II) dichloride hexakis(deuterochloroform) solvate","Acta Crystallographica Section C","2000","56","8","e321","e322","10.1107/S0108270100009203","","","0.71073","MoKα","","0.108","0.067","","","","0.188","","","","","","1.046","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011249","11.0632","0.0005","15.8711","0.0009","9.9597","0.0004","90","","97.559","0.003","90","","1733.58","0.14","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","bis(2-carboxybenzeneammonium) sulfate monohydrate","bis(anthranilium) sulfate monohydrate","","- C14 H18 N2 O9 S -","- C14 H18 N2 O9 S -","- C56 H72 N8 O36 S4 -","4","1","QA0330","Slouf, Miroslav","Bis(2-carboxyanilinium) sulfate monohydrate","Acta Crystallographica Section C","2000","56","8","e353","e353","10.1107/S010827010000915X","","","0.7107","MoKα","","0.08","0.053","","","","0.14","","","","","","1.026","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011250","7.6624","0.0006","5.5762","0.0004","15.2489","0.0011","90","","90","","90","","651.54","0.08","100","2","100","2","","","","","","","","4","P n a 21","P 2c -2n","33","","phenylphosphinic acid","","- C6 H7 O2 P -","- C6 H7 O2 P -","- C24 H28 O8 P4 -","4","1","QA0333","Robert A. Burrow; David H. Farrar; Alan J. Lough; Márcia R. Siqueira; Fatima Squizani","Phenylphosphinic acid","Acta Crystallographica Section C","2000","56","8","e357","e358","10.1107/S0108270100009227","","","0.71073","MoKα","","0.049","0.038","","","","0.089","","","","","","1.064","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011251","9.727","0.002","16.632","0.004","7.104","0.002","90","","90","","90","","1149.3","0.5","210","2","210","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C11 H13 N5 O2 -","- C11 H13 N5 O2 -","- C44 H52 N20 O8 -","4","1","QA0334","Swenson, Dale C.; Nair, Vasu; Bera, Sanjib","Two isomeric dideoxynucleosides","Acta Crystallographica Section C","2000","56","8","e343","e345","10.1107/S0108270100008921","","","0.71073","MoKα","","0.025","0.023","","","","0.064","","","","","","1.107","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011252","8.496","0.004","18.53","0.006","7.226","0.002","90","","90.81","0.04","90","","1137.5","0.7","200","2","200","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C11 H13 N5 O2 -","- C11 H13 N5 O2 -","- C44 H52 N20 O8 -","4","2","QA0334","Swenson, Dale C.; Nair, Vasu; Bera, Sanjib","Two isomeric dideoxynucleosides","Acta Crystallographica Section C","2000","56","8","e343","e345","10.1107/S0108270100008921","","","0.71073","MoKα","","0.07","0.049","","","","0.133","","","","","","0.973","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011253","9.131","0.002","22.09","0.005","7.175","0.003","90","","90.67","0.03","90","","1447.1","0.8","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","n-butylammonium dihydrogenphosphate","","- C3 H12 N O4 P -","- C3 H12 N O4 P -","- C24 H96 N8 O32 P8 -","8","2","QA0335","Fábry, Jan; Císařová, Ivana; Kroupa, Jan","Ferroelastic <i>n</i>-propylammonium dihydrogenphosphate","Acta Crystallographica Section C","2000","56","8","e359","e360","10.1107/S0108270100009598","","","0.71073","MoKα","","0.082","0.034","","0.039","","0.039","","","1.39","","","","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011254","9.438","0.002","8.529","0.002","16.503","0.003","90","","98.38","0.03","90","","1314.3","0.5","133","2","133","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(6R)-6-(3'β-acetoxy-5'-androsten-17'β-yl)-2-phenyl- 5,6-dihydro-4H-[1,3]oxazine","","- C31 H41 N O3 -","- C31 H41 N O3 -","- C62 H82 N2 O6 -","2","1","QA0336","Hewitt, Manuel; Schneider, Thomas R.; Szemerédi, Zsuzsanna; Hajnal, Andrea; Wölfling, Janos; Schneider, Gyula","A steroidal phenyldihydro-1,3-oxazine derivative","Acta Crystallographica Section C","2000","56","8","e363","e364","10.1107/S0108270100009628","","","0.71073","MoKα","","0.042","0.035","","","","0.083","","","","","","1.076","","","","has coordinates,has disorder","176760","2020-10-21","18:00:00",""
"2011255","17.0545","0.001","10.5812","0.0006","15.9456","0.0007","90","","91.332","0.006","90","","2876.7","0.3","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Tris(2,2'-bipyridyl-N,N')iron(II) diperchlorate","Tris(2,2'-bipyridyl-N,N')iron(II) diperchlorate","","- C30 H24 Cl2 Fe N6 O8 -","- C30 H24 Cl2 Fe N6 O8 -","- C120 H96 Cl8 Fe4 N24 O32 -","4","0.5","QA0337","Batten, Stuart R.; Murray, Keith S.; Sinclair, Nathan J.","Tris(2,2'-bipyridyl-<i>N</i>,<i>N</i>')iron(II) diperchlorate","Acta Crystallographica Section C","2000","56","8","e320","e320","10.1107/S0108270100009185","","","0.71073","MoKα","","0.118","0.061","","","","0.137","","","","","","1.061","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011256","12.874","0.004","13.76","0.005","24.974","0.007","98.82","0.03","93.97","0.02","117.8","0.03","3817","2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","methyltriphenylstibonium tetrafluoroborate","","- C19 H18 B F4 Sb -","- C19 H18 B F4 Sb -","- C152 H144 B8 F32 Sb8 -","8","4","QA0338","Low, John Nicolson; Ferguson, George; Wardell, James L.","Methyltriphenylstibonium tetrafluoroborate","Acta Crystallographica Section C","2000","56","8","e317","e317","10.1107/S0108270100008945","","","0.7093","MoKα","","0.11","0.057","","","","0.181","","","","","","1.028","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011257","14.061","0.005","6.644","0.003","21.018","0.01","90","","96.82","0.03","90","","1949.6","1.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","[2-(1-3H-Indenyl)ethyl]-diphenylphosphineborane","","- C23 H24 B P -","- C23 H24 B P -","- C92 H96 B4 P4 -","4","1","QA0339","Groux, Laurent F.; Zargarian, Davit","[2-(1<i>H</i>-Inden-3-yl)ethyl]diphenylphosphine‒borane","Acta Crystallographica Section C","2000","56","8","e366","e367","10.1107/S0108270100009690","","","1.54056","CuKα","","0.099","0.037","","0.078","","0.067","","","0.642","","","0.853","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011258","9.3965","0.0002","10.5437","0.0003","13.2813","0.0004","109.612","0.0016","90.009","0.002","103.902","0.002","1198.48","0.06","291","1","291","1","","","","","","","","5","P -1","-P 1","2","","","","- C26 H35 N O2 S -","- C26 H35 N O2 S -","- C52 H70 N2 O4 S2 -","2","1","QA0340","Hollmann, Christoph; Schürmann, Markus; Preut, Hans; Eilbracht, Peter","<i>N</i>-Benzyl-4-methyl-<i>N</i>-[(3a<i>R</i>*,4<i>R</i>*,7a<i>R</i>*)-6,6,7a-trimethylperhydroinden-4-yl]benzenesulfonamide","Acta Crystallographica Section C","2000","56","8","e352","e352","10.1107/S0108270100009148","","","0.71073","MoKα","","0.078","0.044","","","","0.123","","","","","","1.001","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011259","16.259","0.0006","8.0575","0.0002","14.7794","0.0006","90","","121.967","0.002","90","","1642.58","0.11","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","3,6-Bis[(4-hydroxyphenyl)methyl]piperazine-2,5-dione","","- C18 H18 N2 O4 -","- C18 H18 N2 O4 -","- C72 H72 N8 O16 -","4","0.5","QA0342","Razak, Ibrahim Abdul; Shanmuga Sundara Raj, S.; Fun, Hoong-Kun; Chen, Zhen-Feng; Zhang, Jing; Xiong, Ren-Gen; You, Xiao-Zeng","3,6-Bis(4-hydroxybenzyl)piperazine-2,5-dione","Acta Crystallographica Section C","2000","56","8","e341","e342","10.1107/S010827010000891X","","","0.71073","MoKα","","0.112","0.055","","","","0.146","","","","","","0.9","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011260","6.66","0.001","31.984","0.008","7.123","0.002","90","","114.93","0.02","90","","1375.9","0.6","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","7-Methoxy-3-(salicylideneamino)coumarin","","- C17 H13 N O4 -","- C17 H13 N O4 -","- C68 H52 N4 O16 -","4","1","QA0343","Khoo, Lian Ee; Zhang, Yiqun; Ng, Seik Weng","7-Methoxy-3-(salicylideneamino)coumarin","Acta Crystallographica Section C","2000","56","8","e350","e351","10.1107/S0108270100009136","","","0.71073","MoKα","","0.108","0.056","","","","0.172","","","","","","1.054","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011261","6.8821","0.0002","13.4754","0.0004","12.0807","0.0004","90","","100.338","0.0019","90","","1102.16","0.06","291","1","291","1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C12 H16 O4 -","- C12 H16 O4 -","- C48 H64 O16 -","4","1","QA0344","Roggenbuck, Rafael; Schürmann, Markus; Preut, Hans; Eilbracht, Peter","(5<i>S</i>*,6<i>R</i>*)-1,7-Dioxadispiro[4.0.4.4]tetradecane-2,8-dione","Acta Crystallographica Section C","2000","56","8","e356","e356","10.1107/S0108270100009173","","","0.71073","MoKα","","0.073","0.038","","","","0.101","","","","","","0.953","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011262","8.8863","0.0019","8.8863","0.0019","21.299","0.006","90","","90","","90","","1681.9","0.7","168","2","168","2","","","","","","","","6","P 41","P 4w","76","","(+)-(2R,3S)-3-Bromo-2-chloro-N,N-diisopropyl-3-phenylpropanamide","","- C15 H21 Br Cl N O -","- C15 H21 Br Cl N O -","- C60 H84 Br4 Cl4 N4 O4 -","4","1","QA0345","Chan, Bun; Wong Leh See, Elicia; Simpson, Jim; Tan, Eng Wui","(+)-(2<i>R</i>,3<i>S</i>)-3-Bromo-2-chloro-<i>N</i>,<i>N</i>-diisopropyl-3-phenylpropanamide and (+)-(2<i>R</i>,3<i>S</i>)-3-bromo-2-chloro-<i>N</i>-(4-nitrophenyl)-3-phenylpropanamide","Acta Crystallographica Section C","2000","56","8","e354","e355","10.1107/S0108270100009161","","","0.71073","MoKα","","0.071","0.053","","","","0.133","","","","","","0.992","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011263","13.9","0.004","14.648","0.005","15.553","0.005","90","","90","","90","","3166.7","1.7","170","2","170","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","(+)-(2R,3S)-3-Bromo-2-chloro-N-(4-nitrophenyl)-3-phenylpropanamide","","- C15 H12 Br Cl N2 O3 -","- C15 H12 Br Cl N2 O3 -","- C120 H96 Br8 Cl8 N16 O24 -","8","2","QA0345","Chan, Bun; Wong Leh See, Elicia; Simpson, Jim; Tan, Eng Wui","(+)-(2<i>R</i>,3<i>S</i>)-3-Bromo-2-chloro-<i>N</i>,<i>N</i>-diisopropyl-3-phenylpropanamide and (+)-(2<i>R</i>,3<i>S</i>)-3-bromo-2-chloro-<i>N</i>-(4-nitrophenyl)-3-phenylpropanamide","Acta Crystallographica Section C","2000","56","8","e354","e355","10.1107/S0108270100009161","","","0.71073","MoKα","","0.052","0.033","","","","0.066","","","","","","0.967","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011264","21.079","0.002","10.324","0.004","15.8637","0.0018","90","","109.78","0.009","90","","3248.6","1.4","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- H30 Mo6 Nd2 O38 Pt -","- Mo6 Nd2 O38 Pt -","- Mo24 Nd8 O152 Pt4 -","4","0.5","QA0346","Lee, Uk; Joo, Hea Chung","Dineodymium dihydrogen α-hexamolybdoplatinate(IV) tetradecahydrate, Nd~2~[H~2~α-PtMo~6~O~24~]·14H~2~O","Acta Crystallographica Section C","2000","56","8","e311","e312","10.1107/S0108270100009689","","","0.71069","MoKα","","0.081","0.05","","","","0.12","","","","","","1.132","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011265","44.44","0.02","9.651","0.004","19.527","0.007","90","","111.7","0.03","90","","7781","6","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","(3,5-dinitrobenzoato)bis(triphenylphosphine)silver(I)","","- C43 H33 Ag N2 O6 P2 -","- C43 H33 Ag N2 O6 P2 -","- C344 H264 Ag8 N16 O48 P16 -","8","1","QA0348","Othman, Abdul Hamid; Yang, Yang-Yi; Chen, Xiao-Ming; Ng, Seik Weng","Trigonal‒planar silver coordination in (3,5-dinitrobenzoato)bis(triphenylphosphine)silver(I)","Acta Crystallographica Section C","2000","56","8","e318","e319","10.1107/S0108270100008957","","","0.71073","MoKα","","0.069","0.042","","","","0.11","","","","","","1.029","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011266","9.23","0.008","10.907","0.006","12.056","0.012","112.68","0.06","95.2","0.07","106.05","0.06","1049.2","1.7","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H20 N2 S2 -","- C26 H20 N2 S2 -","- C52 H40 N4 S4 -","2","1","QA0350","Sen, Liao; Su, Cheng-Yong; Zhang, Ze-Fu; Liu, Han-Qin; Zhu, Hai-Liang","1,2-Bis(8-quinolylthiomethyl)benzene","Acta Crystallographica Section C","2000","56","8","e348","e349","10.1107/S0108270100009124","","","0.71073","MoKα","","0.082","0.046","","","","0.111","","","","","","1.03","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011267","19.6683","0.0016","18.7739","0.0016","19.8049","0.0017","90","","117.201","0.001","90","","6504.2","0.9","183","2","183","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C32 H23 B F15 In N2 O -","- C32.0025 H23 B F15 In N2 O -","- C256.02 H184 B8 F120 In8 N16 O8 -","8","2","QA0351","Guzei, Ilia A.; Delpech, Fabien; Jordan, Richard F.","[Hydroxytris(pentafluorophenyl)borato-<i>O</i>][<i>N</i>-isopropyl-2-(isopropylamino)troponiminato-<i>N</i>]methylindium(III)","Acta Crystallographica Section C","2000","56","8","e327","e328","10.1107/S010827010000963X","","","0.71073","MoKα","","0.058","0.031","","","","0.075","","","","","","0.966","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2011268","15.594","0.003","16.837","0.002","5.6919","0.0008","90","","90","","90","","1494.4","0.4","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(1R,8R,11R)-3,3,11-Trimethyl-6,6-ethylenedioxybicyclo[6.3.0]undecan-2-one","","- C16 H26 O3 -","- C16 H26 O3 -","- C64 H104 O12 -","4","1","QA0352","Yoshinobu Inouye","(1<i>R</i>,8<i>R</i>,11<i>R</i>)-3,3,11-Trimethyl-6,6-ethylenedioxybicyclo[6.3.0]undecan-2-one and (1<i>R</i>,2<i>R</i>,8<i>R</i>,11<i>R</i>)-3,3,11-trimethyl-6,6-ethylenedioxybicyclo[6.3.0]undecan-2-ol","Acta Crystallographica Section C","2000","56","8","e361","e362","10.1107/S0108270100009616","","","0.71073","MoKα","","0.172","0.068","","0.253","","0.168","","","1.066","","","1.038","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011269","10.368","0.003","16.3349","0.0014","10.211","0.003","90","","116.614","0.012","90","","1546.1","0.7","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","(1R,2R,8R,11R)-3,3,11-Trimethyl-6,6-ethylenedioxybicyclo[6.3.0]undecan-2-ol","","- C16 H28 O3 -","- C16 H28 O3 -","- C64 H112 O12 -","4","2","QA0352","Yoshinobu Inouye","(1<i>R</i>,8<i>R</i>,11<i>R</i>)-3,3,11-Trimethyl-6,6-ethylenedioxybicyclo[6.3.0]undecan-2-one and (1<i>R</i>,2<i>R</i>,8<i>R</i>,11<i>R</i>)-3,3,11-trimethyl-6,6-ethylenedioxybicyclo[6.3.0]undecan-2-ol","Acta Crystallographica Section C","2000","56","8","e361","e362","10.1107/S0108270100009616","","","0.71073","MoKα","","0.075","0.045","","0.127","","0.111","","","1.046","","","1.064","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2011270","8.0276","0.001","8.7013","0.0011","9.543","0.002","90","","105.901","0.013","90","","641.08","0.18","293","2","296","2","","","","","","","","4","P 1 2/n 1","-P 2yac","13","","Ethylene diammonium bis(hydrogenmalonate) monohydrate","","- C8 H18 N2 O9 -","- C8 H18 N2 O9 -","- C16 H36 N4 O18 -","2","0.5","QA0353","Barnes, John C.; Weakley, Timothy J. R.","Hydrogen bonding in ethylenediammonium bis(hydrogen malonate) monohydrate","Acta Crystallographica Section C","2000","56","8","e346","e347","10.1107/S0108270100008933","","","0.71073","MoKα","","0.058","0.044","","","","0.159","","","","","","0.787","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011271","12.166","0.0004","5.5725","0.0002","14.5413","0.0004","90","","109.247","0.002","90","","930.73","0.05","150","","150","","","","","","","","","5","P 1 21 1","P 2yb","4","","p-Cresyl 2,3-anhydro-5-phthalimido-1-thio-α-D-lyxofuranoside","","- C20 H17 N O4 S -","- C20 H17 N O4 S -","- C40 H34 N2 O8 S2 -","2","1","QA0356","Gallucci, Judith C.; Gadikota, Rajendrakumar Reddy; Lowary, Todd L.","<i>p</i>-Cresyl 2,3-anhydro-5-deoxy-5-phthalimido-1-thio-α-<small>D</small>-lyxofuranoside","Acta Crystallographica Section C","2000","56","8","e365","e365","10.1107/S0108270100009641","","","0.71073","MoKα","","0.058","0.047","","0.106","","0.102","","","1.048","","","1.086","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011272","10.146","0.004","9.003","0.007","15.035","0.002","90","","92.28","0.02","90","","1372.3","1.2","296","","296","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C8 H14 I2 N2 O2 Pt -","- C8 H14 I2 N2 O2 Pt -","- C32 H56 I8 N8 O8 Pt4 -","4","1","QA0357","Saltmarsh, Jennifer A.; Howell, Bob A.; Squattrito, Philip J.","<i>cis</i>-Bis(3,6-dihydro-2<i>H</i>-1,2-oxazine-<i>N</i>)diiodoplatinum(II) and <i>cis</i>-bis(3,4,5,6-tetrahydro-2<i>H</i>-1,2-oxazine-<i>N</i>)diiodoplatinum(II)","Acta Crystallographica Section C","2000","56","8","e335","e337","10.1107/S0108270100009707","","","0.7107","MoKα","","","0.03","","","","0.028","","","","","","1.48","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011273","9.379","0.005","9.537","0.004","8.95","0.004","91.1","0.04","98.37","0.04","66.98","0.04","728.3","0.6","296","","296","","","","","","","","","6","P -1","-P 1","2","","","","- C8 H18 I2 N2 O2 Pt -","- C8 H18 I2 N2 O2 Pt -","- C16 H36 I4 N4 O4 Pt2 -","2","1","QA0357","Saltmarsh, Jennifer A.; Howell, Bob A.; Squattrito, Philip J.","<i>cis</i>-Bis(3,6-dihydro-2<i>H</i>-1,2-oxazine-<i>N</i>)diiodoplatinum(II) and <i>cis</i>-bis(3,4,5,6-tetrahydro-2<i>H</i>-1,2-oxazine-<i>N</i>)diiodoplatinum(II)","Acta Crystallographica Section C","2000","56","8","e335","e337","10.1107/S0108270100009707","","","0.7107","MoKα","","","0.052","","","","0.058","","","","","","2.7","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011274","9.486","0.0019","18.974","0.004","10.759","0.002","90","","92.48","0.03","90","","1934.7","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-poly[[[diaqua(isonicotinato-O,O')europium(III)]-di-μ-isonicotinato-O:O'] dihydrate]","","- C18 H16 Eu N3 O8 -","- C18 H16 Eu N3 O8 -","- C72 H64 Eu4 N12 O32 -","4","1","QA0360","Zeng, Xi-Rui; Xu, Yan; Xiong, Ren-Geng; Zhang, Li-Juan; You, Xiao-Zeng","<i>catena</i>-Poly[[diaqua(isonicotinato-<i>O</i>,<i>O</i>')europium(III)]-di-μ-isonicotinato-<i>O</i>:<i>O</i>']","Acta Crystallographica Section C","2000","56","8","e325","e326","10.1107/S0108270100009604","","","0.71073","MoKα","","0.03","0.025","","","","0.07","","","","","","1.091","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011275","11.668","0.005","12.445","0.005","8.918","0.005","96.697","0.005","106.143","0.005","106.72","0.005","1163.8","0.9","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C19 H25 Ba N3 O5 S2 -","- C19 H25 Ba N3 O5 S2 -","- C38 H50 Ba2 N6 O10 S4 -","2","1","QA0361","Yamamoto, Emi; Kubo, Kanji; Kato, Nobuo; Mori, Akira","Bis[μ-2-(1,4,7,10-tetraoxa-13-azacyclopentadeca-13-yl)cyclohepta-2,4,6-trien-1-one]bis[bis(thiocyanato)barium(II)]","Acta Crystallographica Section C","2000","56","8","e329","e330","10.1107/S0108270100009653","","","0.71073","MoKα","","0.035","0.026","","","","0.07","","","","","","1.147","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011276","10.853","0.001","11.547","0.001","7.821","0.001","96.97","0.01","110.03","0.01","86.84","0.01","913.94","0.18","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Bis[3-(o-methoxyphenyl)-1-methyltriazene 1-oxide(1-)-O,N^3^,O']zinc(II)","Bis[3-(o-methoxyphenyl)-1-methyltriazene 1-oxide(1-)-O,N^3^,O']zinc(II)","","- C16 H20 N6 O4 Zn -","- C16 H20 N6 O4 Zn -","- C32 H40 N12 O8 Zn2 -","2","1","SK1370","Mukherjee, Alok K.; Samanta, Chitra; Mukherjee, Monika; Helliwell, M.","Bis[3-(<i>o</i>-methoxyphenyl)-1-methyltriazene 1-oxidato-<i>O</i>,<i>N</i>^3^,<i>O</i>']zinc(II)","Acta Crystallographica Section C","2000","56","8","952","954","10.1107/S0108270100008003","","","1.5418","CuKα","","0.048","0.042","","","","0.122","","","","","","0.966","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011277","14.5912","0.0019","7.0951","0.0011","15.8414","0.0013","90","","99.138","0.008","90","","1619.2","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","sarcosinium trifluoroacetate","N-methylglycinium trifluoroacetate","","- C5 H8 F3 N O4 -","- C5 H8 F3 N O4 -","- C40 H64 F24 N8 O32 -","8","1","SK1378","Rodrigues, V. H.; Paixão, J. A.; Costa, M.M.R.R.; Matos Beja, A.","Sarcosinium trifluoroacetate","Acta Crystallographica Section C","2000","56","8","1053","1055","10.1107/S010827010000809X","","","0.71073","MoKα","","0.071","0.0557","","","","0.1792","","","","","","1.038","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011278","18.1212","0.0003","18.0363","0.0002","21.8937","0.0001","90","","98.454","0.001","90","","7077.97","0.15","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Dicyclohexylammonium 4-oxo-4H-pyran-2,6-dicarboxylatotributylstannate","","- C31 H53 N O6 Sn -","- C31 H53 N O6 Sn -","- C248 H424 N8 O48 Sn8 -","8","2","SK1382","Ng, Seik Weng; Shanmuga Sundara Raj, S.; Fun, Hoong-Kun; Razak, Ibrahim Abdul; Hook, James M.","Linear chains in polymeric dicyclohexylammonium tributyl(4-oxo-4<i>H</i>-pyran-2,6-dicarboxylato)stannate and methylphenylammonium tributyl(pyridine-2,6-dicarboxylato)stannate containing trigonal bipyramidal tin","Acta Crystallographica Section C","2000","56","8","966","968","10.1107/S0108270100008106","","","0.71073","MoKα","","0.128","0.0681","","","","0.1889","","","","","","1.072","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011279","17.7536","0.0003","9.3746","0.0001","17.8985","0.0002","90","","102.981","0.001","90","","2902.77","0.07","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Methylphenylammonium 2,6-pyridinedicarboxylatotributylstannate","","- C26 H40 N2 O4 Sn -","- C26 H40 N2 O4 Sn -","- C104 H160 N8 O16 Sn4 -","4","1","SK1382","Ng, Seik Weng; Shanmuga Sundara Raj, S.; Fun, Hoong-Kun; Razak, Ibrahim Abdul; Hook, James M.","Linear chains in polymeric dicyclohexylammonium tributyl(4-oxo-4<i>H</i>-pyran-2,6-dicarboxylato)stannate and methylphenylammonium tributyl(pyridine-2,6-dicarboxylato)stannate containing trigonal bipyramidal tin","Acta Crystallographica Section C","2000","56","8","966","968","10.1107/S0108270100008106","","","0.71073","MoKα","","0.0701","0.0488","","","","0.1552","","","","","","1.06","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2011280","8.571","0.0007","6.4665","0.0003","9.8502","0.0008","90","","106.783","0.003","90","","522.69","0.07","291","1","291","1","","","","","","","","3","P 1 21 1","P 2yb","4","","(-)-(1R,2S,2'R,5R)-2-(1-Hydroxyprop-2-yl)-5-methylcyclohexanol","","- C10 H20 O2 -","- C10 H20 O2 -","- C20 H40 O4 -","2","1","SK1383","Körner, Ferdinand; Schürmann, Markus; Preut, Hans; Kreiser, Wolfgang","(‒)-(1<i>R</i>,2<i>S</i>,2'<i>R</i>,5<i>R</i>)-2-(1-Hydroxyprop-2-yl)-5-methylcyclohexanol. Corrigendum","Acta Crystallographica Section C","2000","56","8","1056","1056","10.1107/S0108270100005011","","","0.71069","MoKα","","0.063","0.036","","","","0.081","","","","","","1.012","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011281","10.006","0.004","8.543","0.003","26.09","0.01","90","","98.52","0.04","90","","2205.6","1.5","296.2","","296.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(E)-2-(2-α-Naphthyl)vinyl-3-p-tosyl benzothiazoline","","- C26 H21 N O2 S2 -","- C26 H21 N O2 S2 -","- C104 H84 N4 O8 S8 -","4","1","SK1385","Maiti, Susim; Mukherjee, Monika; Nandi, Bidisha; Helliwell, Madeleine; Kundu, Nitya G.","(<i>E</i>)-2-[2-(1-Naphthyl)vinyl]-3-tosyl-2,3-dihydro-1,3-benzothiazole","Acta Crystallographica Section C","2000","56","8","992","994","10.1107/S0108270100006259","","","1.5418","CuKα","","0.144","0.069","","","","0.225","","","","","","1.012","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011282","16.2515","0.0016","16.2515","0.0016","13.7964","0.0019","90","","90","","90","","3643.8","0.7","173","1","173","1","","","","","","","","5","P 41","P 4w","76","","(M)-8-[(1S,2R)-2-hydroxy-1-methyl-2-phenylethyl]-8-methyl- 8,9-dihydro-7H-dinaphth[2,1-c:1',2'-e]azepinium bromide acetone (1/3) solvate","","- C41 H48 Br N O4 -","- C41 H48 Br N O4 -","- C164 H192 Br4 N4 O16 -","4","1","SK1391","Schneider, Monica; Linden, Anthony; Rippert, Andreas, J.","(<i>M</i>)- and (<i>P</i>)-8-[(1<i>S</i>,2<i>R</i>)-2-hydroxy-1-methyl-2-phenylethyl]-8-methyl-8,9-dihydro-7<i>H</i>-dinaphth[2,1-<i>c</i>:1',2'-<i>e</i>]azepinium bromide solvates","Acta Crystallographica Section C","2000","56","8","1004","1006","10.1107/S0108270100006739","","","0.71069","MoKα","","0.197","0.065","","","","0.169","","","","","","1.004","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011283","8.234","0.003","12.267","0.002","14.3806","0.0019","90","","98.015","0.015","90","","1438.3","0.6","173","1","173","1","","","","","","","","6","P 1 21 1","P 2yb","4","","(P)-8-[(1S,2R)-2-hydroxy-1-methyl-2-phenylethyl]-8-methyl- 8,9-dihydro-7H-dinaphth[2,1-c:1',2'-e]azepinium bromide dichloromethane (1/1) solvate","","- C33 H32 Br Cl2 N O -","- C33 H32 Br Cl2 N O -","- C66 H64 Br2 Cl4 N2 O2 -","2","1","SK1391","Schneider, Monica; Linden, Anthony; Rippert, Andreas, J.","(<i>M</i>)- and (<i>P</i>)-8-[(1<i>S</i>,2<i>R</i>)-2-hydroxy-1-methyl-2-phenylethyl]-8-methyl-8,9-dihydro-7<i>H</i>-dinaphth[2,1-<i>c</i>:1',2'-<i>e</i>]azepinium bromide solvates","Acta Crystallographica Section C","2000","56","8","1004","1006","10.1107/S0108270100006739","","","0.71069","MoKα","","0.07","0.039","","","","0.096","","","","","","1.017","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011284","12.0927","0.0002","25.2129","0.0005","15.4999","0.0003","90","","102.392","0.001","90","","4615.7","0.15","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[(Diisopropyldithiocarbamate) Bis(triphenylphosphines) Gold(I)] butane Solvate","","- C47 H54 Au N P2 S2 -","- C47 H54 Au N P2 S2 -","- C188 H216 Au4 N4 P8 S8 -","4","1","SK1392","Jian, Fangfang; Lu, Lude; Wang, Xin; Shanmuga Sundara Raj, S.; Razak, Ibrahim Abdul; Fun, Hoong-Kun","(<i>N</i>,<i>N</i>-Diisopropyldithiocarbamato-<i>S</i>,<i>S</i>')bis(triphenylphosphine-<i>P</i>)gold(I) butane solvate","Acta Crystallographica Section C","2000","56","8","939","940","10.1107/S0108270100007319","","","0.71073","MoKα","","0.128","0.052","","","","0.119","","","","","","0.988","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011285","18.292","0.007","10.969","0.003","21.363","0.008","90","","105.093","0.0017","90","","4139","2","150","1","150","1","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","trans-Chloro(2-nitrobenzenethiolato-S)bis(triphenylphosphine-P)palladium(II) monoacetone solvate","","- C45 H40 Cl N O3 P2 Pd S -","- C45 H40 Cl N O3 P2 Pd S -","- C180 H160 Cl4 N4 O12 P8 Pd4 S4 -","4","1","SK1393","Aupers, John H.; Ferguson, George; Glidewell, Christopher; Low, John N.; Wardell, James L.","<i>trans</i>-Chloro(2-nitrobenzenethiolato-<i>S</i>)bis(triphenylphosphine-<i>P</i>)palladium(II) monoacetone solvate","Acta Crystallographica Section C","2000","56","8","945","947","10.1107/S0108270100007320","","","0.71073","MoKα","","0.139","0.053","","","","0.147","","","","","","0.943","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011286","10.3499","0.0006","10.3499","0.0006","14.6652","0.0011","90","","90","","120","","1360.48","0.15","173","1","173","1","","","","","","","","6","P 63","P 6c","173","","tris(1,6-dihydro-9H-purine-6-thione-N^7^,S)iron(II) tetrachloroferrate(III) chloride","","- C15 H12 Cl5 Fe2 N12 S3 -","- C15 H12 Cl5 Fe2 N12 S3 -","- C30 H24 Cl10 Fe4 N24 S6 -","2","0.333333","SK1395","Schmalle, Helmut W.; Gyr, Ernst; Dubler, Erich","A mixed-valence iron complex of the antitumour drug 6-mercaptopurine: tris(6-mercaptopurine)iron(II) tetrachloroferrate(III) chloride","Acta Crystallographica Section C","2000","56","8","957","959","10.1107/S0108270100008118","","","0.71073","MoKα","","0.024","0.021","","","","0.038","","","","","","1.098","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011287","8.488","0.0002","22.7523","0.0002","8.781","0.0002","90","","114.929","0.001","90","","1537.8","0.05","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4,5-Diaza-9-fluorenone Benzoylhydrazone Monohydrate","","- C18 H14 N4 O2 -","- C18 H14 N4 O2 -","- C72 H56 N16 O8 -","4","1","SK1396","Lu, Zhong-Lin; Xiao, Wen; Chen, Zhong-Ning; Gong, Xiao-Yang; Shanmuga Sundara Raj, S.; Razak, Ibrahim Abdul; Fun, Hoong-Kun","4,5-Diazafluoren-9-one benzoylhydrazone monohydrate","Acta Crystallographica Section C","2000","56","8","1017","1018","10.1107/S0108270100007459","","","0.71073","MoKα","","0.1153","0.0614","","","","0.1207","","","","","","0.93","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011288","7.7198","0.0001","20.4639","0.0003","15.9112","0.0002","90","","90","","90","","2513.61","0.06","293","2","293","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","Trans-dichloro (1, 5, 9, 13-tetramethyl-1, 5, 9, 13-tetrazacyclohexadecane) Ruthenium(III)triiodide","","- C16 H36 Cl2 I3 N4 Ru -","- C16 H36 Cl2 I3 N4 Ru -","- C64 H144 Cl8 I12 N16 Ru4 -","4","0.5","SK1397","Zeng, Xi-Rui; Shanmuga Sundara Raj, S.; Fun, Hoong-Kun; Zuo, Jing-Lin; You, Xiao-Zeng","<i>trans</i>-Dichloro(1,5,9,13-tetramethyl-1,5,9,13-tetrazacyclohexadecane-κ^4^<i>N</i>)ruthenium(III) triiodide","Acta Crystallographica Section C","2000","56","8","941","942","10.1107/S0108270100007460","","","0.71073","MoKα","","0.0525","0.0392","","","","0.0867","","","","","","1.159","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011289","10.418","0.002","8.88","0.006","13.56","0.002","90","","91.36","0.01","90","","1254.1","0.9","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Methyl 2-N-Benzylamino -2,3-dideoxy -4,6-O-(phenyl methylene)- 3-C-phenylsulfonyl a\-D-glucopyranoside","","- C27 H29 N O6 S -","- C27 H29 N O6 S -","- C54 H58 N2 O12 S2 -","2","1","VJ1104","Suresh, Cheravakkattu G.; Ravindran, Bindu; Rao, K. Narasimha; Pathak, Tanmaya","Comparison of the two anomers of methyl 2-(<i>N</i>-benzylamino)-2,3-dideoxy-4,6-<i>O</i>-phenylmethylene-3-<i>C</i>-phenylsulfonyl-<small>D</small>-glucopyranoside","Acta Crystallographica Section C","2000","56","8","1030","1032","10.1107/S0108270100007344","","","1.5418","CuKa","","0.0347","0.0333","","0.0927","","0.0904","","","1.056","","","1.054","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011290","8.319","0.001","13.197","0.002","5.75","0.002","100.84","0.02","98.61","0.02","89.43","0.01","612.9","0.2","293","2","293","2","","","","","","","","5","P 1","P 1","1","","Methyl 2-N-Benzylamino -2,3-dideoxy -4,6-O-(phenyl methylene)- 3-C-phenylsulfonyl b\-D-glucopyranoside","","- C27 H29 N O6 S -","- C27 H29 N O6 S -","- C27 H29 N O6 S -","1","1","VJ1104","Suresh, Cheravakkattu G.; Ravindran, Bindu; Rao, K. Narasimha; Pathak, Tanmaya","Comparison of the two anomers of methyl 2-(<i>N</i>-benzylamino)-2,3-dideoxy-4,6-<i>O</i>-phenylmethylene-3-<i>C</i>-phenylsulfonyl-<small>D</small>-glucopyranoside","Acta Crystallographica Section C","2000","56","8","1030","1032","10.1107/S0108270100007344","","","1.5418","CuKα","","0.0696","0.0694","","0.2029","","0.2025","","","1.104","","","1.106","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011291","6.0315","0.0007","7.249","0.0008","12.8693","0.0019","90","","91.921","0.009","90","","562.36","0.12","135","2","135","2","","","","","","","","4","P 1 21 1","P 2yb","4","","4,2'-Anhydro-5-(β-D-arabinofuranosyl)-uracil dihydrate","","- C9 H14 N2 O7 -","- C9 H14 N2 O7 -","- C18 H28 N4 O14 -","2","1","AV1044","Bats, Jan W.; Parsch, Uwe; Engels, Joachim W.","Solid-state transformation of 4,2'-anhydro-5-(β-<small>D</small>-arabinofuranosyl)uracil dihydrate to 4,2'-anhydro-5-(β-<small>D</small>-arabinofuranosyl)uracil monohydrate","Acta Crystallographica Section C","2000","56","9","1129","1131","10.1107/S0108270100007794","","","0.71073","MoKα","","0.026","0.025","","","","0.076","","","","","","1.377","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011292","6.024","0.002","7.218","0.003","12.357","0.004","90","","101.4","0.04","90","","526.7","0.3","137","2","137","2","","","","","","","","4","P 1 21 1","P 2yb","4","","4,2'-Anhydro-5-(β-D-arabinofuranosyl)-uracil monohydrate","","- C9 H12 N2 O6 -","- C9 H12 N2 O6 -","- C18 H24 N4 O12 -","2","1","AV1044","Bats, Jan W.; Parsch, Uwe; Engels, Joachim W.","Solid-state transformation of 4,2'-anhydro-5-(β-<small>D</small>-arabinofuranosyl)uracil dihydrate to 4,2'-anhydro-5-(β-<small>D</small>-arabinofuranosyl)uracil monohydrate","Acta Crystallographica Section C","2000","56","9","1129","1131","10.1107/S0108270100007794","","","0.71073","MoKα","","0.082","0.054","","","","0.11","","","","","","1.376","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011293","9.282","","10.803","","7.887","","90","","111.45","","90","","736.08","","122","2","122","2","","","","","","","","4","C 1 c 1","C -2yc","9","N-Methyl-DL-Aspartic Acid monohydrate","N-Methyl-DL-Aspartic Acid","","- C5 H11 N O5 -","- C5 H11 N O5 -","- C20 H44 N4 O20 -","4","1","AV1045","Madsen, Dennis; Pattison, Philip","<i>N</i>-Methyl-<small>DL</small>-aspartic acid monohydrate","Acta Crystallographica Section C","2000","56","9","1157","1158","10.1107/S0108270100008593","","","0.7","Synchrotron","","0.0297","0.0297","","","","0.074","","","","","","1.312","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011294","13.386","0.003","3.75","0.001","14.35","0.003","90","","101.88","0.03","90","","704.9","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3,5-pyrazoledicarboxylic acid monohydrate","","- C5 H6 N2 O5 -","- C5 H6 N2 O5 -","- C20 H24 N8 O20 -","4","1","BK1520","Ching, Nancy; Pan, Long; Huang, Xiaoying; Li, Jing","3,5-Pyrazoledicarboxylic acid monohydrate","Acta Crystallographica Section C","2000","56","9","1124","1125","10.1107/S0108270100007484","","","0.71073","MoKα","","0.0845","0.0401","","","","0.0792","","","","","","1.175","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011295","10.7364","0.0011","14.0507","0.0013","13.5546","0.0013","90","","105.104","0.002","90","","1974.1","0.3","298","2","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[Chloro-(1,5-bis(2-hydroxybenzyl)-1,5-diazacyclooctane) cadmium(II)]","","- C20 H25 Cd Cl N2 O2 -","- C20 H25 Cd Cl N2 O2 -","- C80 H100 Cd4 Cl4 N8 O8 -","4","1","BK1538","Du, Miao; Weng, Lin-Hong; Leng, Xue-Bing; Bu, Xian-He; Zhang, Ruo-Hua","Chloro(2-{[5-(2-hydroxybenzyl-<i>O</i>)-1,5-diaza-1-cyclooctyl-<i>N</i>,<i>N</i>']methyl}phenolato-<i>O</i>)cadmium(II)","Acta Crystallographica Section C","2000","56","9","1090","1091","10.1107/S010827010000901X","","","0.71073","MoKα","","","0.0333","","","","0.0614","","","","","","0.935","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011296","7.9476","0.0002","11.5546","0.0003","29.4257","0.0008","90","","90","","90","","2702.2","0.12","150","2","150","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","4'-Vinyl-2,2':6',2''-terpyridine","","- C17 H13 N3 -","- C17 H13 N3 -","- C136 H104 N24 -","8","1","BM1415","Liu, Xiaoming; Kilner, Colin A.; Thornton-Pett, Mark; Halcrow, Malcolm A.","4'-Vinyl-2,2':6',2''-terpyridine","Acta Crystallographica Section C","2000","56","9","1142","1143","10.1107/S0108270100008295","","","0.71073","MoKα","","0.0747","0.0521","","","","0.147","","","","","","1.044","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011297","9.577","0.004","9.972","0.004","7.602","0.004","106.11","0.03","95.12","0.03","78.22","0.03","682.4","0.5","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","1-Methyl-3,5-di(N,N-dimethylaminomethylen)amino-4-nitropyrazol","","- C10 H17 N7 O2 -","- C10 H17 N7 O2 -","- C20 H34 N14 O4 -","2","1","BR1291","Chernyshev, Vladimir V.; Tafeenko, Victor A.; Makarov, Vadim A.; Sonneveld, Eduard J.; Schenk, Hendrik","3,5-Bis[(<i>N</i>,<i>N</i>-dimethylamino)methyleneamino]-1-methyl-4-nitropyrazole from X-ray powder diffraction data","Acta Crystallographica Section C","2000","56","9","1159","1160","10.1107/S010827010000860X","","","1.54059","CuKα~1~","","","","","","","","","","2.67","","","","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011298","4.9084","0.0002","13.6795","0.0007","9.0482","0.0004","90","","105.414","0.001","90","","585.68","0.05","299","2","299","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","strontium gallium borate hydroxide","","","- B4 Ga3 H O14 Sr3 -","- B4 Ga3 H O14 Sr3 -","- B8 Ga6 H2 O28 Sr6 -","2","0.5","BR1297","Barbier, Jacques; Park, Hyunsoo","A new orthoborate, Sr~3~Ga~3~(BO~3~)~4~O(OH)","Acta Crystallographica Section C","2000","56","9","1057","1058","10.1107/S0108270100009021","","","0.71073","MoKα","","0.0534","0.0348","","0.0804","","0.0735","","","1.055","","","1.119","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011299","10.5757","0.0006","15.0449","0.0008","14.771","0.0008","90","","92.954","0.001","90","","2347.1","0.2","153","2","153","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","rubidium titanium polytelluride","","- Rb3 Te11 Ti3 -","- Rb3 Te11 Ti3 -","- Rb12 Te44 Ti12 -","4","1","BR1300","Huang, Fu Qiang; Ibers, James A.","Rb~3~Ti~3~Te~11~","Acta Crystallographica Section C","2000","56","9","1059","1061","10.1107/S0108270100009367","","","0.71073","MoKα","","0.0359","0.0281","","","","0.0658","","","","","","1.037","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2011300","8.461","0.002","15.653","0.003","14.269","0.003","90","","91.37","0.03","90","","1889.2","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","tri(ethylenediamino)manganous telluride","","- C6 H24 Mn N6 Te4 -","- C6 H24 Mn N6 Te4 -","- C24 H96 Mn4 N24 Te16 -","4","1","DA1117","Chen, Zhen; Wang, Ru-Ji; Xiao-Ying Huang; Li, Jing","Molecular building blocks for solid-state chalcogenides: solvothermal synthesis of [Mn(en)~3~]Te~4~ and [Fe(en)~3~]~2~(Sb~2~Se~5~)","Acta Crystallographica Section C","2000","56","9","1100","1103","10.1107/S0108270100006879","","","0.71073","MoKα","","0.0731","0.0411","","","","0.0717","","","","","","1.343","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011301","15.774","0.003","11.739","0.002","18.239","0.004","90","","90","","90","","3377.3","1.1","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","di[tri(ethylenediamino)ferro] antimony selenide","","- C12 H48 Fe2 N12 Sb2 Se5 -","- C12 H48 Fe2 N12 Sb2 Se5 -","- C48 H192 Fe8 N48 Sb8 Se20 -","4","0.5","DA1117","Chen, Zhen; Wang, Ru-Ji; Xiao-Ying Huang; Li, Jing","Molecular building blocks for solid-state chalcogenides: solvothermal synthesis of [Mn(en)~3~]Te~4~ and [Fe(en)~3~]~2~(Sb~2~Se~5~)","Acta Crystallographica Section C","2000","56","9","1100","1103","10.1107/S0108270100006879","","","0.71073","MoKα","","0.182","0.0823","","","","0.1711","","","","","","1.067","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011302","13.029","0.002","10.819","0.002","21.66","0.003","90","","99.16","0.01","90","","3014.3","0.8","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","N-methyl-4'-methoxy-4-stilbazolium tetraphenylborate","4-[2-(4-methoxyphenyl)ethenyl]-N-methylpyridinum tetraphenylborate","","- C39 H36 B N O -","- C39 H36 B N O -","- C156 H144 B4 N4 O4 -","4","1","DA1127","Li, Shu-Jin; Zhang, De-Chun; Huang, Zhong-Lin; Zhang, Yan-Qiu; Yu, Kai-Bei","4-[2-(4-Methoxyphenyl)ethenyl]-<i>N</i>-methylpyridinium tetraphenylborate","Acta Crystallographica Section C","2000","56","9","1122","1123","10.1107/S0108270100007538","","","0.71073","MoKα","","0.07","0.036","","","","0.088","","","","","","0.868","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011303","9.996","0.001","10.933","0.002","14.385","0.003","78.13","0.02","83.74","0.01","65.59","0.01","1400.4","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Tert-butyloxycarbonyl-alpha-amino isobutyryl - beta-Alanyl - N, (N,N'-dicyclohexyl)-urea.","","- C25 H44 N4 O5 -","- C25 H44 N4 O5 -","- C50 H88 N8 O10 -","2","1","DE1142","Banerjee, Rahul; Maji, Samir Kumar; Banerjee, Arindam","<i>tert</i>-Butyl <i>N</i>-{2-[<i>N</i>-(<i>N</i>,<i>N</i>'-dicyclohexylureidocarbonylethyl)carbamoyl]prop-2-yl}carbamate","Acta Crystallographica Section C","2000","56","9","1120","1121","10.1107/S0108270100007447","","","1.5418","CuKα","","0.0576","0.0461","","","","0.139","","","","","","1.06","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011304","7.571","0.004","9.486","0.006","10.528","0.004","85.72","0.04","71.16","0.04","76.94","0.05","697.1","0.7","293","","293","","","","","","","","","6","P -1","-P 1","2","","3-Methylthio-4-propargylthioquinolinium chloride monohydrate","","- C13 H14 Cl N O S2 -","- C13 H14 Cl N O S2 -","- C26 H28 Cl2 N2 O2 S4 -","2","1","DE1147","Boryczka, Stanisław; Steiner, Thomas","Hydrogen bonding in two salts of 3-methylthio-4-(propargylthio)quinoline","Acta Crystallographica Section C","2000","56","9","1139","1141","10.1107/S0108270100008271","","","0.71073","MoKα","","0.073","0.051","","","","0.146","","","","","","1.018","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011305","19.43","0.011","5.338","0.003","36.66","0.03","90","","111.67","0.05","90","","3534","4","293","2","293","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","4-Methylthio-3-propargylthioquinolinium trichloroacetate","","- C15 H12 Cl3 N O2 S2 -","- C15 H12 Cl3 N O2 S2 -","- C120 H96 Cl24 N8 O16 S16 -","8","1","DE1147","Boryczka, Stanisław; Steiner, Thomas","Hydrogen bonding in two salts of 3-methylthio-4-(propargylthio)quinoline","Acta Crystallographica Section C","2000","56","9","1139","1141","10.1107/S0108270100008271","","","0.71073","MoKα","","0.093","0.056","","","","0.165","","","","","","1.011","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011306","7.462","0.002","16.513","0.005","6.483","0.003","90","","115.32","0.02","90","","722.1","0.5","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","phenylglyoxylic acid","α-Oxobenzeneacetic acid","","- C8 H6 O3 -","- C8 H6 O3 -","- C32 H24 O12 -","4","1","FG1604","Chen, Chung-Der; Brunskill, Andrew P. J.; Hall, Stan S.; Lalancette, Roger A.; Thompson, Hugh W.","Phenyl- and mesitylglyoxylic acids: catemeric hydrogen bonding in two α-keto acids","Acta Crystallographica Section C","2000","56","9","1148","1151","10.1107/S010827010000812X","","","0.71073","MoKα","","0.114","0.059","","","","0.153","","","","","","1.05","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011307","9.121","0.001","9.121","0.001","10.576","0.001","90","","90","","120","","761.97","0.14","248","2","248","2","","","","","","","","3","P 31","P 31","144","mesitylglyoxylic acid","α-oxo-2,4,6-trimethylbenzeneacetic acid","","- C11 H12 O3 -","- C11 H12 O3 -","- C33 H36 O9 -","3","1","FG1604","Chen, Chung-Der; Brunskill, Andrew P. J.; Hall, Stan S.; Lalancette, Roger A.; Thompson, Hugh W.","Phenyl- and mesitylglyoxylic acids: catemeric hydrogen bonding in two α-keto acids","Acta Crystallographica Section C","2000","56","9","1148","1151","10.1107/S010827010000812X","","","0.71073","MoKα","","0.088","0.049","","","","0.127","","","","","","1.02","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011308","16.4393","0.0016","11.2773","0.0012","18.463","0.002","90","","90.14","0.009","90","","3422.9","0.6","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C40 H38 Cl Ni O P2 -","- C40 H38 Cl Ni O P2 -","- C160 H152 Cl4 Ni4 O4 P8 -","4","1","FG1605","Ellis, Dianne D.; Spek, Anthony L.","Chlorobis(triphenylphosphine)nickel(I) tetrahydrofuran solvate and an unsolvated trigonal phase of chlorotris(triphenylphosphine)nickel(I)","Acta Crystallographica Section C","2000","56","9","1067","1070","10.1107/S0108270100008350","","","0.71073","MoKα","","0.053","0.0355","","","","0.096","","","","","","1.018","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011309","19.0125","0.0008","19.0125","0.0008","10.4507","0.0007","90","","90","","120","","3271.6","0.3","150","2","150","2","","","","","","","","5","P 3","P 3","143","","","","- C54 H45 Cl Ni P3 -","- C54 H45 Cl Ni P3 -","- C162 H135 Cl3 Ni3 P9 -","3","1","FG1605","Ellis, Dianne D.; Spek, Anthony L.","Chlorobis(triphenylphosphine)nickel(I) tetrahydrofuran solvate and an unsolvated trigonal phase of chlorotris(triphenylphosphine)nickel(I)","Acta Crystallographica Section C","2000","56","9","1067","1070","10.1107/S0108270100008350","","","0.71073","MoKα","","0.0461","0.0307","","","","0.0662","","","","","","1.016","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011310","8.571","0.0008","9.5382","0.0009","10.3449","0.0009","105.799","0.001","94.1123","0.0011","112.695","0.0013","735.72","0.12","193","2","193","2","","","","","","","","4","P -1","-P 1","2","","","","- C14 H21 N O5 -","- C14 H21 N O5 -","- C28 H42 N2 O10 -","2","1","FR1265","Zhou, Peiwen; Fisher, James D.; Staples, Richard J.; Vij, Ashwani; Natale, Nicholas R.","Ethyl 5-methyl-4-(2,5,5-trimethyl-1,3-dioxan-2-yl)isoxazole-3-carboxylate","Acta Crystallographica Section C","2000","56","9","1146","1147","10.1107/S0108270100008489","","","0.71073","MoKα","","0.054","0.047","","","","0.12","","","","","","1.058","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011311","17.447","0.003","10.467","0.002","21.934","0.004","90","","102.77","0.01","90","","3906.5","1.2","203","2","203","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Tris[(pentafluorophenyl)trimethylsilylamido](tetrahydrofuran)samarium(III)","","- C31 H35 F15 N3 O Si3 Sm -","- C31 H35 F15 N3 O Si3 Sm -","- C124 H140 F60 N12 O4 Si12 Sm4 -","4","1","FR1269","Click, Damon R.; Scott, Brian L.; Watkin, John G.","Tris[(pentafluorophenyl)trimethylsilylamido](tetrahydrofuran)samarium(III)","Acta Crystallographica Section C","2000","56","9","1095","1096","10.1107/S0108270100008775","","","0.71073","MoKα","","0.057","0.038","","","","0.101","","","","","","1.043","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011312","6.652","0.002","10.616","0.004","11.038","0.004","66.18","0.01","88.2","0.01","85.61","0.02","711","0.4","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","(±)-cis-2-(3-Oxo-1,3,4,5,6,7-hexahydroisobenzofuran-1-yl)- cyclohexanecarboxylic acid","","- C15 H20 O4 -","- C15 H20 O4 -","- C30 H40 O8 -","2","1","FR1276","Newman, Jacob M.; Thompson, Hugh W.; Lalancette, Roger A.","Two diastereomers of (±)-<i>cis</i>-2-(3-oxo-1,3,4,5,6,7-hexahydroisobenzofuran-1-yl)cyclohexanecarboxylic acid","Acta Crystallographica Section C","2000","56","9","1152","1154","10.1107/S0108270100008477","","","0.71073","MoKα","","0.059","0.038","","","","0.088","","","","","","1.01","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2011313","11.372","0.007","10.467","0.009","11.901","0.016","90","","91.11","0.07","90","","1416","2","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(±)-cis-2-(3-Oxo-1,3,4,5,6,7-hexahydroisobenzofuran-1-yl)- cyclohexanecarboxylic acid","","- C15 H20 O4 -","- C15 H20 O4 -","- C60 H80 O16 -","4","1","FR1276","Newman, Jacob M.; Thompson, Hugh W.; Lalancette, Roger A.","Two diastereomers of (±)-<i>cis</i>-2-(3-oxo-1,3,4,5,6,7-hexahydroisobenzofuran-1-yl)cyclohexanecarboxylic acid","Acta Crystallographica Section C","2000","56","9","1152","1154","10.1107/S0108270100008477","","","0.71073","MoKα","","0.131","0.065","","","","0.237","","","","","","1.09","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011314","7.242","0.002","16.187","0.005","10.596","0.003","90","","109.7","0.01","90","","1169.4","0.6","173","1","173","1","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Trans-Dichlorodibenzylaminepalladium(II)","","- C18 H30 Cl2 N2 O2 Pd S2 -","- C18 H30 Cl2 N2 O2 Pd S2 -","- C36 H60 Cl4 N4 O4 Pd2 S4 -","2","0.5","FR1279","Decken, Andreas; Gisia L. Pisegna; Christopher M. Vogels; Stephen A. Westcott","<i>trans</i>-Bis(benzylamine)dichloropalladium(II) bis(dimethyl sulfoxide) solvate","Acta Crystallographica Section C","2000","56","9","1071","1072","10.1107/S0108270100008428","","","0.71073","MoKα","","0.0355","0.0256","","0.0641","","0.0594","","","1.093","","","1.085","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011315","9.9888","0.0011","15.5672","0.0009","10.905","0.0009","90","","107.841","0.007","90","","1614.2","0.2","163","2","163","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","benzo,cis-cyclohexano-14-crown-4","","","- C18 H26 O4 -","- C18 H26 O4 -","- C72 H104 O16 -","4","1","FR1290","Bryan, Jeffrey C.; Sachleben, Richard A.","Benzo-<i>cis</i>-cyclohexano-14-crown-4 and its lithium thiocyanate complex","Acta Crystallographica Section C","2000","56","9","1104","1106","10.1107/S0108270100009033","","","0.71073","MoKα","","0.055","0.037","","","","0.1","","","","","","1.03","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011316","9.3885","0.0008","23.96","0.003","17.744","0.002","90","","102.507","0.008","90","","3896.8","0.7","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","benzo,cis-cyclohexano-14-crown-4 lithium thiocyanate","","","- C19 H26 Li N O4 S -","- C19 H26 Li N O4 S -","- C152 H208 Li8 N8 O32 S8 -","8","2","FR1290","Bryan, Jeffrey C.; Sachleben, Richard A.","Benzo-<i>cis</i>-cyclohexano-14-crown-4 and its lithium thiocyanate complex","Acta Crystallographica Section C","2000","56","9","1104","1106","10.1107/S0108270100009033","","","0.71073","MoKα","","0.093","0.048","","","","0.135","","","","","","1.01","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011317","17.76","0.009","32.336","0.011","7.9664","0.0006","90","","90","","90","","4575","3","293","2","293","2","","","","","","","","3","P c c n","-P 2ab 2ac","56","","9-(n-dodecylaminomethyl)anthracene","","- C27 H37 N -","- C27 H37 N -","- C216 H296 N8 -","8","1","GD1095","Ramos Silva, M.; Matos Beja, A.; Paixao, J. A.; Alte da Veiga, L.; Sobral, A. J. F. N.; Rebanda, N. G. C. L.; Rocha Gonsalves, A. M. dA.","C—H···π interactions in 9-(<i>n</i>-dodecylaminomethyl)anthracene","Acta Crystallographica Section C","2000","56","9","1136","1138","10.1107/S0108270100008441","","","1.54056","CuKα","","0.0792","0.0556","","","","0.1872","","","","","","1.087","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011318","7.852","0.003","15.962","0.005","11.951","0.004","90","","105.48","0.03","90","","1443.5","0.9","298","","298","","","","","","","","","5","P 1 21 1","P 2yb","4","","(2-Carbamoylethyl)bis(dimethylglyoximato) [(R)-1-(1-naphthyl)ethylamine]cobalt(III)","","- C25 H39 Co N6 O6 -","- C25 H39 Co N6 O6 -","- C50 H78 Co2 N12 O12 -","2","1","GD1103","Ohgo, Yoshiki; Ohashi, Yuji; Hagiwara, Mieko; Shida, Mitsuru; Arai, Yoshifusa; Takeuchi, Seiji; Ohgo, Yoshiaki","(2-Carbamoylethyl)bis(dimethylglyoximato-<i>N</i>,<i>N</i>')[(<i>R</i>)-1-(1-naphthyl)ethylamine]cobalt(III) ethanol solvate and bis(dimethylglyoximato-<i>N</i>,<i>N</i>')[2-(<i>N</i>-methylcarbamoyl)ethyl][methyl (<i>S</i>)-phenylalaninate-<i>N</i>]cobalt(III)","Acta Crystallographica Section C","2000","56","9","1062","1064","10.1107/S010827010000826X","","","0.71073","MoKα","","0.0619","0.0539","","","","0.1238","","","","","","1.12","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2011319","11.097","0.004","10.914","0.003","11.178","0.004","90","","91.5","0.03","90","","1353.3","0.8","298","","298","","","","","","","","","5","P 1 21 1","P 2yb","4","","Bis(dimethylglyoximato) [2-(methylcarbamoyl)ethyl][methyl (S)-phenylalaninate]cobalt(III)","","- C22 H35 Co N6 O7 -","- C22 H35 Co N6 O7 -","- C44 H70 Co2 N12 O14 -","2","1","GD1103","Ohgo, Yoshiki; Ohashi, Yuji; Hagiwara, Mieko; Shida, Mitsuru; Arai, Yoshifusa; Takeuchi, Seiji; Ohgo, Yoshiaki","(2-Carbamoylethyl)bis(dimethylglyoximato-<i>N</i>,<i>N</i>')[(<i>R</i>)-1-(1-naphthyl)ethylamine]cobalt(III) ethanol solvate and bis(dimethylglyoximato-<i>N</i>,<i>N</i>')[2-(<i>N</i>-methylcarbamoyl)ethyl][methyl (<i>S</i>)-phenylalaninate-<i>N</i>]cobalt(III)","Acta Crystallographica Section C","2000","56","9","1062","1064","10.1107/S010827010000826X","","","0.71073","MoKα","","0.0542","0.0461","","","","0.1359","","","","","","1.073","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2011320","4.9992","0.0008","12.694","0.003","16.442","0.003","90","","93.54","0.01","90","","1041.4","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-(4-chlorophenyl)-2-cyano-2,3-epoxypropanamide","","- C10 H7 Cl N2 O2 -","- C10 H7 Cl N2 O2 -","- C40 H28 Cl4 N8 O8 -","4","1","GD1105","Lah, Nina; Leban, Ivan; Majcen-Le Maréchal, Alenka; Le Grel, Philippe; Robert, Albert; Sieler, Joachim; Giester, Gerald","From α-carbamoyl-α-cyanooxiranes to 3-halogenopyruvamides","Acta Crystallographica Section C","2000","56","9","1164","1167","10.1107/S0108270100008623","","","0.71073","MoKα","","0.0683","0.0478","","","","0.1515","","","","","","1.032","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011321","5.934","0.003","33.653","0.006","6.177","0.001","90","","107.12","0.03","90","","1178.9","0.7","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","3-bromo-2-cyano-3-(4-methylphenyl)-2-hydroxypropanamide","","- C11 H11 Br N2 O2 -","- C11 H11 Br N2 O2 -","- C44 H44 Br4 N8 O8 -","4","1","GD1105","Lah, Nina; Leban, Ivan; Majcen-Le Maréchal, Alenka; Le Grel, Philippe; Robert, Albert; Sieler, Joachim; Giester, Gerald","From α-carbamoyl-α-cyanooxiranes to 3-halogenopyruvamides","Acta Crystallographica Section C","2000","56","9","1164","1167","10.1107/S0108270100008623","","","0.71073","MoKα","","0.0831","0.0401","","","","0.1081","","","","","","0.971","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011322","22.614","0.005","10.257","0.002","10.099","0.002","90","","114.32","0.03","90","","2134.6","0.9","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","3-bromo-3-(4-metylphenyl)-2-oxopropanamide","","- C10 H10 Br N O2 -","- C10 H10 Br N O2 -","- C80 H80 Br8 N8 O16 -","8","1","GD1105","Lah, Nina; Leban, Ivan; Majcen-Le Maréchal, Alenka; Le Grel, Philippe; Robert, Albert; Sieler, Joachim; Giester, Gerald","From α-carbamoyl-α-cyanooxiranes to 3-halogenopyruvamides","Acta Crystallographica Section C","2000","56","9","1164","1167","10.1107/S0108270100008623","","","0.71073","MoKα","","0.0635","0.0387","","","","0.1091","","","","","","0.973","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011323","5.526","0.001","29.989","0.006","5.997","0.001","90","","107.96","0.03","90","","945.4","0.3","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","3-chloro-3-phenyl-2,2-dihydroxypropanamide","","- C9 H10 Cl N O3 -","- C9 H10 Cl N O3 -","- C36 H40 Cl4 N4 O12 -","4","1","GD1105","Lah, Nina; Leban, Ivan; Majcen-Le Maréchal, Alenka; Le Grel, Philippe; Robert, Albert; Sieler, Joachim; Giester, Gerald","From α-carbamoyl-α-cyanooxiranes to 3-halogenopyruvamides","Acta Crystallographica Section C","2000","56","9","1164","1167","10.1107/S0108270100008623","","","0.71073","MoKα","","0.0344","0.0278","","","","0.0634","","","","","","1.006","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011324","17.382","0.0007","6.7257","0.0003","23.9374","0.0009","90","","95.368","0.002","90","","2786.2","0.2","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1,4-Diazabicyclo[2.2.2]octane‒5-hydroxyisophthalic acid (1/1)","","- C14 H18 N2 O5 -","- C14 H18 N2 O5 -","- C112 H144 N16 O40 -","8","1","GG1007","Burchell, Colin J.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher","Threefold interweaving of (4,4) nets built from <i>R</i>{_<b>10</b>^<b>10</b>}(58) rings in the hydrogen-bonded adduct 1,4-diazabicyclo[2.2.2]octane‒5-hydroxyisophthalic acid (1/1)","Acta Crystallographica Section C","2000","56","9","1126","1128","10.1107/S010827010000771X","","","0.71073","MoKα","","0.063","0.046","","","","0.121","","","","","","1.095","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011325","8.2107","0.0003","9.3093","0.0004","26.8707","0.0009","90","","90","","90","","2053.89","0.13","295","1","295","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C21 H30 Cl2 N2 Ru -","- C21 H30 Cl2 N2 Ru -","- C84 H120 Cl8 N8 Ru4 -","4","1","","Aitali, Mustapha; El Firdoussi, Larbi; Karim, Abdellah; Barrero, Alejandro F.; Quirós, Miguel","A ruthenium(II) complex with p-cymene and (S)-2-anilinoethylpyrrolidine","Acta Crystallographica, Section C","2000","56","","1088","1089","10.1107/S0108270100008787","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2011326","6.6157","0.0011","9.654","0.004","10.748","0.004","101.96","0.03","90.13","0.03","104.29","0.03","649.7","0.4","150","","150","","","","","","","","","5","P -1","-P 1","2","","Bis(μ~2~-chloro)-bis-[1,2,3,3-(4-oxo-6,6-dimethyl-1-ethoxycarbonyl)- hexenyl]-palladium (II)","","- C22 H34 Cl2 O6 Pd2 -","- C22 H34 Cl2 O6 Pd2 -","- C22 H34 Cl2 O6 Pd2 -","1","0.5","GG1012","Spek, Anthony L.; Canisius, Johannes; Preut, Hans; Krause, Norbert","The allyl complex di-μ-chloro-bis{[(1,2,3-η)-4-oxo-5,5-dimethyl-1-(ethoxycarbonyl)hexenyl]palladium(II)}","Acta Crystallographica Section C","2000","56","9","1065","1066","10.1107/S0108270100008799","","","0.71073","MoKα","","0.0187","0.0179","","","","0.0439","","","","","","1.119","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011327","6.3914","0.0005","9.0264","0.0006","26.9292","0.0019","90","","90","","90","","1553.58","0.19","150","2","150","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C17 H26 O3 -","- C17 H26 O3 -","- C68 H104 O12 -","4","1","GG1013","Ellis, Dianne D.; Spek, Anthony L.","(2<i>R</i>,3<i>R</i>,5<i>R</i>)-2-[(2<i>R</i>,3a<i>S</i>,6a<i>R</i>)-2,3,3a,4,5,6a-Hexahydrofuro[2,3-<i>b</i>]furan-2-yl]-5-isopropenyl-2,3-dimethylcyclohexanone and (4a<i>R</i>,5<i>S</i>,7<i>R</i>)-5-isopropenyl-7,8,8-trimethyl-2,3,4,4a,5,6,7,8-octahydronaphthalene-4a-carbonitrile","Acta Crystallographica Section C","2000","56","9","1173","1175","10.1107/S0108270100008805","","","0.71073","MoKα","","0.0748","0.048","","","","0.1137","","","","","","0.951","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011328","8.3419","0.0009","12.3902","0.001","14.4052","0.0014","90","","90","","90","","1488.9","0.2","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C17 H23 N O -","- C17 H23 N O -","- C68 H92 N4 O4 -","4","1","GG1013","Ellis, Dianne D.; Spek, Anthony L.","(2<i>R</i>,3<i>R</i>,5<i>R</i>)-2-[(2<i>R</i>,3a<i>S</i>,6a<i>R</i>)-2,3,3a,4,5,6a-Hexahydrofuro[2,3-<i>b</i>]furan-2-yl]-5-isopropenyl-2,3-dimethylcyclohexanone and (4a<i>R</i>,5<i>S</i>,7<i>R</i>)-5-isopropenyl-7,8,8-trimethyl-2,3,4,4a,5,6,7,8-octahydronaphthalene-4a-carbonitrile","Acta Crystallographica Section C","2000","56","9","1173","1175","10.1107/S0108270100008805","","","0.71073","MoKα","","0.0874","0.0503","","","","0.1047","","","","","","1.035","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011329","7.0044","0.0005","11.182","0.001","6.3971","0.0008","102.978","0.008","104.697","0.004","74.017","0.008","459.42","0.08","296.2","","296.2","","","","","","","","","5","P -1","-P 1","2","","","","- C5 H9 N2 Na O6 -","- C5 H9 N2 Na O6 -","- C10 H18 N4 Na2 O12 -","2","1","GS1079","Muthuraman, Meiyappan; Nicoud, Jean-François; Bagieu-Beucher, Muriel","Sodium 5-nitro-2-pyridonate trihydrate","Acta Crystallographica Section C","2000","56","9","1077","1078","10.1107/S0108270100009045","","","0.5608","AgKα","","0.0514","0.051","","0.057","","0.057","","","1.908","","","1.91","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2011330","5.674","0.0014","11.699","0.006","33.534","0.0015","90","","90","","90","","2226","1.3","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","1,6-Anhydro-2,3-di-O-Benzyl-5C-(Carbethoxy-1(R)-hydroxymethyl)-L-altrofuranose","1,6-Anhydro-2,3-di-O-benzyl-5C-[(R)-ethoxycarbonyl(hydroxy)methyl]-L- altrofuranose","","- C24 H28 O8 -","- C24 H28 O8 -","- C96 H112 O32 -","4","1","GS1095","Taillefumier, Claude; Charron, Christophe; Chapleur, Yves; Aubry, Andre","1,6-Anhydro-2,3-di-<i>O</i>-benzyl-5<i>C</i>-[(<i>R</i>)-ethoxycarbonyl(hydroxy)methyl]-β-<small>L</small>-altrofuranose","Acta Crystallographica Section C","2000","56","9","1168","1169","10.1107/S0108270100008702","","","1.5418","CuKα","","0.064","0.051","","","","0.148","","","","","","1.047","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011331","7.8783","0.0002","10.4689","0.0001","16.068","0.0004","90","","95.147","0.001","90","","1319.9","0.05","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C5 H17 Al N2 O8 P2 -","- C5 H17 Al N2 O8 P2 -","- C20 H68 Al4 N8 O32 P8 -","4","1","GS1096","Phan Thanh, S.; Marrot, J.; Renaudin, J.; Maisonneuve, V.","[H~3~N(CH~2~)~5~NH~3~].AlP~2~O~8~H, a one-dimensional aluminophosphate","Acta Crystallographica, Section C","2000","56","9","1073","1074","10.1107/S0108270100008532","","","","","","","","","","","","","","","","","","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011332","11.623","0.002","13.426","0.003","15.156","0.002","76.44","0.01","71.3","0.01","75.16","0.02","2135.3","0.7","303","2","303","2","","","","","","","","7","P -1","-P 1","2","","","","- C43 H33 Br4 Cl2 Fe2 N5 O6 -","- C43 H33 Br4 Cl2 Fe2 N5 O6 -","- C86 H66 Br8 Cl4 Fe4 N10 O12 -","2","1","GS1097","Elmali, Ayhan; Kavlakoglu, Ebru; Elerman, Yalc̨ın; Svoboda, Ingrid","A complex containing both five- and six-coordinate [bis(5-bromosalicylidene)benzene-1,2-diimine]chloroiron(III)","Acta Crystallographica Section C","2000","56","9","1097","1099","10.1107/S0108270100008714","","","0.71093","MoKα","","0.037","0.037","","","","0.121","","","","","","1.014","","","","has coordinates,has Fobs","199470","2020-10-21","18:00:00",""
"2011333","10.914","0.001","21.758","0.001","32.774","0.001","90","","90","","90","","7782.7","0.8","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","Bis-(12-Krone-4)-cadmium-bispentaiodid","Bis-(1,3,5,7-Tetraoxacyclododecan)-cadmium-bis-pentaiodid","","- C16 H32 Cd I10 O8 -","- C16 H32 Cd I10 O8 -","- C128 H256 Cd8 I80 O64 -","8","0.25","JZ1406","Wieczorrek, Carsten","Isolierte I~10~^2{-^}-Ringe, ein neues Strukturelement in der Polyiodid-Chemie","Acta Crystallographica Section C","2000","56","9","1082","1084","10.1107/S0108270100008817","","","0.7107","MoKα","","0.034","0.0313","","0.0643","","0.063","","","1.086","","","1.104","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011334","14.742","0.001","14.742","","17.791","0.001","90","","90","","90","","3866.5","0.3","293","2","293","2","","","","","","","","5","I -4 2 d","I -4 2bw","122","Tris-Ethylendiamin-zinktetraiodid","Tris(1,2-ethandiamin)zinktriiodid-iodid","","- C6 H24 I4 N6 Zn -","- C6 H24 I4 N6 Zn -","- C48 H192 I32 N48 Zn8 -","8","0.5","JZ1409","Wieczorrek, Carsten","Tetraiodide von Tris(1,2-ethandiamin)komplexen der Metalle Zink und Nickel","Acta Crystallographica Section C","2000","56","9","1079","1081","10.1107/S0108270100008829","","","0.71073","MoKα","","0.0218","0.0196","","","","0.042","","","","","","1.094","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011335","14.67","0.001","14.67","","17.754","0.002","90","","90","","90","","3820.8","0.5","293","2","293","2","","","","","","","","5","I -4 2 d","I -4 2bw","122","Tris-Ethylendiamin-nickeltetraiodid","Tris(1,2-diaminoethan)nickeltriiodid-iodid","","- C6 H24 I4 N6 Ni -","- C6 H24 I4 N6 Ni -","- C48 H192 I32 N48 Ni8 -","8","0.5","JZ1409","Wieczorrek, Carsten","Tetraiodide von Tris(1,2-ethandiamin)komplexen der Metalle Zink und Nickel","Acta Crystallographica Section C","2000","56","9","1079","1081","10.1107/S0108270100008829","","","0.71073","MoKα","","0.0452","0.0276","","","","0.0516","","","","","","0.905","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011336","7.49","0.002","13.4","0.003","18.639","0.006","90","","90","","90","","1870.7","0.9","293","2","293","2","","","","","","","","5","I b a m","-I 2 2c","72","[Bis-Ethylendiamin-kupfer]bis-triiodid","[Bis-1,2-Diaminoethan-kupfer]bis-triiodid","","- C4 H16 Cu I6 N4 -","- C4 H16 Cu I6 N4 -","- C16 H64 Cu4 I24 N16 -","4","0.25","JZ1410","Wieczorrek, Carsten","Bis-Triiodide von 1,2-Ethandiaminkomplexen am Beispiel des Metalls Kupfer","Acta Crystallographica Section C","2000","56","9","1085","1087","10.1107/S0108270100008830","","","0.71073","MoKα","","0.0487","0.0391","","","","0.0906","","","","","","1.11","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011337","9.684","0.0008","5.2868","0.0008","12.8212","0.0007","90","","106.47","0.006","90","","629.48","0.12","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","3-Chloro-1-(4-morpholinyl-5-nitroimidazol-1-yl)propan-2-ol","","- C10 H15 Cl N4 O4 -","- C10 H15 Cl N4 O4 -","- C20 H30 Cl2 N8 O8 -","2","1","JZ1415","Gzella, Andrzej; Wrzeciono, Urszula; Pöppel, Wolfram","Azole. 44. Über Morpholinonitroimidazolderivate","Acta Crystallographica Section C","2000","56","9","1161","1163","10.1107/S0108270100008635","","","1.54178","CuKα","","0.026","0.025","","","","0.072","","","","","","1.038","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011338","6.5036","0.0008","7.8493","0.0009","12.9757","0.0014","91.101","0.009","101.026","0.01","101.94","0.01","634.91","0.13","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","3-Chloro-1-(5-morpholinyl-4-nitroimidazol-1-yl)propan-2-ol","","- C10 H15 Cl N4 O4 -","- C10 H15 Cl N4 O4 -","- C20 H30 Cl2 N8 O8 -","2","1","JZ1415","Gzella, Andrzej; Wrzeciono, Urszula; Pöppel, Wolfram","Azole. 44. Über Morpholinonitroimidazolderivate","Acta Crystallographica Section C","2000","56","9","1161","1163","10.1107/S0108270100008635","","","1.54178","CuKα","","0.048","0.041","","","","0.122","","","","","","1.054","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011339","11.4056","0.0002","12.2501","0.0001","13.1746","0.0003","90","","91.497","0.001","90","","1840.12","0.05","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","10-(benzoylamino)-3,4,6,7,9,10-hexahydro-1,8-(2H,5H)-acridinedione (I)","","- C20 H22 N2 O4 -","- C20 H22 N2 O4 -","- C80 H88 N8 O16 -","4","1","KA1336","Jeyakanthan, J.; Shanmuga Sundara Raj, S.; Velmurugan, D.; Fun, Hoong-Kun; Rajan, T. Joseph; Ramakrishnan, V.T.","Two benzoylaminoacridinedione derivatives","Acta Crystallographica Section C","2000","56","9","1109","1112","10.1107/S0108270199016455","","","0.71073","MoKα","","0.0842","0.0561","","","","0.167","","","","","","1.025","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011340","23.2343","0.001","13.8327","0.0006","16.3286","0.0007","90","","132.14","0.001","90","","3891.4","0.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","10-(4-methylbenzoylamino)-3,4,6,7,9,10-hexahydro-1,8-(2H,5H)-acridinedione(II)","","- C21 H24 N2 O4 -","- C21 H24 N2 O4 -","- C168 H192 N16 O32 -","8","1","KA1336","Jeyakanthan, J.; Shanmuga Sundara Raj, S.; Velmurugan, D.; Fun, Hoong-Kun; Rajan, T. Joseph; Ramakrishnan, V.T.","Two benzoylaminoacridinedione derivatives","Acta Crystallographica Section C","2000","56","9","1109","1112","10.1107/S0108270199016455","","","0.71073","MoKα","","0.0705","0.0553","","","","0.1897","","","","","","0.945","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011341","11.255","0.015","6.865","0.0013","11.953","0.0012","90","","104.15","0.02","90","","895.5","1.2","293","","293","2","","","","","","","","5","I 1 2/m 1","-I 2y","12","","6,12-Dihydro-2,8-dihydroxy-1,3,7,9-tetramethyl-dipyrido[1,2-a:1',2'-d] pyrazinediylium dichloride dihydrate","","- C16 H24 Cl2 N2 O4 -","- C16 H18 Cl2 N2 O4 -","- C32 H36 Cl4 N4 O8 -","2","0.25","NA1479","Košutić-Hulita, Nada; Danilovski, Aleksandar; Malešević, Miroslav; Orešić, Marina; Dumić, Miljenko","2,8-Dihydroxy-1,3,7,9-tetramethyl-6,12-dihydrodipyrido[1,2-<i>a</i>:1',2'-<i>d</i>]pyrazinediylium dichloride dihydrate","Acta Crystallographica Section C","2000","56","9","1144","1145","10.1107/S0108270100008313","","","0.71073","MolybdenumKα","","0.0594","0.0477","","","","0.1685","","","","","","1.113","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011342","11.665","0.002","7.4718","0.0011","16.2794","0.0015","90","","106.666","0.014","90","","1359.3","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","N-(3-Carboxy-phenyl)-2-hydroxy-1-naphthaldimine","","","- C18 H13 N O3 -","- C18 H13 N O3 -","- C72 H52 N4 O12 -","4","1","OB1032","Pavlović, Gordana; Matijević Sosa, Julija","3-[(2-Oxo-1-naphthylidene)methylamino]benzoic acid","Acta Crystallographica Section C","2000","56","9","1117","1119","10.1107/S0108270100007290","","","0.71073","MoKα","","0.1332","0.046","","","","0.117","","","","","","0.944","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011343","10.1958","0.0015","9.9753","0.001","13.1655","0.0019","90","","90.695","0.017","90","","1338.9","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","[(H2NC2H4NH2)(H3NC2H4NH3)2][Ge9O18(OH)4]","","","- C6 H32 Ge9 N6 O22 -","- C6 H32 Ge9 N6 O22 -","- C12 H64 Ge18 N12 O44 -","2","0.5","OS1114","Sun, Kai; Dadachov, Mike S.; Conradsson, Tony; Zou, Xiaodong","A three-dimensional open-framework germanate containing four-, five- and six-coordinated germanium","Acta Crystallographica Section C","2000","56","9","1092","1094","10.1107/S0108270100009057","","","0.71073","MoKα","","0.0406","0.0268","","","","0.0579","","","","","","0.958","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011344","13.594","0.002","14.808","0.003","5.611","0.0015","90.089","0.017","98.13","0.018","83.505","0.014","1110.8","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","α-(4-Chlorophenyl)-N-phenylnitrone","N-(p-Chlorobenzylidene)phenylamine N-oxide","","- C13 H10 Cl N O -","- C13 H10 Cl N O -","- C52 H40 Cl4 N4 O4 -","4","2","QA0266","Vijayalakshmi, L.; Parthasarathi, V.; Manishanker, P.","<i>N</i>-(<i>p</i>-Chlorobenzylidene)phenylamine <i>N</i>-oxide","Acta Crystallographica Section C","2000","56","9","e403","e404","10.1107/S0108270100010544","","","0.71069","MoKα","","0.054","0.036","","","","0.115","","","","","","1.02","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011345","7.814","0.005","11.561","0.003","18.58","0.007","90","","101.96","0.04","90","","1642","1.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","6-methyl-4(2-napthyl)ethenyl-3-cyano-1-benzopyran-2-one.","","- C23 H15 N O2 -","- C23 H15 N O2 -","- C92 H60 N4 O8 -","4","1","QA0319","Vijayalakshmi, L.; Parthasarathi, V.; Varu, Bharat; Dodia, Narasinh; Shah, Anamik","3-Cyano-6-methyl-4-(2-naphthylethenyl)-1-benzopyran-2-one","Acta Crystallographica Section C","2000","56","9","e401","e402","10.1107/S0108270100010532","","","0.71073","MoKα","","0.067","0.042","","","","0.144","","","","","","0.831","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011346","11.372","0.003","8.042","0.002","15.621","0.009","90","","104.71","0.02","90","","1381.8","0.9","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","bis(1-methylguanidinium) Tetrachlorocuprate(II)","","- C4 H16 Cl4 Cu N6 -","- C4 H16 Cl4 Cu N6 -","- C16 H64 Cl16 Cu4 N24 -","4","0.5","QA0332","Corzo-Suárez, Raúl; Díaz, Isabel; García-Granda, Santiago; Fernández, Vicente","Bis(1-methylguanidinium) tetrachlorocuprate(II) and 4-(2-pyrimidin-1-io)piperazinium tetrachlorocuprate(II)","Acta Crystallographica Section C","2000","56","9","e385","e387","10.1107/S0108270100011045","","","0.71073","MoKα","","0.075","0.04","","","","0.117","","","","","","1.086","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011347","9.205","0.007","16.13","0.03","9.391","0.007","90","","99.24","0.06","90","","1376","3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(2-pyrimidinyl)-piperazine Tetrachlorocuprate(II)","","- C8 H14 Cl4 Cu N4 -","- C8 H14 Cl4 Cu N4 -","- C32 H56 Cl16 Cu4 N16 -","4","1","QA0332","Corzo-Suárez, Raúl; Díaz, Isabel; García-Granda, Santiago; Fernández, Vicente","Bis(1-methylguanidinium) tetrachlorocuprate(II) and 4-(2-pyrimidin-1-io)piperazinium tetrachlorocuprate(II)","Acta Crystallographica Section C","2000","56","9","e385","e387","10.1107/S0108270100011045","","","0.71073","MoKα","","0.085","0.051","","","","0.135","","","","","","1.038","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011348","12.553","0.001","14.4169","0.0009","13.2205","0.0009","90","","94.377","0.007","90","","2385.6","0.3","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","catena-(μ~2~-4,4'-bipyridine)(1,10-phenanthroline)(diperchlorato)copper(II) monohydrate","","- C22 H18 Cl2 Cu N4 O9 -","- C22 H18 Cl2 Cu N4 O9 -","- C88 H72 Cl8 Cu4 N16 O36 -","4","1","QA0341","Tong, Ming-Liang; Chen, Xiao-Ming; Ng, Seik Weng","<i>catena</i>-Poly[[[bis(perchlorato-<i>O</i>)(1,10-phenanthroline-<i>N</i>,<i>N</i>')copper(II)]-μ-4,4'-bipyridine-<i>N</i>:<i>N</i>'] monohydrate]","Acta Crystallographica Section C","2000","56","9","e374","e375","10.1107/S0108270100011057","","","0.71073","MoKα","","0.098","0.061","","","","0.173","","","","","","1.028","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011349","20.0177","0.001","15.7193","0.0008","12.9074","0.0007","90","","103.235","0.001","90","","3953.6","0.4","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","[Co(tren)(dmso)Cl](ClO~4~)~2~","chloro tris-(2-aminoethyl)amine (dimethyl sulfoxide-O)- cobalt (III) perchlorate","","- C8 H24 Cl3 Co N4 O9 S -","- C8 H24 Cl3 Co N4 O9 S -","- C64 H192 Cl24 Co8 N32 O72 S8 -","8","2","QA0349","Hu, Xiaopeng; Feng, Xiaolong; Cai, Jiwen; Ji, Liangnian","[Tris(2-aminoethyl)amine-κ^4^<i>N</i>]chloro(dimethyl sulfoxide-<i>O</i>)cobalt(III) diperchlorate","Acta Crystallographica Section C","2000","56","9","e388","e389","10.1107/S0108270100011069","","","0.71073","MoKα","","0.061","0.044","","","","0.13","","","","","","1.036","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2011350","9.682","0.005","18.654","0.005","8.977","0.005","90","","90","","90","","1621.3","1.3","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C15 H20 O4 S2 -","- C15 H20 O4 S2 -","- C60 H80 O16 S8 -","4","1","QA0358","Kubo, Kanji; Mori, Akira; Kato, Nobuo; Takeshita, Hitoshi","5,8,11-Trioxa-2,14-dithiabicyclo[13.4.1]icosa-1(19),15,17-trien-20-one","Acta Crystallographica Section C","2000","56","9","e396","e397","10.1107/S0108270100010489","","","0.71073","MoKα","","0.087","0.04","","","","0.102","","","","","","1.02","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011351","13.0959","0.0012","15.3703","0.0013","8.7107","0.0003","90","","108.86","0.004","90","","1659.2","0.2","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-benzylideneaniline(pentacarbonyl)chromium(0)","","- C18 H11 Cr N O5 -","- C18 H11 Cr N O5 -","- C72 H44 Cr4 N4 O20 -","4","1","QA0362","Nieger, Martin; Liptau, Patrick; Dötz, Karl Heinz","[<i>N</i>-(Benzylidene)aniline-<i>N</i>]pentacarbonylchromium(0)","Acta Crystallographica Section C","2000","56","9","e390","e391","10.1107/S0108270100011070","","","0.71073","MoKα","","0.054","0.037","","","","0.095","","","","","","1.024","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011352","6.004","0.002","7.675","0.004","45.564","0.003","90","","90","","90","","2099.6","1.3","143","2","143","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C21 H25 N O8 -","- C21 H25 N O8 -","- C84 H100 N4 O32 -","4","1","QA0363","Gainsford, Graeme J.; Tyler, Peter C.; Furneaux,Richard H.","1,7,8-Tri-<i>O</i>-acetyl-6-<i>O</i>-benzoylcastanospermine","Acta Crystallographica Section C","2000","56","9","e394","e395","10.1107/S0108270100010477","","","0.71073","MoKα","","0.048","0.048","","","","0.093","","","","","","1.126","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011353","13.4832","0.0002","19.634","0.0002","20.3112","0.0003","90","","98.634","0.0008","90","","5316.03","0.12","273.2","","200","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C56 H59 F6 O4 P5 Ru -","- C56 H59 F6 O4 P5 Ru -","- C224 H236 F24 O16 P20 Ru4 -","4","0.5","QA0364","Lucas, Nigel T.; Powell, Clem E.; Humphrey, Mark G.","<i>cis</i>,<i>cis</i>,<i>cis</i>-(Acetato-<i>O</i>,<i>O</i>')bis[1,2-bis(diphenylphosphino)ethane-<i>P</i>,<i>P</i>']ruthenium(II) hexafluorophosphate dimethanol solvate","Acta Crystallographica Section C","2000","56","9","e392","e393","10.1107/S0108270100011082","","","0.7107","MoKα","","0.059","0.035","","0.046","","0.039","","","0.939","","","0.949","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2011354","9.7567","0.0003","10.344","0.0003","17.0684","0.0006","90","","90","","90","","1722.6","0.09","291","1","291","1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C20 H24 O4 -","- C20 H24 O4 -","- C80 H96 O16 -","4","1","QA0370","Uerdingen, Marc; Schürmann, Markus; Preut, Hans; Krause, Norbert","3,17-Dioxoandrosta-4,6-dien-11-yl acetate","Acta Crystallographica Section C","2000","56","9","e415","e415","10.1107/S0108270100011094","","","0.71073","MoKα","","0.097","0.035","","","","0.078","","","","","","0.933","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011355","11.353","0.005","22.134","0.005","5.897","0.007","90","","90","","90","","1481.8","1.9","296","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","L-Kynulenine sulfate dihydrate","","- C10 H18 N2 O9 S -","- C10 H18 N2 O9 S -","- C40 H72 N8 O36 S4 -","4","1","QA0372","Okabe, Nobuo; Eguchi, Yoko; Miura, Junko; Akiko, Shimosaki","<small>L</small>-Kynureninium sulfate dihydrate","Acta Crystallographica Section C","2000","56","9","e416","e417","10.1107/S0108270100011100","","","0.71069","MoKα","","","0.0565","","","","0.1629","","","","","","1.153","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011356","6.88","0.002","8.201","0.003","9.298","0.002","90","","105.59","0.01","90","","505.3","0.3","296.2","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C3 H6 Cl N O -","- C3 H6 Cl N O -","- C12 H24 Cl4 N4 O4 -","4","1","QA0373","Sakamoto, Jun; Nakagawa, Takashi; Kanehisa, Nobuko; Kai, Yasushi; Katsura, Masahiro","3-Chloropropionamide","Acta Crystallographica Section C","2000","56","9","e413","e413","10.1107/S0108270100011112","","","0.7107","MoKα","","","0.0354","","","","0.1085","","","","","","0.96","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011357","11.253","0.004","5.74","0.006","17.782","0.006","90","","98.19","0.03","90","","1136.9","1.3","296","","296","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","sp-9-Acetylfluorene","","- C15 H12 O -","- C15 H12 O -","- C60 H48 O4 -","4","1","QA0375","Meyers, Cal Y.; Lutfi, Hisham G.; Robinson, Paul D.","<i>sp</i>-9-Acetylfluorene, the initial acetylation product of 9-fluorenyllithium","Acta Crystallographica Section C","2000","56","9","e418","e419","10.1107/S0108270100011124","","","0.71069","MoKα","","0.134","0.045","","","","0.156","","","","","","1.008","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011358","7.0911","0.0001","12.2566","0.0002","20.5272","0.0004","90","","90","","90","","1784.08","0.05","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N-(6-amino-3-methyl-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinyl)- N-[β-D-glucopyranosyl]acetamide","","- C13 H24 N4 O10 -","- C13 H24 N4 O10 -","- C52 H96 N16 O40 -","4","1","QA0376","Low, John Nicolson; Molina, Sebastián; Nogueras, Manuel; Sánchez, Adolfo; Cobo, Justo","<i>N</i>-(6-Amino-3-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-<i>N</i>-(β-<small>D</small>-glucopyranosyl)acetamide","Acta Crystallographica Section C","2000","56","9","e420","e420","10.1107/S0108270100011148","","","0.71073","MoKα","","0.045","0.039","","","","0.1","","","","","","1.057","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011359","14.409","0.002","16.489","0.003","19.267","0.003","90","","90","","90","","4577.6","1.3","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Clarithromycin Hydrochloride 3.5 Hydrate","6-O-Methylerythromycin A Hydrochloride 3.5 Hydrate","","- C38 H77 Cl N O16.5 -","- C38 H77 Cl N O16.5 -","- C152 H308 Cl4 N4 O66 -","4","1","QD0001","Parvez, Masood; Arayne, M. Saeed; Sabri, Rizwana; Sultana, Najma; 6-O-Methylerythromycin A Hydrochloride 3.5 Hydrate","Clarithromycin hydrochloride 3.5-hydrate","Acta Crystallographica Section C","2000","56","9","e398","e399","10.1107/S0108270100010490","","","1.54178","CuKα","","0.109","0.058","","","","0.15","","","","","","1.05","","","","has coordinates,has Fobs","194538","2020-10-21","18:00:00",""
"2011360","7.721","0.002","8.905","0.005","11.231","0.004","97.57","0.04","105.69","0.03","103.6","0.03","706.7","0.5","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","2-(2,6-dimethoxyphenyl)-4H-1-benzopyran-4-one","","- C17 H14 O4 -","- C17 H14 O4 -","- C34 H28 O8 -","2","1","QD0002","Wallet, J.-C.; Molins, Elies; Miravitlles, Carlos","A second triclinic modification of 2',6'-dimethoxyflavone","Acta Crystallographica Section C","2000","56","9","e414","e414","10.1107/S0108270100011008","","","0.71073","MoKα","","0.203","0.055","","","","0.143","","","","","","0.917","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011361","11.1807","0.0011","11.626","0.003","11.7904","0.0016","112.119","0.013","103.677","0.01","96.013","0.014","1347.2","0.5","289","2","289","2","","","","","","","","6","P -1","-P 1","2","","","","- C16 H32 Cl4 N4 Ni2 O9 -","- C16 H32 Cl4 N4 Ni2 O9 -","- C32 H64 Cl8 N8 Ni4 O18 -","2","1","QD0003","Sung, Nack-Do; Yun, Ki-Seob; Kim, Jin-Gyu; Suh, Il-Hwan","μ-Aqua-pentaaqua[μ-3,6-bis(6-methyl-2-pyridyl)pyridazine]chlorodinickel(II) trichloride trihydrate","Acta Crystallographica Section C","2000","56","9","e370","e371","10.1107/S0108270100010507","","","0.71073","MoKα","","0.044","0.032","","","","0.08","","","","","","1.033","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011362","12.369","0.002","7.6809","0.0003","15.332","0.003","90","","101.842","0.009","90","","1425.6","0.4","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-(2,4,6-Trimethyl)phenylazo(3,5-dimethyl)phenol","","- C17 H20 N2 O -","- C17 H20 N2 O -","- C68 H80 N8 O4 -","4","1","QD0004","Lynch, Daniel E.; Byriel, Karl A.","3,5-Dimethyl-4-(2,4,6-trimethylphenyldiazenyl)phenol","Acta Crystallographica Section C","2000","56","9","e400","e400","10.1107/S0108270100010519","","","0.71073","MoKα","","0.073","0.042","","","","0.127","","","","","","1.034","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011363","7.0127","0.0011","12.524","0.002","14.477","0.003","90","","90","","90","","1271.5","0.4","293","2","293","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C14 H8 N2 O4 S -","- C14 H8 N2 O4 S -","- C56 H32 N8 O16 S4 -","4","1","QD0005","Kovalevsky, A. Yu.; Ponomarev, I. I.; Baranova, M. A.","2-[2-(5-Nitro-2-thienyl)ethenyl]-4<i>H</i>-3,1-benzoxazine-4-one, 2-[2-(4-nitrophenyl)ethenyl]-4<i>H</i>-3,1-benzoxazine-4-one and 6,7-dimethoxy-2-[2-(4-nitrophenyl)ethenyl]-4<i>H</i>-3,1-benzoxazine-4-one","Acta Crystallographica Section C","2000","56","9","e408","e409","10.1107/S010827010001057X","","","0.71073","MoKα","","0.119","0.051","","0.142","","0.1","","","0.963","","","1.179","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011364","14.627","0.003","7.491","0.002","12.344","0.005","90","","98.71","0.03","90","","1336.9","0.7","213","2","213","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C16 H10 N2 O4 -","- C16 H10 N2 O4 -","- C64 H40 N8 O16 -","4","1","QD0005","Kovalevsky, A. Yu.; Ponomarev, I. I.; Baranova, M. A.","2-[2-(5-Nitro-2-thienyl)ethenyl]-4<i>H</i>-3,1-benzoxazine-4-one, 2-[2-(4-nitrophenyl)ethenyl]-4<i>H</i>-3,1-benzoxazine-4-one and 6,7-dimethoxy-2-[2-(4-nitrophenyl)ethenyl]-4<i>H</i>-3,1-benzoxazine-4-one","Acta Crystallographica Section C","2000","56","9","e408","e409","10.1107/S010827010001057X","","","0.71073","MoKα","","0.149","0.081","","0.289","","0.178","","","1.166","","","1.545","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011365","6.8484","0.001","7.2348","0.0014","16.806","0.003","93.801","0.015","96.783","0.013","105.321","0.013","793.3","0.2","208","2","208","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H14 N2 O6 -","- C18 H14 N2 O6 -","- C36 H28 N4 O12 -","2","1","QD0005","Kovalevsky, A. Yu.; Ponomarev, I. I.; Baranova, M. A.","2-[2-(5-Nitro-2-thienyl)ethenyl]-4<i>H</i>-3,1-benzoxazine-4-one, 2-[2-(4-nitrophenyl)ethenyl]-4<i>H</i>-3,1-benzoxazine-4-one and 6,7-dimethoxy-2-[2-(4-nitrophenyl)ethenyl]-4<i>H</i>-3,1-benzoxazine-4-one","Acta Crystallographica Section C","2000","56","9","e408","e409","10.1107/S010827010001057X","","","0.71073","MoKα","","0.12","0.045","","0.143","","0.101","","","1.024","","","1.108","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011366","49.542","0.011","10.958","0.003","18.123","0.004","90","","100.03","0.03","90","","9688","4","180","2","180","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","trans-Dichlorobis[1,2-ethandiylbis[diphenylphosphane]-P,P']molybdenum","","- C54.5 H54 Cl2 Mo P4 -","- C54.5 H54 Cl2 Mo P4 -","- C436 H432 Cl16 Mo8 P32 -","8","1","QD0007","Filippou, Alexander, C.; Portius, Peter; Philippopoulos, Athanassios, I.; Kociok-Köhn, Gabriele; Ziemer, Burkhard","Pentane and tetrahydrofuran solvates of <i>trans</i>-dichlorobis[1,2-ethanediylbis(diphenylphosphine)-<i>P</i>,<i>P</i>']molybdenum(II)","Acta Crystallographica Section C","2000","56","9","e378","e379","10.1107/S010827010001060X","","","0.71073","MoKα","","0.196","0.074","","","","0.157","","","","","","0.801","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2011367","11.3197","0.0011","13.4052","0.0014","17.455","0.002","90","","96.093","0.011","90","","2633.7","0.5","180","2","180","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","trans-Dichlorobis[1,2-ethandiylbis[diphenylphosphane]-P,P']molybdenum","","- C60 H64 Cl2 Mo O2 P4 -","- C60 H64 Cl2 Mo O2 P4 -","- C120 H128 Cl4 Mo2 O4 P8 -","2","0.5","QD0007","Filippou, Alexander, C.; Portius, Peter; Philippopoulos, Athanassios, I.; Kociok-Köhn, Gabriele; Ziemer, Burkhard","Pentane and tetrahydrofuran solvates of <i>trans</i>-dichlorobis[1,2-ethanediylbis(diphenylphosphine)-<i>P</i>,<i>P</i>']molybdenum(II)","Acta Crystallographica Section C","2000","56","9","e378","e379","10.1107/S010827010001060X","","","0.71073","MoKα","","0.039","0.033","","","","0.094","","","","","","1.068","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011368","3.789","0.007","12.2","0.01","14.99","0.02","90","","94.41","0.01","90","","690.9","1.7","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-Fluoro-2,3-indolinedione","","- C8 H4 F N O2 -","- C8 H4 F N O2 -","- C32 H16 F4 N4 O8 -","4","1","QD0008","Naumov, Pance; Anastasova, Frosa; Drew, Michael G. B.; Ng, Seik Weng","5-Fluoroindoline-2,3-dione","Acta Crystallographica Section C","2000","56","9","e406","e407","10.1107/S0108270100010568","","","0.71073","MoKα","","0.088","0.053","","","","0.166","","","","","","1.074","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011369","13.46","0.02","8.62","0.01","17.89","0.02","90","","105.28","0.01","90","","2002","4","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Tetrakis(imidazole-N^3^)nickel(II) diacetate","","- C16 H22 N8 Ni O4 -","- C16 H22 N8 Ni O4 -","- C64 H88 N32 Ni4 O16 -","4","0.5","QD0009","Naumov, Pance; Ristova, Mirjana; Drew, Michael G. B.; Ng, Seik Weng","Bis(acetato-<i>O</i>)tetrakis(imidazole-<i>N</i>^3^)nickel(II)","Acta Crystallographica Section C","2000","56","9","e372","e373","10.1107/S0108270100010520","","","0.71073","MoKα","","0.047","0.036","","","","0.105","","","","","","1.063","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011370","8.571","0.002","12.102","0.002","10.814","0.002","90","","91.53","0.02","90","","1121.3","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tetraaqua(5-fluoro-uracil-1-acetato-O)-zinc(II) tetrahydrate","","- C12 H24 F2 N4 O16 Zn -","- C12 H24 F2 N4 O16 Zn -","- C24 H48 F4 N8 O32 Zn2 -","2","0.5","QD0010","Li, Chang-Zheng; Wang, Liu-Fang; Li, Yi-Zhi; Xia, Chun-Gu; Dai, Rong-Bin","<i>trans</i>-Tetraaquabis(5-fluorouracil-1-acetato-<i>O</i>)zinc(II) tetrahydrate","Acta Crystallographica Section C","2000","56","9","e376","e377","10.1107/S0108270100010593","","","0.71073","MoKα","","0.032","0.03","","","","0.11","","","","","","0.884","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011371","9.987","0.002","8.451","0.002","14.233","0.003","90","","90","","90","","1201.3","0.5","193","2","193","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C8 H8 Cu N6 O6 -","- C8 H8 Cu N6 O6 -","- C32 H32 Cu4 N24 O24 -","4","1","QD0011","Riggio, Ivonne; Albada, Gerard A. van; Mutikainen, Ilpo; Turpeinen, Urho; Reedijk, Jan","<i>catena</i>-Poly[[bis(nitrato)(pyrimidine)copper(II)]-μ-pyrimidine-<i>N</i>:<i>N</i>']","Acta Crystallographica Section C","2000","56","9","e380","e381","10.1107/S010827010001101X","","","0.71073","MoKα","","0.031","0.03","","","","0.077","","","","","","1.083","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011372","7.9539","0.0016","9.5523","0.0019","10.695","0.002","97.61","0.03","110.44","0.03","104.17","0.03","716.7","0.3","298","2","","","","","","","","","","5","P -1","-P 1","2","","","","- C14 H14 Br F3 O2 -","- C14 H14 Br F3 O2 -","- C28 H28 Br2 F6 O4 -","2","1","QD0013","Coles, Simon J.; Hursthouse, Michael B.","3-(4-Bromophenyl)-2-(3,4-dihydro-2<i>H</i>-pyran-5-yl)-1,1,1-trifluoropropan-2-ol","Acta Crystallographica Section C","2000","56","9","e405","e405","10.1107/S0108270100010556","","","0.71073","MoKα","","","0.058","","","","0.18","","","","","","1.002","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011373","12.1251","0.001","8.132","0.0005","19.5195","0.0015","90","","103.23","0.009","90","","1873.6","0.3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Cesium-tantalum-sulfide","","","- Cs6 S22 Ta4 -","- Cs6 S22 Ta4 -","- Cs12 S44 Ta8 -","2","0.5","QD0016","Stoll, Petra; Näther, Christian; Jeß, Inke; Bensch, Wolfgang","Cs~6~Ta~4~S~22~","Acta Crystallographica Section C","2000","56","9","e368","e369","10.1107/S0108270100010829","","","0.71073","MoKα","","0.029","0.024","","","","0.059","","","","","","1.065","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011374","7.162","0.002","15.101","0.004","9.035","0.004","90","","96.89","0.02","90","","970.1","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","trans-[Sn(IV)(C~2~H~4~S~2~)~2~(C~5~H~5~NS)~2~]","trans-bis(ethane-1,2-dithiolato[2-]-S,S~'~)bis(2-mercapto-pyridine)tin(IV)","","- C14 H18 N2 S6 Sn -","- C14 H10 N2 S6 Sn -","- C28 H20 N4 S12 Sn2 -","2","0.5","QD0017","Wu, Li-ming; Chen, Ling; Dai, Jingcao; Lin, Ping; Du, Wen-xin; Wu, Xin-tao","<i>trans</i>-Bis[ethane-1,2-dithiolato(2‒)-<i>S</i>,<i>S</i>']bis(2-mercaptopyridine-<i>S</i>)tin(IV)","Acta Crystallographica Section C","2000","56","9","e382","e382","10.1107/S0108270100011021","","","0.71073","MoKα","","","0.031","","","","0.084","","","","","","1.061","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011375","9.778","0.002","10.879","0.002","5.706","0.002","90","","90","","90","","607","0.3","296.2","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C4 H8 N2 O2 -","- C4 H8 N2 O2 -","- C16 H32 N8 O8 -","4","0.5","QD0020","Sakamoto, Jun; Nakagawa, Takashi; Kanehisa, Nobuko; Kai, Yasushi; Katsura, Masahiro","Methylmalonamide and ethylmalonamide","Acta Crystallographica Section C","2000","56","9","e411","e412","10.1107/S0108270100010866","","","0.7107","MoKα","","","0.0404","","","","0.1146","","","","","","1.152","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011376","6.57","0.001","9.502","0.001","11.032","0.001","90","","96.69","0.01","90","","684.02","0.14","296.2","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C5 H10 N2 O2 -","- C5 H10 N2 O2 -","- C20 H40 N8 O8 -","4","1","QD0020","Sakamoto, Jun; Nakagawa, Takashi; Kanehisa, Nobuko; Kai, Yasushi; Katsura, Masahiro","Methylmalonamide and ethylmalonamide","Acta Crystallographica Section C","2000","56","9","e411","e412","10.1107/S0108270100010866","","","0.7107","MoKα","","","0.0509","","","","0.1203","","","","","","1.131","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011377","12.725","0.004","6.167","0.001","10.228","0.002","90","","111.98","0.01","90","","744.3","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","rac-Dibromosuccinic acid","","- C4 H4 Br2 O4 -","- C4 H4 Br2 O4 -","- C16 H16 Br8 O16 -","4","1","QD0022","Bolte, Michael; Degen, Alexander","<i>rac</i>-2,3-Dibromosuccinic acid","Acta Crystallographica Section C","2000","56","9","e410","e410","10.1107/S0108270100010611","","","0.71073","MoKα","","0.035","0.031","","","","0.081","","","","","","1.119","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011378","34.992","0.004","6.6249","0.0006","14.651","0.002","90","","111.751","0.009","90","","3154.6","0.7","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","none","Bis(μ3-seleno)(η^5^-cyclopentadienyl)hexacarbonyldiironcobalt","","- C11 H5 Co Fe2 O6 Se2 -","- C11 H5 Co Fe2 O6 Se2 -","- C88 H40 Co8 Fe16 O48 Se16 -","8","1","QD0023","Virovets, Alexander V.; Konchenko, Sergey N.","Redetermination of hexacarbonyl(η^5^-cyclopentadienyl)bis(μ~3~-selenido)diiron(II)cobalt(II)","Acta Crystallographica Section C","2000","56","9","e383","e384","10.1107/S0108270100011033","","","0.71069","MoKα","","0.105","0.028","","","","0.062","","","","","","0.693","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011379","18.612","0.008","19.807","0.009","11.087","0.005","90","","95.94","0.03","90","","4065","3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(6R*,16R*)-9,14-Dihydro-6-methyl-6,16-methano-6H,16H-[2,4]benzo- thiazepino[3,4-d][1,3,5]benzoxadiazocine hydrobromide 0.5 dimethylformamide","","- C20.5 H22.5 Br N2.5 O1.5 S -","- C20.5 H22.5 Br N2.5 O1.5 S -","- C164 H180 Br8 N20 O12 S8 -","8","2","SK1354","Kettmann, Viktor; Svetlik, Jan","(6<i>R</i>*,16<i>R</i>*)-9,14-Dihydro-6-methyl-6,16-methano-6<i>H</i>,16<i>H</i>-[2,4]benzothiazepino[3,4-<i>d</i>][1,3,5]benzoxadiazocine hydrobromide dimethylformamide hemisolvate","Acta Crystallographica Section C","2000","56","9","1115","1116","10.1107/S0108270100006727","","","0.71073","MoKα","","0.181","0.063","","","","0.157","","","","","","0.896","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2011380","10.276","0.002","10.276","0.002","30.249","0.004","90","","90","","90","","3194.2","1","293","2","293","2","","","","","","","","7","I -4 2 d","I -4 2bw","122","tris(ethylenediamine)-nickel(II)tetrathioantimonate nitrate","tris(ethylenediamine)-nickel(II)tetrathioantimonate nitrate ?","","- C12 H48 N13 Ni2 O3 S4 Sb -","- C12 H48 N13 Ni2 O3 S4 Sb -","- C48 H192 N52 Ni8 O12 S16 Sb4 -","4","0.25","SK1373","Schur, Michael; Bensch, Wolfgang","Bis[tris(1,2-ethanediamine-<i>N</i>,<i>N</i>')nickel(II)] tetrathioantimonate(V) nitrate","Acta Crystallographica Section C","2000","56","9","1107","1108","10.1107/S0108270100009082","","","0.71073","MoKα","","0.0508","0.031","","","","0.0699","","","","","","1","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2011381","6.216","0.002","14.219","0.006","9.342","0.003","90","","90.91","0.03","90","","825.6","0.5","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","Anilinium hydrogenphosphite","","- C6 H10 N O3 P -","- C6 H10 N O3 P -","- C24 H40 N4 O12 P4 -","4","1","SK1377","Paixão, J. A.; Matos Beja, A.; Ramos Silva, M.; Martin-Gil, J.","Two anilinium salts: anilinium hydrogenphosphite and anilinium hydrogenoxalate hemihydrate","Acta Crystallographica Section C","2000","56","9","1132","1135","10.1107/S0108270100008015","","","0.71073","MoKα","","0.0496","0.0283","","","","0.0839","","","","","","1.048","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011382","23.9825","0.0019","5.7253","0.0014","13.891","0.002","90","","109.34","0.011","90","","1799.7","0.5","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Anilinium hydrogenoxalate monohydrate","","- C8 H10 N O4.5 -","- C8 H10 N O4.5 -","- C64 H80 N8 O36 -","8","1","SK1377","Paixão, J. A.; Matos Beja, A.; Ramos Silva, M.; Martin-Gil, J.","Two anilinium salts: anilinium hydrogenphosphite and anilinium hydrogenoxalate hemihydrate","Acta Crystallographica Section C","2000","56","9","1132","1135","10.1107/S0108270100008015","","","0.71073","MoKα","","0.0451","0.0341","","","","0.1007","","","","","","1.054","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011383","3.9198","0.0001","18.3222","0.0005","7.9352","0.0002","90","","103.221","0.002","90","","554.8","0.03","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-(Nitromethylene)-1,3-dithietane","","- C3 H3 N O2 S2 -","- C3 H3 N O2 S2 -","- C12 H12 N4 O8 S8 -","4","1","SK1398","Shanmuga Sundara Raj, S.; Surya Prakash Rao, H.; Sakthikumar, L.; Fun, Hoong-Kun","2-(Nitromethylene)-1,3-dithietane","Acta Crystallographica Section C","2000","56","9","1113","1114","10.1107/S0108270100009100","","","0.71073","MoKα","","0.0476","0.0384","","","","0.0994","","","","","","0.989","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011384","6.0851","0.0002","18.346","0.0004","11.3499","0.0006","90","","94.02","0.003","90","","1263.95","0.08","293","2","293","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C11 H17 N O4 -","- C11 H17 N O4 -","- C44 H68 N4 O16 -","4","1","SK1400","Luger, Peter; Weber, Manuela; Szeimies, Günter; Pätzel, Michael","3-(<i>tert</i>-Butyloxycarbonylamino)bicyclo[1.1.1]pentanecarboxylic acid at 293K","Acta Crystallographica Section C","2000","56","9","1170","1172","10.1107/S0108270100008994","","","0.71068","MoKα","","0.0873","0.0479","","","","0.1394","","","","","","1.007","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011385","4.86","0.003","32.543","0.004","8.538","0.003","90","","94.79","0.04","90","","1345.6","1","153","","153","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H13 N3 O2 -","- C14 H13 N3 O2 -","- C56 H52 N12 O8 -","4","1","TA1290","Smith, Graham; Bott, Raymond C.; Lynch, Daniel E.","The 1:1 adduct of 4-aminobenzoic acid with 4-aminobenzonitrile","Acta Crystallographica Section C","2000","56","9","1155","1156","10.1107/S010827010000874X","","","0.7107","MoKα","","","0.045","","","","0.043","","","","","","1.795","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011386","8.516","0.003","10.915","0.004","13.054","0.006","90","","95.31","0.01","90","","1208.2","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-poly[[Silver(I)-μ-[(E)-1,2-bis(2-pyridyl)ethylene-N:N']]nitrate]","","- C12 H10 Ag N3 O3 -","- C12 H10 Ag N3 O3 -","- C48 H40 Ag4 N12 O12 -","4","1","TA1291","Tong, Ming-Liang; Chen, Xiao-Ming","<i>catena</i>-Poly[[silver(I)-μ-[(<i>E</i>)-1,2-bis(2-pyridyl)ethylene-<i>N</i>:<i>N</i>']] nitrate]","Acta Crystallographica Section C","2000","56","9","1075","1076","10.1107/S0108270100008647","","","0.71073","MoKα","","0.053","0.034","","","","0.08","","","","","","1.018","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011387","14.2386","0.0009","9.4823","0.0007","28.063","0.002","90","","90","","90","","3788.9","0.5","100","2","100","1","","","","","","","","6","P n a 21","P 2c -2n","33","","trans-Tetrachlorobis(N,N'-dimethylimidazolidine-2-thione)tellurium(IV)","","- C10 H20 Cl4 N4 S2 Te -","- C10 H20 Cl4 N4 S2 Te -","- C80 H160 Cl32 N32 S16 Te8 -","8","2","AV1048","Husebye, Steinar; Törnroos, Karl W.","<i>trans</i>-Tetrachlorobis(<i>N</i>,<i>N</i>'-dimethylimidazolidine-2-thione)tellurium(IV), a thiourea complex of tellurium with asymmetric Te—S bonds","Acta Crystallographica Section C","2000","56","10","1242","1244","10.1107/S0108270100009392","","","0.71073","MoKα","","0.029","0.026","","","","0.052","","","","","","1.182","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011388","12.17","0.002","12.934","0.003","14.112","0.003","66.46","0.03","85.71","0.03","79.46","0.03","2002.1","0.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","(μ-2,6-Bis{[(2-hydroxyphenyl)(2-pyridylmethyl)amino]methyl}-4-methylphenolato)- bis[diaquanickel(II)] acetate dimetylformamide 0.75-hydrate","","- C38 H48.5 N5 Ni2 O10.75 -","- C38 H48.5 N5 Ni2 O10.75 -","- C76 H97 N10 Ni4 O21.5 -","2","1","BK1519","de Brito, Marcos A.; Bortoluzzi, Adailton J.; Greatti, Alessandra; Ceccato, Augusto S.; Joussef, Antônio C.; Drechsel, Sueli M.","(μ-2,6-Bis{[(2-hydroxyphenyl)(2-pyridylmethyl)amino]methyl}-4-methylphenolato)bis[diaquanickel(II)] acetate dimethylformamide 0.75-hydrate","Acta Crystallographica Section C","2000","56","10","1188","1190","10.1107/S0108270100009379","","","0.71073","MoKα","","0.07","0.038","","","","0.107","","","","","","1.013","","","","has coordinates,has Fobs","206183","2020-10-21","18:00:00",""
"2011389","7.4128","0.0007","10.7752","0.001","22.337","0.002","90","","97.538","0.002","90","","1768.7","0.3","297","2","297","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-(4'-hydroxyphenyl)-amino-6,7-dimethoxyquinazoline","","- C17 H20 Cl N3 O4 -","- C17 H20 Cl N3 O4 -","- C68 H80 Cl4 N12 O16 -","4","1","BK1527","Sudbeck, Elise A.; Jennissen, Jason D.; Liu, Xing-Ping; Uckun, Fatih M.","An inhibitor of Janus kinase 3: 4-(4-hydroxyphenylamino)-6,7-dimethoxyquinazolin-1-ium chloride methanol solvate","Acta Crystallographica Section C","2000","56","10","1282","1283","10.1107/S0108270100007496","","","0.71073","MoKα","","0.082","0.048","","","","0.12","","","","","","0.99","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011390","35.161","0.006","13.763","0.006","18.845","0.003","90","","119.104","0.012","90","","7968","4","130","2","130","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","[(TPPBr4)Fe]2O.2CH2Cl2","","- C90 H52 Br8 Cl4 Fe2 N8 O -","- C90 H52 Br8 Cl4 Fe2 N8 O -","- C360 H208 Br32 Cl16 Fe8 N32 O4 -","4","0.5","BK1532","Li, Ming; Shang, Maoyu; Duval, Hugues F.; Scheidt, W. Robert","μ-Oxo-bis[(2,3,12,13-tetrabromo-5,10,15,20-tetraphenylporphyrinato)iron(III)] bis(dichloromethane) solvate","Acta Crystallographica Section C","2000","56","10","1206","1207","10.1107/S0108270100010222","","","0.71073","MoKα","","0.054","0.04","","","","0.099","","","","","","1.041","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011391","22.5868","0.0004","22.5868","0.0004","8.302","0.0001","90","","90","","90","","4235.38","0.12","150","","150","","","","","","","","","3","I 41/a :2","-I 4ad","88","4-(hydroxymethyl)phenanthrene","4-phenanthrenemethanol","","- C15 H12 O -","- C15 H12 O -","- C240 H192 O16 -","16","1","BK1535","Gerkin, Roger E.","Hydrogen bonding and C—H···O interactions in 4-phenanthrenemethanol at 150K","Acta Crystallographica Section C","2000","56","10","1287","1288","10.1107/S0108270100008039","","","0.71073","MoKα","","","0.04","","","","0.102","","","","","","1.92","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011392","11.9418","0.0006","15.288","0.0008","19.0307","0.001","90","","90.915","0.001","90","","3473.9","0.3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tetrakis(μ-p-hydroxybenzoato-O,O')bis(dimethyl sulfoxide-S)dirhodium(II)- tetrakis(μ-butyrato-O,O')bis(dimethyl sulfoxide-S)dirhodium(II) cocrystal ethanol disolvate","","- C56 H84 O26 Rh4 S4 -","- C56 H84 O26 Rh4 S4 -","- C112 H168 O52 Rh8 S8 -","2","0.5","BK1540","Sveshnikov, Nikolay N.; Dickman, Michael H.; Pope, Michael T.","Bis(dimethyl sulfoxide-<i>S</i>)tetrakis(μ-<i>p</i>-hydroxybenzoato-<i>O</i>:<i>O</i>')dirhodium(II)‒tetrakis(μ-butyrato-<i>O</i>:<i>O</i>')bis(dimethyl sulfoxide-<i>S</i>)dirhodium(II) cocrystal ethanol disolvate","Acta Crystallographica Section C","2000","56","10","1193","1195","10.1107/S0108270100009756","","","0.71073","MoKα","","0.039","0.03","","","","0.079","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2011393","5.4734","0.0003","11.4048","0.0006","11.52","0.0006","115.478","0.001","95.941","0.001","93.035","0.001","641.88","0.06","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","1-cyano-2-hydroxy-N-[3-(methylsulphonyl)phenyl]but-2-enamide","","- C12 H12 N2 O4 S -","- C12 H12 N2 O4 S -","- C24 H24 N4 O8 S2 -","2","1","BK1544","Ghosh, Sutapa; Jennissen, Jason D.; Zheng, Yaguo; Uckun, Fatih M.","Three leflunomide metabolite analogs","Acta Crystallographica Section C","2000","56","10","1254","1257","10.1107/S0108270100009768","","","0.71073","MoKα","","0.04","0.034","","","","0.102","","","","","","1.05","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011394","5.2834","0.0004","10.8265","0.0008","13.1634","0.001","69.009","0.001","81.085","0.001","83.238","0.001","692.91","0.09","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","1-cyano-2-hydroxy-N-[3-bromo-4-(trifluromethoxy)phenyl]but-2-enamide","","- C12 H8 Br F3 N2 O3 -","- C12 H8 Br F3 N2 O3 -","- C24 H16 Br2 F6 N4 O6 -","2","1","BK1544","Ghosh, Sutapa; Jennissen, Jason D.; Zheng, Yaguo; Uckun, Fatih M.","Three leflunomide metabolite analogs","Acta Crystallographica Section C","2000","56","10","1254","1257","10.1107/S0108270100009768","","","0.71073","MoKα","","0.103","0.045","","","","0.131","","","","","","1.01","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011395","8.8002","0.001","5.5336","0.0006","25.852","0.003","90","","97.644","0.001","90","","1247.7","0.2","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-cyano-2-hydroxy-N-[4-(methylsulfonyl)phenyl]but-2-enamide","","- C12 H12 N2 O4 S -","- C12 H12 N2 O4 S -","- C48 H48 N8 O16 S4 -","4","1","BK1544","Ghosh, Sutapa; Jennissen, Jason D.; Zheng, Yaguo; Uckun, Fatih M.","Three leflunomide metabolite analogs","Acta Crystallographica Section C","2000","56","10","1254","1257","10.1107/S0108270100009768","","","0.71073","MoKα","","0.051","0.044","","","","0.113","","","","","","1.07","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011396","4.5907","0.0006","15.975","0.002","11.173","0.0013","90","","97.187","0.002","90","","812.95","0.17","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,4,6-trichloro-1-isocyanobenzene","","- C7 H2 Cl3 N -","- C7 H2 Cl3 N -","- C28 H8 Cl12 N4 -","4","1","BK1548","Pink, Maren; Britton, Doyle; Noland, Wayland E.; Pinnow, Matthew J.","2,4,6-Trichlorophenylisonitrile and 2,4,6-trichlorobenzonitrile","Acta Crystallographica Section C","2000","56","10","1271","1273","10.1107/S0108270100010234","","","0.71073","MoKα","","0.081","0.039","","0.095","0.083","","","","0.93","1.04","1.04","","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011397","3.8742","0.0003","15.8897","0.0013","12.9067","0.0011","90","","90.975","0.002","90","","794.42","0.11","173","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,4,6-trichlorobenzonitrile","","- C7 H2 Cl3 N -","- C7 H2 Cl3 N -","- C28 H8 Cl12 N4 -","4","1","BK1548","Pink, Maren; Britton, Doyle; Noland, Wayland E.; Pinnow, Matthew J.","2,4,6-Trichlorophenylisonitrile and 2,4,6-trichlorobenzonitrile","Acta Crystallographica Section C","2000","56","10","1271","1273","10.1107/S0108270100010234","","","0.71073","MoKα","","0.034","0.026","","0.068","0.066","","","","1.08","1.13","1.13","","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011398","10.45","0.003","6.623","0.003","14.828","0.004","90","","103.31","0.03","90","","998.7","0.6","293","2","293","2","","","","","","","","7","C 1 2 1","C 2y","5","Chloramine-B","","","- C6 H8 Cl N Na O3.5 S -","- C6 H8 Cl N Na O3.5 S -","- C24 H32 Cl4 N4 Na4 O14 S4 -","4","1","BM1403","George, Elizabeth; Vivekanandan, Subramania; Sivakumar, Kandasamy","Chloramine-B sesquihydrate","Acta Crystallographica Section C","2000","56","10","1208","1209","10.1107/S0108270100007617","","","0.71073","MoKα","","0.038","0.0345","","","","0.0795","","","","","","1.146","","","","has coordinates,has Fobs","199684","2020-10-21","18:00:00",""
"2011399","16.224","0.002","15.523","0.003","19.061","0.004","90","","99.25","0.01","90","","4738","1.5","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","rhodamine B","3,6-bis(diethylamino)-1',3'-dihydrospiro[xanthene-9,3'-isobenzofuran]-1'-one","","- C28 H30 N2 O3 -","- C28 H28.211 N2 O3 -","- C224 H225.688 N16 O24 -","8","2","BM1410","Kvick, Åke; Vaughan, Gavin B. M.; Wang, Xiqing; Sun, Yuan; Long, Yingcai","A synchrotron-radiation study of the lactone form of rhodamine B at 120K","Acta Crystallographica Section C","2000","56","10","1232","1233","10.1107/S0108270100008404","","","0.496","synchrotron","","0.089","0.058","","","","0.151","","","","","","0.88","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011400","11.47","0.003","9.966","0.006","16.023","0.001","90","","90","","90","","1831.6","1.2","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","DL-Arginine","DL-2-amino-5-guanidovaleric acid","","- C6 H16 N4 O3 -","- C6 H16 N4 O3 -","- C48 H128 N32 O24 -","8","1","BM1417","Kingsford-Adaboh, Robert; Grosche, Manja; Dittrich, Birger; Luger, Peter","<small>DL</small>-Arginine monohydrate at 100K","Acta Crystallographica Section C","2000","56","10","1274","1276","10.1107/S0108270100010325","","","0.71073","MoKα","","0.0346","0.0344","","","","0.0796","","","","","","1.121","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011401","9.124","0.001","26.061","0.003","7.328","0.001","90","","90","","90","","1742.5","0.4","150","2","150","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","2,5-bis[2-(4-methoxyphenyl)ethenyl]pyrazine","","","- C22 H20 N2 O2 -","- C22 H20 N2 O2 -","- C88 H80 N8 O8 -","4","0.5","BM1420","Scaccianoce, Laura; Feeder, Neil; Teat, Simon J.; Marseglia, Elisabeth A.; Grimsdale, Andrew C.; Holmes, Andrew B.","A synchrotron diffraction study of two polymorphic forms of 2,5-bis[2-(4-methoxyphenyl)ethenyl]pyrazine","Acta Crystallographica Section C","2000","56","10","1277","1279","10.1107/S0108270100010337","","","0.6891","synchrotron","","0.075","0.057","","","","0.138","","","","","","1.12","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011402","32.339","0.006","5.732","0.001","9.411","0.002","90","","102.815","0.004","90","","1701","0.6","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","2,5-bis[2-(4-methoxyphenyl)ethenyl]pyrazine","","","- C22 H20 N2 O2 -","- C22 H20 N2 O2 -","- C88 H80 N8 O8 -","4","0.5","BM1420","Scaccianoce, Laura; Feeder, Neil; Teat, Simon J.; Marseglia, Elisabeth A.; Grimsdale, Andrew C.; Holmes, Andrew B.","A synchrotron diffraction study of two polymorphic forms of 2,5-bis[2-(4-methoxyphenyl)ethenyl]pyrazine","Acta Crystallographica Section C","2000","56","10","1277","1279","10.1107/S0108270100010337","","","0.6891","synchrotron","","0.064","0.049","","","","0.141","","","","","","1.089","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011403","8.614","0.002","19.363","0.004","12.473","0.003","90","","95.59","0.03","90","","2070.5","0.8","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C36 H44 Ca N2 O12 Zn2 -","- C36 H44 Ca N2 O12 Zn2 -","- C72 H88 Ca2 N4 O24 Zn4 -","2","0.5","BM1424","Cui, Yong; Zhang, Xing; Zheng, Fakun; Ren, Jing; Chen, Gang; Qian, Yitai; Huang, Jinshun","Two mixed-metal carboxylate‒base adducts","Acta Crystallographica Section C","2000","56","10","1198","1200","10.1107/S0108270100009999","","","0.71073","MoKα","","0.062","0.05","","","","0.155","","","","","","1.149","","","","has coordinates,has disorder,has Fobs","203567","2020-10-21","18:00:00",""
"2011404","20.571","0.0005","13.9851","0.0003","18.8102","0.0004","90","","103.814","0.007","90","","5254.9","0.3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C48 H68 Ca Co2 N2 O12 -","- C48 H68 Ca Co2 N2 O12 -","- C192 H272 Ca4 Co8 N8 O48 -","4","0.5","BM1424","Cui, Yong; Zhang, Xing; Zheng, Fakun; Ren, Jing; Chen, Gang; Qian, Yitai; Huang, Jinshun","Two mixed-metal carboxylate‒base adducts","Acta Crystallographica Section C","2000","56","10","1198","1200","10.1107/S0108270100009999","","","0.71073","MoKα","","0.099","0.062","","","","0.135","","","","","","1.087","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011405","6.2757","0.0013","8.026","0.002","8.09","0.002","90.37","0.03","107.03","0.03","90.86","0.03","389.55","0.17","203","2","203","2","","","","","","","","4","P -1","-P 1","2","Barium hydroxyde iodide tetra-hydrate","Tetraaquabarium hydroxide iodide","","- Ba H9 I O5 -","- Ba H9 I O5 -","- Ba2 H18 I2 O10 -","2","1","BR1264","Fromm, Katharina M.; Goesmann, Helmut","On the way to sol‒gels: an analysis of the intra- and intermolecular hydrogen bonding in [Ba(OH)I(H~2~O)~4~]","Acta Crystallographica Section C","2000","56","10","1179","1180","10.1107/S0108270100009586","","","0.71073","MoKa","","0.017","0.016","","0.039","","0.039","","","1.164","","","1.169","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011406","8.121","0.001","8.121","0.001","13.672","0.003","90","","90","","90","","901.7","0.3","293","2","293","2","","","","","","","","4","P 4/n b m :2","-P 4a 2b","125","","Potassium sodium tin selenide","","- K3 Na Se8 Sn3 -","- K3 Na Se8 Sn3 -","- K6 Na2 Se16 Sn6 -","2","0.125","BR1296","Chen, Xuean; Huang, Xiaoying; Li, Jing","Potassium sodium tin selenide, K~3~NaSn~3~Se~8~","Acta Crystallographica Section C","2000","56","10","1181","1182","10.1107/S0108270100010106","","","0.71073","MoKα","","0.046","0.029","","","","0.071","","","","","","1.228","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011407","10.7358","0.001","15.8301","0.0012","13.4377","0.0008","90","","110.482","0.006","90","","2139.3","0.3","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C25 H18 N2 O2 S2 -","- C25 H18 N2 O2 S2 -","- C100 H72 N8 O8 S8 -","4","1","DA1140","Boryczka, Stanisław; Schreurs, Antoine M. M.; Kroon, Jan; Steiner, Thomas","Bis(4-propargyloxy-3-quinolylthio)methane","Acta Crystallographica Section C","2000","56","10","1234","1235","10.1107/S0108270100008611","","","0.71073","MoKα","","0.0709","0.0476","","","","0.1051","","","","","","1.104","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011408","7.4077","0.0011","22.064","0.003","11.585","0.002","90","","90","","90","","1893.5","0.5","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","Ni(t-salpd)","","","- C19 H24 N2 Ni O6 -","- C19 H24 N2 Ni O6 -","- C76 H96 N8 Ni4 O24 -","4","0.5","DA1141","Gomes, Ligia; Sousa, Carla; Freire, Cristina; de Castro, Baltazar","Diaqua{6,6'-dimethoxy-2,2'-[propane-1,3-diylbis(nitrilomethylidyne-<i>N</i>)]diphenolato-<i>O</i>,<i>O</i>'}nickel(II)","Acta Crystallographica Section C","2000","56","10","1201","1203","10.1107/S010827010001009X","","","0.71073","MoKα","","0.049","0.037","","0.105","","0.093","","","1.05","","","1.1","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011409","8.221","0.001","9.223","0.001","9.483","0.001","109.144","0.002","101.536","0.002","114.01","0.002","572.3","0.11","298","2","","","","","","","","","","6","P -1","-P 1","2","","diaquabis[bis(pyrazol-1-yl-κN^2^)methane]copper(II) diperchlorate","","- C14 H20 Cl2 Cu N8 O10 -","- C14 H20 Cl2 Cu N8 O10 -","- C14 H20 Cl2 Cu N8 O10 -","1","0.5","DE1144","Zhang, Lei; Du, Miao; Tang, Liang-Fu; Leng, Xue-Bing; Wang, Zhi-Hong","A novel three-dimensional copper(II) network <i>via</i> hydrogen bonds: diaquabis[bis(pyrazol-1-yl-κ<i>N</i>^2^)methane]copper(II) diperchlorate","Acta Crystallographica Section C","2000","56","10","1210","1212","10.1107/S0108270100009434","","","0.71073","MoKα","","","0.042","","","","0.124","","","","","","1.019","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2011410","5.37","0.005","8.971","0.008","9.92","0.009","90","","90","","90","","477.9","0.8","163","2","163","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","3-Hydroxycyclopent-2-enone","3-Hydroxycyclopent-2-enone","","- C5 H6 O2 -","- C5 H6 O2 -","- C20 H24 O8 -","4","1","DE1148","Gerrard, Juliet A.; Meade, Susie J.; Morris, Jonathan C.; Steel, Peter J.","Two crystalline modifications of 2-hydroxycyclopent-2-enone","Acta Crystallographica Section C","2000","56","10","1251","1253","10.1107/S0108270100009550","","","0.71073","MoKα","","0.0451","0.0315","","","","0.0697","","","","","","0.977","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011411","9.1","0.007","10.761","0.008","10.124","0.007","90","","106.491","0.011","90","","950.6","1.2","163","2","163","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","3-Hydroxycyclopent-2-enone","3-Hydroxycyclopent-2-enone","","- C5 H6 O2 -","- C5 H6 O2 -","- C40 H48 O16 -","8","2","DE1148","Gerrard, Juliet A.; Meade, Susie J.; Morris, Jonathan C.; Steel, Peter J.","Two crystalline modifications of 2-hydroxycyclopent-2-enone","Acta Crystallographica Section C","2000","56","10","1251","1253","10.1107/S0108270100009550","","","0.71073","MoKα","","0.0937","0.0434","","","","0.1151","","","","","","0.914","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011412","16.124","0.002","16.371","0.002","17.766","0.001","81.676","0.003","66.289","0.002","80.05","0.003","4214.4","0.8","100","2","100","2","","","","","","","","5","P -1","-P 1","2","Trimetrexate","2,4-diamino-5-methyl-6-[(3,4,5-trimethoxyanilino)methyl]quinazoline","","- C80 H110 N20 O17 S2 -","- C80 H110 N20 O17 S2 -","- C160 H220 N40 O34 S4 -","2","1","FG1597","Hempel, Andrew; Camerman, Norman; Mastropaolo, Donald; Camerman, Arthur","The antifolate trimetrexate: observation of the enzyme-binding conformation","Acta Crystallographica Section C","2000","56","10","1225","1227","10.1107/S0108270100008349","","","0.71073","MoKα","","0.198","0.065","","","","0.168","","","","","","0.877","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011413","13.532","0.003","15.223","0.005","12.755","0.003","101.98","0.02","106.91","0.02","83.71","0.02","2455.7","1.2","210","2","210","2","","","","","","","","7","P -1","-P 1","2","","","","- C72 H56 B2 Cl2 F40 Ga12 O16 -","- C72 H56 B2 Cl1.99 F40 Ga12 O16 -","- C72 H56 B2 Cl1.99 F40 Ga12 O16 -","1","0.5","FG1603","Swenson, Dale C.; Dagorne, Samuel; Jordan, Richard F.","A dicationic gallium‒oxo‒hydroxide cage compound","Acta Crystallographica Section C","2000","56","10","1213","1215","10.1107/S0108270100009902","","","0.71073","MoKα","","0.132","0.056","","","","0.122","","","","","","1.11","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2011414","8.268","0.004","17.802","0.007","14.707","0.008","90","","93.32","0.02","90","","2161","1.8","301","","298","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(2,5-dimethoxyphenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-bis(ethoxycarbo nyl)","","- C21 H27 N O6 -","- C21 H27 N O6 -","- C84 H108 N4 O24 -","4","1","FR1251","Sara K. Metcalf; Elizabeth M. Holt","Three methoxy-substituted diethyl 4-phenyl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate compounds","Acta Crystallographica Section C","2000","56","10","1228","1231","10.1107/S0108270100008416","","","0.71073","MoKα","","0.186","0.071","","","","0.25","","","","","","1.01","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011415","8.462","0.006","7.637","0.006","33.44","0.02","90","","94.48","0.02","90","","2154","3","301","","298","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-(3,4-dimethoxyphenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-bis(ethoxycarbo nyl)","","- C21 H27 N O6 -","- C21 H27 N O6 -","- C84 H108 N4 O24 -","4","1","FR1251","Sara K. Metcalf; Elizabeth M. Holt","Three methoxy-substituted diethyl 4-phenyl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate compounds","Acta Crystallographica Section C","2000","56","10","1228","1231","10.1107/S0108270100008416","","","0.71073","MoKα","","0.195","0.085","","","","0.263","","","","","","1.01","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2011416","8.714","0.008","16.167","0.014","16.948","0.014","90","","90","","90","","2388","4","301","","298","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","4-(3,4,5-trimethoxyphenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-bis(ethoxyca rbonyl) (III)","","- C22 H29 N O7 -","- C22 H29 N O7 -","- C88 H116 N4 O28 -","4","1","FR1251","Sara K. Metcalf; Elizabeth M. Holt","Three methoxy-substituted diethyl 4-phenyl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate compounds","Acta Crystallographica Section C","2000","56","10","1228","1231","10.1107/S0108270100008416","","","0.71073","MoKα","","0.125","0.069","","","","0.22","","","","","","1","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2011417","9.1099","0.0007","15.9279","0.0015","20.5073","0.0019","90","","100.445","0.002","90","","2926.3","0.4","193","2","193","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","Astemizole tetrachlorocuprate(II)","1-[(4-Fluorophenyl)methyl]-N-{1-[2-(4-methoxyphenyl)ethyl]-4-piperidin-4-yl}- 1H-benzimidazol-2-ammonium tetrachloro copper(II).","","- C28 H33 Cl4 Cu F N4 O -","- C28 H33 Cl4 Cu F N4 O -","- C112 H132 Cl16 Cu4 F4 N16 O4 -","4","1","FR1280","Parvez, Masood; Braitenbach, Kristin","Astemizole tetrachlorocuprate(II)","Acta Crystallographica Section C","2000","56","10","1216","1217","10.1107/S0108270100007733","","","0.71073","MoKα","","0.142","0.051","","","","0.101","","","","","","0.81","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2011418","10.4286","0.0002","9.1195","0.0002","11.3748","0.0002","90","","112.299","0.0011","90","","1000.88","0.03","150","","150","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","N-(2-hydroxy-1,1-dimethylethyl)benzamide","N-(2-hydroxy-1,1-dimethylethyl)benzamide","","- C11 H15 N O2 -","- C11 H15 N O2 -","- C44 H60 N4 O8 -","4","1","FR1281","Gerkin, Roger E.","Hydrogen bonds and C—H···O interactions in <i>N</i>-(2-hydroxy-1,1-dimethylethyl)benzamide at 150K","Acta Crystallographica Section C","2000","56","10","1218","1219","10.1107/S0108270100007629","","","0.71073","MoKα","","","0.038","","","","0.098","","","","","","1.97","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011419","8.3604","0.0002","8.1567","0.0001","19.1388","0.0004","90","","95.467","0.001","90","","1299.2","0.04","150","","150","","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","2,4,5,7-tetramethylphenanthrene#","","","- C18 H18 -","- C18 H18 -","- C72 H72 -","4","1","FR1287","Gerkin, Roger E.","2,4,5,7-Tetramethylphenanthrene at 150K","Acta Crystallographica Section C","2000","56","10","1220","1221","10.1107/S010827010000843X","","","0.71073","MoKα","","","0.043","","","","0.096","","","","","","1.92","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011420","16.8468","0.0003","37.3753","0.0007","13.8418","0.0003","90","","90","","90","","8715.5","0.3","150","","150","","","","","","","","","3","P n n a","-P 2a 2bc","52","2-[1-(1-naphthyl)ethyl]benzoic acid","","","- C19 H16 O2 -","- C19 H16 O2 -","- C456 H384 O48 -","24","3","FR1289","Gerkin, Roger E.","Hydrogen bonding and C—H···O interactions in 2-[1-(1-naphthyl)ethyl]benzoic acid at 150K","Acta Crystallographica Section C","2000","56","10","1222","1224","10.1107/S0108270100009781","","","0.71073","MoKα","","","0.055","","","","0.076","","","","","","1.67","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011421","6.7449","0.0008","9.8755","0.0013","13.878","0.002","81.586","0.01","86.189","0.01","88.519","0.009","912.3","0.2","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","5-oxocyclooctanecarboxylic acid","","- C9 H14 O3 -","- C9 H14 O3 -","- C36 H56 O12 -","4","2","FR1293","Lalancette, Roger A.; Brunskill, Andrew P. J.; Thompson, Hugh W.","5-Oxocyclooctanecarboxylic acid: hydrogen-bonding pattern and conformational disorder in a medium-ring ε-keto acid","Acta Crystallographica Section C","2000","56","10","1260","1262","10.1107/S0108270100009793","","","0.71073","MoKα","","0.107","0.067","","","","0.178","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2011422","22.195","0.006","5.2607","0.0013","25.413","0.003","90","","98.938","0.015","90","","2931.2","1.1","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","benzyl 2-carboxy-3-ethyl-4-methylpyrrole-5-carboxylate","","- C16 H17 N O4 -","- C16 H17 N O4 -","- C128 H136 N8 O32 -","8","1","GD1110","Ramos Silva, M.; Matos Beja, A.; Paixao, J. A.; Alte da Veiga, L.; Sobral, A. J. F. N.; Rocha Gonsalves, A. M. d'A.","Benzyl 5-carboxy-4-ethyl-3-methylpyrrole-2-carboxylate","Acta Crystallographica Section C","2000","56","10","1263","1264","10.1107/S010827010000980X","","","0.71073","MoKα","","0.138","0.041","","","","0.129","","","","","","0.964","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011423","28.945","0.003","6.5473","0.0009","27.526","0.002","90","","117.622","0.007","90","","4621.9","0.9","294","2","294","2","","","","","","","","6","C 1 2 1","C 2y","5","DSI(Diaryl Sulfonyl Imidazolone)","[(S)-(+)-4-Phenyl-1-[1-(4-aminobenzoyl)indoline-5-sulfonyl]-4,5-dihydro- 2-imidazolone] 0.5-hydrochloride","","- C48 H45 Cl N8 O8 S2 -","- C48 H45 Cl N8 O8 S2 -","- C192 H180 Cl4 N32 O32 S8 -","4","1","GG1010","Park, Kyung-Lae; Moon, Byoung-Gi; Jung, Sang-Hun; Kim, Jin-Gyu; Suh, Il-Hwan","Multicentre hydrogen bonds in a 2:1 arylsulfonylimidazolone hydrochloride salt","Acta Crystallographica Section C","2000","56","10","1247","1250","10.1107/S0108270100009495","","","0.71069","MoKα","","0.082","0.048","","","","0.116","","","","","","1.018","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011424","14.934","0.001","10.115","0.001","15.74","0.001","90","","113.049","0.005","90","","2187.8","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","terbogrel","E-6-[4-(3-tert-butyl-2-cyanoguanidino)phenyl]-6-(3-pyridyl)hex-5-enoic acid","","- C23 H27 N5 O2 -","- C23 H27 N5 O2 -","- C92 H108 N20 O8 -","4","1","GS1099","Michaux, Catherine; Norberg, Bernadette; Dogné , Jean-Michel; Durant, François; Masereel, Bernard; Delarge, Jacques; Wouters, Johan","Terbogrel, a dual-acting agent for thromboxane receptor antagonism and thromboxane synthase inhibition","Acta Crystallographica Section C","2000","56","10","1265","1266","10.1107/S0108270100009872","","","1.54178","CuKα","","0.047","0.036","","","","0.105","","","","","","1.047","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011425","13.8976","0.0001","7.5553","0.0001","17.3704","0.0002","90","","97.947","0.001","90","","1806.39","0.03","133","","133","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H40 Cl6 N12 Si2 -","- C26 H40 Cl6 N12 Si2 -","- C52 H80 Cl12 N24 Si4 -","2","0.5","JZ1418","Hensen, Karl; Spangenberg, Björn; Bolte, Michael","The addition-reaction product of 1,1,1,4,4,4-hexachloro-1,4-disilabutane with <i>N</i>-methylimidazole","Acta Crystallographica Section C","2000","56","10","1245","1246","10.1107/S0108270100009471","","","0.71073","MoKα","","0.0637","0.041","","0.0847","0.0774","0.0847","","","1.078","","","1.078","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011426","11.6811","0.0002","9.8679","0.0002","11.13","0.0002","90","","93.482","0.001","90","","1280.56","0.04","133","2","133","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C7 H9 Br4 N Ti -","- C7 H9 Br4 N Ti -","- C28 H36 Br16 N4 Ti4 -","4","1","JZ1419","Hensen, Karl; Lemke, Alexander; Bolte, Michael","Tetrabromo(2,6-dimethylpyridine-<i>N</i>)titanium(IV), a twinned crystal structure","Acta Crystallographica Section C","2000","56","10","1196","1197","10.1107/S0108270100009811","","","0.71073","MoKα","","0.04","0.034","","","","0.068","","","","","","1.002","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011427","10.1311","0.0003","12.2128","0.0004","14.3972","0.0005","82.423","0.002","80.855","0.003","82.344","0.002","1731.85","0.1","150","0.1","150","0.1","","","","","","","","5","P -1","-P 1","2","","η(1‒5)-4-ferrocenyl-1,2,5,6-tetrakis(trimethylsilyl)cyclohexa-2,4-dien-1-yl- (η^5^-cyclopentadienyl)titanium(II)","","- C33 H52 Fe Si4 Ti -","- C33 H52 Fe Si4 Ti -","- C66 H104 Fe2 Si8 Ti2 -","2","1","JZ1420","Štěpnička, Petr; Císařová, Ivana; Horáček, Michal; Mach, Karel","A ferrocenyl-substituted pseudotitanocene complex","Acta Crystallographica Section C","2000","56","10","1204","1205","10.1107/S0108270100010167","","","0.71073","MoKα","","0.06","0.045","","","","0.113","","","","","","1.069","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011428","19.7221","0.0009","4.8605","0.0002","10.2699","0.0005","90","","97.121","0.001","90","","976.87","0.08","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","trans-cis S-Benzyl dithiocarbazate","","- C8 H10 N2 S2 -","- C8 H10 N2 S2 -","- C32 H40 N8 S8 -","4","1","NA1480","Shanmuga Sundara Raj, S.; Yamin, Bohari M.; Boshaala, Ahmed M. A.; Tarafder, M. T. H.; Fun, Hoong-Kun","<i>trans</i>‒<i>cis</i> <i>S</i>-Benzyl dithiocarbazate","Acta Crystallographica Section C","2000","56","10","1236","1237","10.1107/S0108270100009276","","","0.71073","MoKα","","0.075","0.06","","","","0.113","","","","","","0.976","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011429","8.553","0.005","13.127","0.003","11.819","0.003","106.21","0.02","82.77","0.03","99.72","0.03","1251.6","0.9","293","2","293","2","","","","","","","","7","P -1","-P 1","2","[K(DB18C6)]~2~[Pt(SCN)~4~]","[2,5,8,15,18,21-hexaoxatricyclo[20.4.0.1^9,14^]hexacosa- 1(22)9(14),10,12,23,25-hexadiene-κ^6^O]potassium(I) tetrakis(thiocyanato-S)platinum(II)","","- C44 H48 K2 N4 O12 Pt S4 -","- C44 H48 K2 N4 O12 Pt S4 -","- C44 H48 K2 N4 O12 Pt S4 -","1","0.5","OA1101","Li, Xue; Dou, Jian-Min; Liu, Ying; Zhu, Lan-Ying; Zheng, Pei-Ju","A novel Pt^II^‒dibenzo-18-crown-6 (DB18C6) complex","Acta Crystallographica Section C","2000","56","10","1185","1187","10.1107/S010827010000929X","","","0.71073","MoKα","","0.034","0.025","","","","0.075","","","","","","0.906","","","","has coordinates","197043","2020-10-21","18:00:00",""
"2011430","6.5948","0.0017","9.493","0.003","19.64","0.005","90","","90","","90","","1229.6","0.6","298","2","298","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","sodium calcium tantalate","trisodium dicalcium tantalum hexoxide","","- Ca2 Na3 O6 Ta -","- Ca2 Na3 O6 Ta -","- Ca16 Na24 O48 Ta8 -","8","0.25","OA1102","Yamane, Hisanori; Takahashi, Hiroki; Kajiwara, Takashi; Shimada, Masahiko","Na~3~Ca~2~TaO~6~, a rock-salt superstructure phase with a fully ordered cation arrangement","Acta Crystallographica Section C","2000","56","10","1177","1178","10.1107/S0108270100009306","","","0.71073","MoKα","","0.024","0.015","","","","0.035","","","","","","1.13","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011431","22.155","0.002","7.744","0.0008","13.6293","0.0015","90","","102.906","0.002","90","","2279.3","0.4","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","trans-Dichloro(1,10-bis(mercaptobenzylyl)-4,7-dioxadecane)palladium(II)","","- C20 H26 Cl2 O2 Pd S2 -","- C20 H26 Cl2 O2 Pd S2 -","- C80 H104 Cl8 O8 Pd4 S8 -","4","1","OB1036","Park, Ki-Min; Yoon, Il; Yoo, Byeong Soon; Choi, Jin Beom; Lee, Shim Sung; Kim, Bong Gon","<i>trans</i>-Dichloro(1,12-diphenyl-5,8-dioxa-2,11-dithiadodecane-<i>S</i>,<i>S</i>')palladium(II)","Acta Crystallographica Section C","2000","56","10","1191","1192","10.1107/S010827010000946X","","","0.71073","MoKα","","0.1175","0.0681","","","","0.1996","","","","","","1.061","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011432","12.6304","0.0008","11.3329","0.001","7.0306","0.0006","90","","97.197","0.006","90","","998.42","0.14","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(2-oxoimidazolidinyl)ethyl 2-methylprop-2-enoate","","- C9 H14 N2 O3 -","- C9 H14 N2 O3 -","- C36 H56 N8 O12 -","4","1","OS1113","Spirlet, Marie-Rose; Desreux, Jean F.; Riondel, Alain; Herbst, Gilles; Goudiakas, Jean","2-(2-Oxoimidazolidinyl)ethyl 2-methylprop-2-enoate","Acta Crystallographica Section C","2000","56","10","1258","1259","10.1107/S0108270100009835","","","0.71073","MoKα","","0.045","0.032","","","","0.09","","","","","","0.95","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011433","7.4538","0.0008","7.5568","0.0007","17.6385","0.0013","90","","90","","90","","993.52","0.16","150","2","150","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C11 H12 O4 -","- C11 H12 O4 -","- C44 H48 O16 -","4","1","OS1119","Ellis, Dianne D.; Spek, Anthony L.","(5<i>S</i>)-3-Oxo-4-oxa-<i>endo</i>-tricyclo[5.2.1.0^2,6^]dec-8-en-5-yl acetate","Acta Crystallographica Section C","2000","56","10","1269","1270","10.1107/S0108270100010179","","","0.71073","MoKα","","0.0395","0.0341","","","","0.0825","","","","","","1.08","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011434","18.4896","0.0003","14.4128","0.0005","18.6685","0.0006","90","0.01","97.977","0.003","90","0.01","4926.8","0.2","298","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H23 N5 O4 S -","- C26 H22 N5 O4 S -","- C208 H176 N40 O32 S8 -","8","2","QA0295","El Hazazi, S.; Baouid, A.; Hasnaoui, A.; Pierrot, M.","Éthyl 5-méthylthio-3-(4-nitrophényl)-3a-phényl-3a,4-dihydro-3<i>H</i>-[1,2,4]triazolo[4,3-<i>a</i>][1,5]benzodiazépine-1-carboxylate","Acta Crystallographica Section C","2000","56","10","e457","e458","10.1107/S0108270100011677","","","0.71073","MoKα","","0.083","0.064","","0.063","","0.061","","","1.924","","","1.806","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011435","14.4861","0.0005","16.872","0.001","17.9161","0.0006","90","0.01","152.698","0.002","90","0.01","2008.5","0.2","298","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C23 H25 N3 O2 -","- C23 H25 N3 O2 -","- C92 H100 N12 O8 -","4","1","QA0297","Aatif, A.; Baouid, A.; Hasnaoui, A.; Pierrot, M.","1-Mésityl-6-méthyl-3a,4-propano-3a,4,5,6-tétrahydro[1,2,4]oxadiazolo[4,5-<i>a</i>][1,5]benzodiazépin-5-one","Acta Crystallographica Section C","2000","56","10","e459","e460","10.1107/S0108270100011689","","","0.71073","MoKα","","0.075","0.05","","0.058","","0.057","","","1.451","","","1.399","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011436","9.9313","0.0018","10.3818","0.0014","23.253","0.002","90","","90","","90","","2397.5","0.6","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","2,2'-Methylenebis(3-hydroxy-2-cyclohexen-1-one)","","- C13 H16 O4 -","- C13 H16 O4 -","- C104 H128 O32 -","8","1","QA0324","SethuSankar, K.; Banumathi, S.; Krishna, R.; Velmurugan, D.","2,2'-Methylenebis(3-hydroxy-2-cyclohexen-1-one)","Acta Crystallographica Section C","2000","56","10","e479","e480","10.1107/S0108270100012117","","","1.54184","CuKα","","0.055","0.044","","","","0.176","","","","","","1.311","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011437","9.446","0.001","11.486","0.001","14.342","0.001","90","","93.14","0.01","90","","1553.7","0.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","mer-trichlorotris(thiazole)ruthenium(III)","mer-trichlorotris(thiazole)ruthenium(III)","","- C9 H9 Cl3 N3 Ru S3 -","- C9 H9 Cl3 N3 Ru S3 -","- C36 H36 Cl12 N12 Ru4 S12 -","4","1","QA0327","Pifferi, Claudia; Cini, Renzo","<i>mer</i>-Trichlorotris(1,3-thiazole-<i>N</i>)ruthenium(III)","Acta Crystallographica Section C","2000","56","10","e439","e440","10.1107/S0108270100012191","","","0.71073","MoKα","","0.03","0.0232","","","","0.0554","","","","","","1.009","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2011438","8.81","0.002","11.047","0.002","15.085","0.003","90","","98.67","0.03","90","","1451.4","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","tetramethylammonium di-chloro-di-μ~2~-oxo-tetra-μ~2~-methoxotetradioxo -tetramolybdate(VI)","","- C12 H36 Cl2 Mo4 N2 O14 -","- C12 H36 Cl2 Mo4 N2 O14 -","- C24 H72 Cl4 Mo8 N4 O28 -","2","0.5","QA0331","Strukan, Neven; Cindrić, Marina; Kajfež, Tanja; Kamenar, Boris; Giester, Gerald","The polyoxometallate [(CH~3~)~4~N]~2~[Mo~4~O~10~(OCH~3~)~4~Cl~2~]","Acta Crystallographica Section C","2000","56","10","e443","e444","10.1107/S0108270100012233","","","0.71073","MoKα","","0.041","0.031","","","","0.079","","","","","","1.044","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011439","13.5897","0.0005","10.0316","0.0004","22.624","0.001","90","","147.261","0.003","90","","1668","0.18","298","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C26 H20 Cu F6 N8 O10 S2 -","- C26 H20 Cu F6 N8 O9.94 S2 -","- C52 H40 Cu2 F12 N16 O19.88 S4 -","2","0.5","QA0347","Gueddi, A.; Mernari, B.; Giorgi, M.; Pierrot, M.","Two 2,5-bis(2-pyridinyl)-1,3,4-oxadiazole‒metal complexes (<i>M</i> = Cu and~Ni)","Acta Crystallographica Section C","2000","56","10","e426","e428","10.1107/S0108270100011707","","","0.71073","MoKα","","0.076","0.065","","0.074","","0.074","","","1.496","","","1.635","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2011440","13.6569","0.0009","10.963","0.0007","18.921","0.001","90","0.01","147.752","0.003","90","0.01","1511.6","0.2","298","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H20 Cl2 N8 Ni O12 -","- C24 H16 Cl2 N8 Ni O12 -","- C48 H32 Cl4 N16 Ni2 O24 -","2","0.5","QA0347","Gueddi, A.; Mernari, B.; Giorgi, M.; Pierrot, M.","Two 2,5-bis(2-pyridinyl)-1,3,4-oxadiazole‒metal complexes (<i>M</i> = Cu and~Ni)","Acta Crystallographica Section C","2000","56","10","e426","e428","10.1107/S0108270100011707","","","0.71073","MoKα","","0.088","0.086","","0.075","","0.073","","","2.272","","","2.154","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2011441","7.6475","0.0004","9.2255","0.0003","17.521","0.005","90","0.01","99.122","0.002","90","0.01","1220.5","0.4","298","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H12 N2 O5 -","- C12 H12 N2 O5 -","- C48 H48 N8 O20 -","4","1","QA0354","Ferfra, S.; Ahabchane, N.; Essassi, E. M.; Pierrot, M.","3-(Ethoxycarbonyldihydroxymethyl)-2-oxo-1,2-dihydroquinoxaline","Acta Crystallographica Section C","2000","56","10","e463","e464","10.1107/S0108270100012142","","","0.71073","MoKα","","0.066","0.049","","0.054","","0.054","","","1.479","","","1.472","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011442","10.105","0.003","18.133","0.003","15.59","0.005","90","","103.29","0.02","90","","2780.1","1.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C17 H28 Cu N6 O15 Pt -","- C17 H22 Cu N6 O15 Pt -","- C68 H88 Cu4 N24 O60 Pt4 -","4","1","QA0355","Song, Rita; Kim, Kwan Mook; Sohn, Youn Soo","A zigzag-type one-dimensional coordination polymer formed by (2,2-dimethyl-1,3-propanediamine)bis(isonicotinato)platinum(II) and copper nitrate","Acta Crystallographica Section C","2000","56","10","e447","e447","10.1107/S0108270100012488","","","0.71073","MoKα","","0.043","0.034","","","","0.091","","","","","","1.073","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2011443","9.9783","0.0003","20.4064","0.0007","11.1476","0.0003","90","0.01","93.231","0.002","90","0.01","2266.28","0.12","298","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H25 Cl N2 O6 -","- C24 H25 Cl N2 O6 -","- C96 H100 Cl4 N8 O24 -","4","1","QA0359","Benelbaghdadi, R.; Benharref, A.; Hasnaoui, A.; Lavergne, J. P.; Pierrot, M.; Huet, F.","Diéthyl 10-chloro-7-méthyl-6-oxo-11b-phényl-2,3,5,6,7,11b-héxahydrooxazolino[3,2-<i>d</i>][1,4]benzodiazépine-2,3-carboxylate","Acta Crystallographica Section C","2000","56","10","e461","e462","10.1107/S0108270100012130","","","0.71073","MoKα","","0.053","0.041","","0.047","","0.047","","","1.492","","","1.53","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011444","9.586","0.003","8.279","0.002","11.096","0.005","90","","99.74","0.02","90","","867.9","0.5","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C16 H23 N O8 -","- C16 H23 N O8 -","- C32 H46 N2 O16 -","2","1","QA0365","Gainsford, Graeme J.; Furneaux, Richard H.; Mason, Jenny M.; Tyler, Peter C.","1,2,7,8-Tetra-<i>O</i>-acetylaustraline","Acta Crystallographica Section C","2000","56","10","e477","e478","10.1107/S0108270100012099","","","0.71069","MoKα","","0.081","0.053","","","","0.108","","","","","","1.012","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011445","27.981","0.006","15.523","0.003","8.9366","0.0018","90","","90","","90","","3881.6","1.4","150","2","150","2","","","","","","","","5","P n a 21","P 2c -2n","33","","catena-Poly[[tetrakis[μ-(3-methoxyphenyl)acetato-O:O']dicopper(II)]- μ-2-aminopyrimidine-N^1^:N^3^]","","- C40 H41 Cu2 N3 O12 -","- C40 H41 Cu2 N3 O12 -","- C160 H164 Cu8 N12 O48 -","4","1","QA0366","Lynch, Daniel E.; Duckhouse, Helen L.","<i>catena</i>-Poly[[tetrakis[μ-(3-methoxyphenyl)acetato-<i>O</i>:<i>O</i>']dicopper(II)]-μ-2-aminopyrimidine-<i>N</i>^1^:<i>N</i>^3^]","Acta Crystallographica Section C","2000","56","10","e425","e425","10.1107/S0108270100011653","","","0.71073","MoKα","","0.117","0.049","","","","0.096","","","","","","0.891","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011446","9.7508","0.0007","9.7508","0.0007","28.177","0.002","90","","90","","120","","2320.1","0.3","291","2","291","2","","","","","","","","7","R 3 2 :H","R 3 2""","155","","","","- C12 H24 B2 F8 Na5 Nd O21 -","- C12 H24 B2 F8 Na5 Nd O21 -","- C36 H72 B6 F24 Na15 Nd3 O63 -","3","0.166667","QA0369","Farrugia, Louis J.; Peacock, Robert D.; Stewart, Brian","Lanthanide complexes of 2,2'-oxydiacetate: Na~5~[<i>M</i>(C~4~H~4~O~5~)~3~](BF~4~)~2~·6H~2~O (<i>M</i> = Nd, Sm or Gd)","Acta Crystallographica Section C","2000","56","10","e435","e436","10.1107/S0108270100012087","","","0.71073","MoKα","","0.022","0.022","","","","0.055","","","","","","1.133","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011447","9.7223","0.0011","9.7223","0.0011","28.0728","0.0014","90","","90","","120","","2298","0.4","291","2","291","2","","","","","","","","7","R 3 2 :H","R 3 2""","155","","","","- C12 H24 B2 F8 Na5 O21 Sm -","- C12 H24 B2 F8 Na5 O21 Sm -","- C36 H72 B6 F24 Na15 O63 Sm3 -","3","0.166667","QA0369","Farrugia, Louis J.; Peacock, Robert D.; Stewart, Brian","Lanthanide complexes of 2,2'-oxydiacetate: Na~5~[<i>M</i>(C~4~H~4~O~5~)~3~](BF~4~)~2~·6H~2~O (<i>M</i> = Nd, Sm or Gd)","Acta Crystallographica Section C","2000","56","10","e435","e436","10.1107/S0108270100012087","","","0.71073","MoKα","","0.014","0.014","","","","0.037","","","","","","1.133","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011448","9.7041","0.001","9.7041","0.001","28.025","0.006","90","","90","","120","","2285.5","0.6","291","2","291","2","","","","","","","","7","R 3 2 :H","R 3 2""","155","","","","- C12 H24 B2 F8 Gd Na5 O21 -","- C12 H24 B2 F8 Gd Na5 O21 -","- C36 H72 B6 F24 Gd3 Na15 O63 -","3","0.166667","QA0369","Farrugia, Louis J.; Peacock, Robert D.; Stewart, Brian","Lanthanide complexes of 2,2'-oxydiacetate: Na~5~[<i>M</i>(C~4~H~4~O~5~)~3~](BF~4~)~2~·6H~2~O (<i>M</i> = Nd, Sm or Gd)","Acta Crystallographica Section C","2000","56","10","e435","e436","10.1107/S0108270100012087","","","0.71073","MoKα","","0.012","0.012","","","","0.032","","","","","","1.073","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011449","8.828","0.006","15.174","0.005","16.42","0.007","113.52","0.03","99.27","0.04","83.53","0.04","1987.6","1.8","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","trans-2,3-Dibenzoyl-2-butenedioic acide diethyl ester","","- C22 H20 O6 -","- C22 H20 O6 -","- C88 H80 O24 -","4","2","QA0371","Li, Yi-Zhi; Dai, Rong-Bin; Wu, An-Xin; Wang, Min; Li, Qin-Xi; Sun, Gang-Chun; Wang, Liu-Fang; Xia, Chun-Gu","Diethyl <i>trans</i>-2,3-dibenzoyl-2-butenedioate","Acta Crystallographica Section C","2000","56","10","e455","e456","10.1107/S0108270100011665","","","0.71073","MoKα","","0.018","0.017","","","","0.058","","","","","","0.927","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011450","8.8218","0.0005","9.8252","0.0006","10.1163","0.0006","90","","90","","90","","876.8","0.2","298","","298","","","","","","","","Synthetic","4","P b c a","-P 2ac 2ab","61","","","Mansfieldite","- Al As H4 O6 -","- Al As H4 O6 -","- Al8 As8 H32 O48 -","8","1","","Harrison, William T. A.","Synthetic mansfieldite, AlAsO~4~.2H~2~O","Acta Crystallographica, Section C","2000","56","","e421","e421","10.1107/S0108270100011690","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:12:03",""
"2011451","11.3793","0.0002","5.924","0.0001","12.1901","0.0001","90","","115.31","","90","","742.865","0.019","213","2","213","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H16 Cl2 N4 Ni -","- C12 H16 Cl2 N4 Ni -","- C24 H32 Cl4 N8 Ni2 -","2","0.5","QA0378","Maxcy, Karen R.; Smith, Randy; Willett, Roger D.; Vij, Ashwani","Dichlorobis(1,2-phenylenediamine)nickel(II)","Acta Crystallographica Section C","2000","56","10","e454","e454","10.1107/S0108270100012476","","","0.71073","MoKα","","0.025","0.023","","","","0.057","","","","","","1.218","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011452","8.3328","0.0017","11.68","0.002","11.724","0.002","90","","106.92","0.03","90","","1091.7","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","(4-DMAP)2[SnCl6]","4-Dimethylaminopyridinium hexachlorostanate","","- C14 H22 Cl6 N4 Sn -","- C14 H22 Cl6 N4 Sn0.989 -","- C28 H44 Cl12 N8 Sn1.978 -","2","0.5","QA0379","Willett, Roger D.; Haddad, Salim F.","Bis[4-(dimethylamino)pyridinium] hexachlorostannate(IV)","Acta Crystallographica Section C","2000","56","10","e438","e438","10.1107/S0108270100012129","","","0.71073","MoKα","","0.032","0.025","","","","0.065","","","","","","1.186","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2011453","30.523","0.006","8.4111","0.0017","13.914","0.003","90","","94.4","0.03","90","","3561.6","1.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(pyridinecarboxylato-O,N)(pyridinecarboxylic acid-O,N)manganese(III) hydroxide","","- C18 H14 Mn N3 O7 -","- C18 H14 Mn N3 O7 -","- C144 H112 Mn8 N24 O56 -","8","1","QA0380","Li, Yi-Zhi; Wang, Min; Wang, Liu-Fang; Xia, Chun-Gu","Bis(pyridinecarboxylato-<i>O</i>,<i>N</i>)(pyridinecarboxylic acid-<i>O</i>,<i>N</i>)manganese(III) hydroxide","Acta Crystallographica Section C","2000","56","10","e445","e446","10.1107/S0108270100012245","","","0.71073","MoKα","","0.029","0.029","","","","0.067","","","","","","0.86","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011454","17.304","0.004","13.055","0.003","19.444","0.004","90","","105.8","0.02","90","","4226.5","1.7","300","2","300","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C30 H70 Cl Li N3 Ni O3 P3 -","- C30 H70 Cl Li N3 Ni O3 P3 -","- C120 H280 Cl4 Li4 N12 Ni4 O12 P12 -","4","1","QA0381","Kuchen, Wilhelm; Wunderlich, Hartmut","Three different functions of a phosphinic amidato ligand in <i>L</i>Ni(<i>L</i>Li)(<i>L</i>H) {<i>L</i> = [^<i>t^</i>Bu~2~P(O)NEt]^{-^}}","Acta Crystallographica Section C","2000","56","10","e434","e434","10.1107/S0108270100012075","","","0.71073","MoKα","","0.092","0.045","","","","0.133","","","","","","0.933","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2011455","20.612","0.01","10.053","0.005","13.507","0.007","90","","127.264","0.007","90","","2227.5","1.9","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H12 Br8 Cu N6 -","- C10 H12 Br8 Cu N6 -","- C40 H48 Br32 Cu4 N24 -","4","0.5","QA0382","Willett, Roger D.; Haddad, Salim F.; Twamley, Brendan","Bis(2,6-diamino-3,5-dibromopyridinium) tetrabromocuprate(II)","Acta Crystallographica Section C","2000","56","10","e437","e437","10.1107/S0108270100012105","","","0.71073","MoKα","","0.076","0.05","","","","0.129","","","","","","1.019","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2011456","9.598","0.003","16.056","0.004","18.112","0.004","90","","100.88","0.02","90","","2741","1.3","173","2","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","tris(t-butyl-3-oxobutanoato)iron(III)","","- C24 H39 Fe O9 -","- C24 H39 Fe O9 -","- C96 H156 Fe4 O36 -","4","1","QA0385","Urs, Usha K.; Shalini, K.; Shivashankar, S. A.; Guru Row, T. N.","Low-temperature tris(<i>tert</i>-butyl 3-oxobutanoato)iron(III)","Acta Crystallographica Section C","2000","56","10","e448","e449","10.1107/S010827010001249X","","","0.71069","MoKα","","","0.062","","","","0.173","","","","","","0.906","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011457","9.3491","0.0015","9.7506","0.0012","10.3634","0.0016","83.938","0.011","75.667","0.012","64.891","0.01","828.8","0.2","293","","293","","","","","","","","","5","P -1","-P 1","2","Tetraimidazolium octamolybdate(VI)","","","- C12 H20 Mo8 N8 O26 -","- C12 H20 Mo8 N8 O26 -","- C12 H20 Mo8 N8 O26 -","1","0.5","QA0386","Gili, Pedro; Núñez, Pedro; Martín-Zarza, Pedro; Lorenzo-Luis, Pablo A.","A new inorganic‒organic hybrid: tetraimidazolium octamolybdate(VI) containing the β-form of the [Mo~8~O~26~]^4{-^} anion","Acta Crystallographica Section C","2000","56","10","e441","e442","10.1107/S0108270100012221","","","0.71069","MoKα","","0.031","0.024","","","","0.076","","","","","","0.927","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011458","13.798","0.003","9.335","0.0019","13.729","0.003","90","","107.42","0.03","90","","1687.3","0.7","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H24 Br2 N2 O2 Sn -","- C10 H24 Br2 N2 O2 Sn -","- C40 H96 Br8 N8 O8 Sn4 -","4","1","QA0387","König, Uwe-Christoph; Berkei, Michael; Hirsch, Claudia; Preut, Hans; Mitchell, Terence Nigel","<i>cis</i>-Dibromo-<i>trans</i>-dimethyl-<i>cis</i>-bis(<i>N</i>,<i>N</i>-dimethylacetamide)tin(IV)","Acta Crystallographica Section C","2000","56","10","e452","e453","10.1107/S010827010001221X","","","0.71073","MoKα","","0.043","0.033","","","","0.078","","","","","","1.093","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011459","9.3218","0.0007","9.3218","0.0007","73.631","0.008","90","","90","","120","","5541","0.8","170","2","170","2","","","","","","","","4","P 61 2 2","P 61 2 (0 0 5)","178","","(1S,2S)-1,2-bis(2'-thiophenyl)cyclopentane bis-(-)- menthylcarbonate","","- C39 H54 O4 S2 -","- C39 H54 O4 S2 -","- C234 H324 O24 S12 -","6","0.5","QA0388","Bates, Robert B.; Carducci, Michael D.; Diez, Anna; Forns, Pilar; Kane, Vinayak V.; Rubiralta, Mario","Absolute configuration of a <i>C</i>~2~-symmetric bis(thiophenol)","Acta Crystallographica Section C","2000","56","10","e484","e484","10.1107/S0108270100012506","","","0.71073","MoKα","","0.093","0.045","","","","0.119","","","","","","1","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011460","5.7874","0.0007","7.5327","0.0007","25.3418","0.0019","90","","94.227","0.008","90","","1101.76","0.19","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","organofluorine derivative","N-arylenamine-3-chloro-4-fluoroaniline","","- C13 H9 Cl F N -","- C13 H9 Cl F N -","- C52 H36 Cl4 F4 N4 -","4","1","QD0015","Arjuna Gowda, K. V.; Kokila, M. K.; Puttaraja; Kulkarni, M. V.; Shivaprakash, N. C.","(<i>E</i>)-<i>N</i>-Benzylidene-3-chloro-4-fluoroaniline","Acta Crystallographica Section C","2000","56","10","e481","e482","10.1107/S0108270100012166","","","1.5418","CuKα","","0.041","0.035","","","","0.123","","","","","","0.976","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011461","10.574","0.003","12.983","0.004","19.239","0.006","90","","103.99","0.02","90","","2562.8","1.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(n-butyldiphenylphosphine)dichloro(η^6^-p-cymeme)ruthenium(II)","","- C26 H33 Cl2 P Ru -","- C26 H33 Cl2 P Ru -","- C104 H132 Cl8 P4 Ru4 -","4","1","QD0018","Bruno, Giuseppe; Panzalorto, Manuela; Nicoló, Francesco; Arena, Carmela Grazia; Cardiano, Paola","(<i>n</i>-Butyldiphenylphosphine)dichloro(η^6^-<i>p</i>-cymeme)ruthenium(II)","Acta Crystallographica Section C","2000","56","10","e429","e429","10.1107/S0108270100011896","","","0.71073","MoKα","","0.109","0.057","","","","0.159","","","","","","0.864","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011462","4.9475","0.0005","8.2059","0.0012","35.213","0.005","90","","90","","90","","1429.6","0.3","295","2","295","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Alanine-tryptophan monohydrate","","","- C14 H19 N3 O4 -","- C14 H19 N3 O4 -","- C56 H76 N12 O16 -","4","1","QD0019","Emge, T. J.; Agrawal, A.; Dalessio, J. P.; G. Dukovic; J. A. Inghrim; K. Janjua; M. Macaluso; L. L. Robertson; T. J. Stiglic; Y. Volovik; M. M. Georgiadis","Alaninyltryptophan hydrate, glycyltryptophan dihydrate and tryptophylglycine hydrate","Acta Crystallographica Section C","2000","56","10","e469","e471","10.1107/S0108270100011926","","","1.5418","CuKα","","0.029","0.026","","","","0.063","","","","","","1.004","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011463","5.8404","0.0006","8.2429","0.0008","14.8299","0.001","90","","96.178","0.008","90","","709.79","0.11","295","2","295","2","","","","","","","","4","P 1 21 1","P 2yb","4","Glycine-tryptophan dihydrate","","","- C13 H19 N3 O5 -","- C13 H19 N3 O5 -","- C26 H38 N6 O10 -","2","1","QD0019","Emge, T. J.; Agrawal, A.; Dalessio, J. P.; G. Dukovic; J. A. Inghrim; K. Janjua; M. Macaluso; L. L. Robertson; T. J. Stiglic; Y. Volovik; M. M. Georgiadis","Alaninyltryptophan hydrate, glycyltryptophan dihydrate and tryptophylglycine hydrate","Acta Crystallographica Section C","2000","56","10","e469","e471","10.1107/S0108270100011926","","","1.5418","CuKα","","0.035","0.034","","","","0.08","","","","","","1.002","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011464","16.128","0.002","16.128","0.002","5.195","0.001","90","","90","","90","","1351.3","0.4","295","2","295","2","","","","","","","","4","P 41","P 4w","76","Tryptophan-glycine monohydrate","","","- C13 H17 N3 O4 -","- C13 H17 N3 O4 -","- C52 H68 N12 O16 -","4","1","QD0019","Emge, T. J.; Agrawal, A.; Dalessio, J. P.; G. Dukovic; J. A. Inghrim; K. Janjua; M. Macaluso; L. L. Robertson; T. J. Stiglic; Y. Volovik; M. M. Georgiadis","Alaninyltryptophan hydrate, glycyltryptophan dihydrate and tryptophylglycine hydrate","Acta Crystallographica Section C","2000","56","10","e469","e471","10.1107/S0108270100011926","","","1.5418","CuKα","","0.117","0.061","","","","0.147","","","","","","1.005","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2011465","7.415","0.003","8.353","0.004","24.406","0.01","90","","90","","90","","1511.6","1.1","120","2","120","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(-)-(S)-2-(Fluorodiphenylmethyl)pyrrolidinium chloride","","- C17 H19 Cl F N -","- C17 H19 Cl F N -","- C68 H76 Cl4 F4 N4 -","4","1","QD0021","Batsanov, Andrei S.; Howard, Judith A. K.","(‒)-(<i>S</i>)-2-(Fluorodiphenylmethyl)pyrrolidinium chloride","Acta Crystallographica Section C","2000","56","10","e467","e468","10.1107/S0108270100011914","","","0.71073","MoKα","","0.029","0.027","","","","0.067","","","","","","1.079","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011466","5.643","0.002","15.625","0.008","17.641","0.008","90","","89.98","0.04","90","","1555.4","1.2","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","catena-Bis(thiocyanato)bis(diphenylthiourea)cadmium(II) dihydrate","","- C28 H28 Cd N6 O2 S4 -","- C28 H28 Cd N6 O2 S4 -","- C56 H56 Cd2 N12 O4 S8 -","2","0.5","QD0024","Zhu, Huai-Gang; Yang, Guang; Chen, Xiao-Ming; Ng, Seik Weng","<i>catena</i>-Poly[[[bis(<i>N</i>,<i>N</i>'-diphenylthiourea)cadmium(II)]-di-μ-thiocyanato] dihydrate]","Acta Crystallographica Section C","2000","56","10","e430","e431","10.1107/S0108270100011902","","","0.71073","MoKα","","0.058","0.037","","","","0.097","","","","","","1.037","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011467","9.42","0.003","9.805","0.004","11.228","0.006","114.55","0.04","114.67","0.04","91.03","0.03","833.9","0.8","293","","","","","","","","","","","4","P -1","-P 1","2","","10-Ethyl-3-(4-methoxyphenyl)-1,2,4-triazolo[4'3':2,3]1,2,4- triazino[5,6-b]indole","","- C19 H16 N6 O -","- C19 H16 N6 O -","- C38 H32 N12 O2 -","2","1","QD0026","Shaban, Mohammed A. E.; Morgaan, Ali, E. A.; Chun, Hyungphil; Bernal, Ivan","10-Ethyl-3-(4-methoxyphenyl)-1,2,4-triazolo[4',3':2,3]-1,2,4-triazino[5,6-<i>b</i>]indole","Acta Crystallographica Section C","2000","56","10","e472","e473","10.1107/S010827010001194X","","","0.71073","MoKα","","0.208","0.053","","0.145","","0.115","","","0.831","","","1.223","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011468","7.1613","0.0005","7.1613","0.0005","11.6184","0.0008","90","","90","","120","","516.01","0.06","298","2","298","2","","","","","","","","4","P 63","P 6c","173","","","","- Cs O12 Se2 V3 -","- Cs O12 Se2 V3 -","- Cs2 O24 Se4 V6 -","2","0.333333","QD0027","Harrison, William T. A.","Caesium vanadium selenite, Cs(VO~2~)~3~(SeO~3~)~2~","Acta Crystallographica Section C","2000","56","10","e422","e422","10.1107/S0108270100011719","","","0.71073","MoKα","","0.031","0.029","","","","0.063","","","","","","1.01","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011469","9.079","0.002","7.555","0.002","13.015","0.002","90","","104.1","0.01","90","","865.8","0.3","296.2","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C9 H10 N2 O2 -","- C9 H10 N2 O2 -","- C36 H40 N8 O8 -","4","1","QD0028","Sakamoto, Jun; Nakagawa, Takashi; Kanehisa, Nobuko; Kai, Yasushi; Katsura, Masahiro","2-Phenylmalonamide","Acta Crystallographica Section C","2000","56","10","e485","e486","10.1107/S0108270100011938","","","0.7107","MoKα","","","0.0378","","","","0.1043","","","","","","1.231","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011470","24.191","0.003","10.9675","0.0016","11.6115","0.0015","90","","106.644","0.009","90","","2951.6","0.7","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- Co H14 K4 Mo6 N O31 -","- Co K4 Mo6 N O31 -","- Co4 K16 Mo24 N4 O124 -","4","0.5","QD0030","Lee, Uk; Joo, Hea Chung","Tripotassium hexahydrogenhexamolybdocobaltate(III) potassium nitrate tetrahydrate, K~3~[H~6~CoMo~6~O~24~]·KNO~3~·4H~2~O","Acta Crystallographica Section C","2000","56","10","e423","e424","10.1107/S0108270100012154","","","0.71069","MoKα","","0.057","0.042","","","","0.119","","","","","","1.087","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011471","7.5615","0.0002","11.1023","0.0004","20.9017","0.0005","90","","95.302","0.002","90","","1747.19","0.09","150","2","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C16 H28 O7 -","- C16 H28 O7 -","- C64 H112 O28 -","4","1","QD0032","Light, Mark E.; Hursthouse, Michael B.","Methyl 2-hydroxy-2-[5'-hydroxy-5'-(1-hydroxy-1-methylethyl)-5,2'-dimethylperhydro-2,2'-bifuranyl-5-yl]acetate","Acta Crystallographica Section C","2000","56","10","e483","e483","10.1107/S0108270100012257","","","0.71073","MoKα","","","0.038","","","","0.1","","","","","","1.04","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011472","19.519","0.001","14.269","0.001","26.068","0.002","90","","94.456","0.002","90","","7238.4","0.8","123.2","","293","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2,4,5-Triphenyl-4H-imidazol-4-yl-hydroperoxide dichloromethane solvate (2:1)","","- C43 H34 Cl2 N4 O4 -","- C43 H34 Cl2 N4 O4 -","- C344 H272 Cl16 N32 O32 -","8","1","QD0033","Hu, Zhi Zhi; Takami, Shizuka; Kimura, Masaru; Tachi, Yoshimitsu; Naruta, Yoshinori","2,4,5-Triphenyl-4<i>H</i>-imidazol-4-yl hydroperoxide‒dichloromethane (2/1)","Acta Crystallographica Section C","2000","56","10","e465","e466","10.1107/S0108270100011720","","","1.5418","CuKα","","","0.051","","","","0.142","","","","","","1.149","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011473","5.862","0.0019","12.3986","0.0016","26.854","0.003","90","","90","","90","","1951.8","0.7","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Sodium α-hydronitrilotriacetate dihydrate","","- C6 H12 N Na O8 -","- C6 H12 N Na O8 -","- C48 H96 N8 Na8 O64 -","8","1","QD0035","Kang, Jun-Gill; Hong, Jung-Pyo; Kang, Sung Kwon","Sodium hydrogen nitrilotriacetate dihydrate","Acta Crystallographica Section C","2000","56","10","e432","e433","10.1107/S0108270100012014","","","0.71073","MoKα","","0.056","0.038","","","","0.109","","","","","","1.047","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011474","7.365","0.0015","10.311","0.002","12.311","0.003","78.45","0.03","84.36","0.03","84.38","0.03","908.6","0.4","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C9 H21 Cl4 N O Sn2 -","- C9 H21 Cl4 N O Sn2 -","- C18 H42 Cl8 N2 O2 Sn4 -","2","1","QD0036","König, Uwe-Christoph; Berkei, Michael; Hirsch, Claudia; Preut, Hans; Mitchell, Terence Nigel","Chlorodimethyl(<i>N</i>-methylpyrrolidinone)tin(IV)-μ-chloro-dichlorodimethyltin(IV)","Acta Crystallographica Section C","2000","56","10","e450","e451","10.1107/S0108270100011963","","","0.71073","MoKα","","0.057","0.03","","","","0.063","","","","","","0.804","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011475","9.7083","0.0019","13.214","0.003","11.574","0.002","90","","92.11","0.03","90","","1483.8","0.5","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[(3-tert-Butyl)-1-(2-picolyl) imidazolium] bromide.H~2~O","3-tert-Butyl-1-pyridin-2-ylmethyl-3H-imidazolium bromide-water (1/1)","","- C13 H20 Br N3 O -","- C13 H20 Br N3 O -","- C52 H80 Br4 N12 O4 -","4","1","QD0037","Kleinhenz, Sven; Tulloch, Arran A. D.; Danopoulos, Andreas A.","3-<i>tert</i>-Butyl-1-(2-pyridylmethyl)-3<i>H</i>-imidazolium bromide hydrate","Acta Crystallographica Section C","2000","56","10","e476","e476","10.1107/S0108270100012026","","","0.71073","MoKα","","0.036","0.029","","","","0.071","","","","","","1.065","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011476","5.02","0.001","9.636","0.001","14.506","0.001","90","","98.232","0.004","90","","694.46","0.16","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","7-nitroindazole","","","- C7 H5 N3 O2 -","- C7 H5 N3 O2 -","- C28 H20 N12 O8 -","4","1","QD0040","Ooms, Frédéric; Norberg, Bernadette; Isin, Emre M.; Castagnoli, Neal Jr; Van der Schyf, Cornelis J.; Wouters, Johan","7-Nitroindazole","Acta Crystallographica Section C","2000","56","10","e474","e475","10.1107/S0108270100011975","","","1.5418","CuKα","","0.041","0.037","","","","0.109","","","","","","1.097","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011477","30.879","0.006","13.793","0.005","15.669","0.005","90","","115.68","0.02","90","","6014","3","296.2","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H36 N5 Ni S4 -","- C24 H36 N5 Ni S4 -","- C192 H288 N40 Ni8 S32 -","8","1","SK1387","Mochida, Tomoyuki; Suzuki, Shinya; Moriyama, Hiroshi; Terao, Hiroshi; Sugawara, Tadashi","Tetra-<i>n</i>-butylammonium bis(1,2-dimercaptoethene-1,2-dicarbonitrilato-<i>S</i>,<i>S</i>')nickel(III)","Acta Crystallographica Section C","2000","56","10","1183","1184","10.1107/S0108270100009094","","","0.7107","MoKα","","","0.041","","","","0.1048","","","","","","1.275","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2011478","24.902","0.006","15.109","0.006","6.674","0.002","90","","90","","90","","2511.1","1.4","173","","173","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C14 H12 N2 O4 -","- C14 H12 N2 O4 -","- C112 H96 N16 O32 -","8","1","SK1403","Basu Baul, T. S.; Dhar, S.; Tiekink, E. R. T.","2-Hydroxy-5-[(<i>E</i>)-(4-methoxyphenyl)diazenyl]benzoic acid","Acta Crystallographica Section C","2000","56","10","1280","1281","10.1107/S0108270100010118","","","0.71073","MoKα","","","0.034","","","","0.033","","","","","","1.65","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011479","14.7856","0.0003","7.7565","0.0001","11.9571","0.0002","90","","112.517","0.001","90","","1266.75","0.04","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-[N-methyl-N-hydroxyethyl)amino]benzaldehyde thiosemicarbazone","","- C11 H16 N4 O S -","- C11 H16 N4 O S -","- C44 H64 N16 O4 S4 -","4","1","SK1408","Shanmuga Sundara Raj, S.; Fun, Hoong-Kun; Zhang, Xuan-Jun; Tian, Yu-Peng; Xie, Fu-Xin; Ma, Ji-Long","4-(<i>N</i>-Hydroxyethyl-<i>N</i>-methylamino)benzaldehyde thiosemicarbazone","Acta Crystallographica Section C","2000","56","10","1238","1239","10.1107/S0108270100010180","","","0.71073","MoKα","","0.0865","0.0611","","","","0.1166","","","","","","0.932","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011480","13.6731","0.0009","8.9078","0.0006","12.4539","0.0008","90","","120.07","0.001","90","","1312.7","0.15","306","2","306","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis-(3-nitrophenyl) disulfide","","- C12 H8 N2 O4 S2 -","- C12 H8 N2 O4 S2 -","- C48 H32 N8 O16 S8 -","4","0.5","SK1410","Cannon, Debbie; Glidewell, Christopher; Low, John N.; Wardell, James L.","Bis(3-nitrophenyl) disulfide forms no C—H···O hydrogen bonds","Acta Crystallographica Section C","2000","56","10","1267","1268","10.1107/S010827010001012X","","","0.71073","MoKα","","0.036","0.03","","","","0.089","","","","","","1.047","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011481","9.2881","0.0012","11.9318","0.0013","8.8201","0.0007","91.607","0.008","92.081","0.009","112.925","0.009","898.73","0.18","293","2","293","2","","","","","","","","7","P -1","-P 1","2","oxythiamine hexafluorophosphate monohydrate","3-[(3,4-dihydro-2-methyl-4-oxopyrimidin-5-yl)methyl]- 5-(2-hydroxyethyl)-4-methylthiazolium hexafluorophosphate monohydrate","","- C12 H18 F6 N3 O3 P S -","- C12 H18 F6 N3 O3 P S -","- C24 H36 F12 N6 O6 P2 S2 -","2","1","SX1104","Hu, Ning-Hai; Kiyota, Yasuhiro; Aoki, Katsuyuki","Oxythiamine hexafluorophosphate monohydrate, a thiamine antagonist with the same conformation as thiamine","Acta Crystallographica Section C","2000","56","10","1284","1286","10.1107/S0108270100009847","","","0.71069","MoKα","","0.06","0.051","","","","0.154","","","","","","1.069","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011482","7.692","0.003","16.825","0.003","13.7247","0.0018","90","","99.428","0.018","90","","1752.2","0.8","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","2,4-o-tolyl-3-azabicyclo[3.3.1]nonan-9-one","","- C22 H25 N O -","- C22 H25 N O -","- C88 H100 N4 O4 -","4","1","VJ1106","Vijayalakshmi, L.; Parthasarathi, V.; Venkatraj, M.; Jeyaraman, R.","2,4-Bis(<i>o</i>-tolyl)-3-azabicyclo[3.3.1]nonan-9-one","Acta Crystallographica Section C","2000","56","10","1240","1241","10.1107/S0108270100009318","","","1.5418","CuKα","","0.086","0.064","","","","0.206","","","","","","1.101","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011483","9.128","0.003","10.096","0.002","11.763","0.002","108.19","0.01","91.93","0.02","94.23","0.02","1025.2","0.4","293","2","150","0.1","","","","","","","","5","P -1","-P 1","2","Bis(acridine)(nitrato)silver","Bis(acridine)(nitrato-O,O')silver(I)","","- C26 H18 Ag N3 O3 -","- C26 H18 Ag N3 O3 -","- C52 H36 Ag2 N6 O6 -","2","1","AV1049","Sloufova, Ivana; Slouf, Miroslav","Bis(acridine-<i>N</i>)(nitrato-<i>O</i>,<i>O</i>')silver(I)","Acta Crystallographica Section C","2000","56","11","1312","1313","10.1107/S0108270100011392","","","0.71069","MoKα","","0.021","0.02","","","","0.056","","","","","","1.192","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011484","23.547","0.002","10.922","0.003","19.4876","0.0018","90","","113.34","0.007","90","","4601.7","1.4","289","2","289","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C51 H59 N O11 S -","- C51 H59 N O11 S -","- C204 H236 N4 O44 S4 -","4","1","BJ1002","Kim, Jong Seung; Lee, Won Ku; Rim, Jeong Ah; Jensen, William P.; Lee, Jin-Ho; Kim, Moon-Jib; Kim, Jin-Gyu; Suh, Il-Hwan","25,27-(6-Tosyl-3,9-dioxa-6-azaundecane-1,11-diyldioxy)-26,28-(3,6,9-trioxaundecane-1,11-diyldioxy)calix[4]arene","Acta Crystallographica Section C","2000","56","11","1369","1371","10.1107/S0108270100010921","","","0.71069","MoKα","","0.2033","0.0808","","","","0.2063","","","","","","1.011","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011485","9.416","0.0003","11.4361","0.0003","11.5642","0.0003","118.281","0.001","90.114","0.001","93.444","0.001","1093.98","0.05","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","tris(2-methylphenyl)phosphonium tetrachloroborate","","- C21 H22 B Cl4 P -","- C21 H22 B Cl4 P -","- C42 H44 B2 Cl8 P2 -","2","1","BJ1003","Burke, Jacquelyn M.; Howard, Judith A. K.; Marder, Todd B.; Wilson, Claire","Tris(2-methylphenyl)phosphonium tetrachloroborate","Acta Crystallographica Section C","2000","56","11","1354","1355","10.1107/S0108270100010623","","","0.71073","MoKα","","0.07","0.039","","","","0.09","","","","","","1.001","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011486","13.383","0.005","13.038","0.004","8.372","0.003","90","","121.76","0.04","90","","1242.1","0.9","220","2","220","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","trans-tetraaquabis(trifluoroacetato)manganese(II)","","- C4 H8 F6 Mn O8 -","- C4 H8 F6 Mn O8 -","- C16 H32 F24 Mn4 O32 -","4","0.5","BK1539","Olejnik, Zofia; Lis, Tadeusz","High-temperature phase of <i>trans</i>-tetraaquabis(trifluoroacetato-<i>O</i>)manganese(II)","Acta Crystallographica Section C","2000","56","11","1310","1311","10.1107/S0108270100011215","","","0.71073","MoKα","","0.05","0.042","","","","0.109","","","","","","1.108","","","","has coordinates,has disorder","176760","2020-10-21","18:00:00",""
"2011487","11.3936","0.0003","8.2659","0.0002","16.984","0.0005","90","","90.675","0.0017","90","","1599.41","0.07","148","0.1","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C19 H17 Br O3 -","- C19 H17 Br O3 -","- C76 H68 Br4 O12 -","4","1","BK1550","Lloyd, Barry A.; Arif, Atta M.; Allred, Evan L.","A norbornenyl derivative with through-space ketone π-interaction","Acta Crystallographica Section C","2000","56","11","1377","1379","10.1107/S0108270100011185","","","0.71073","MoKα","","","0.041","","","","0.0898","","","","","","1.009","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011488","11.1247","0.0015","10.4604","0.001","16.6259","0.0014","90","","93.951","0.009","90","","1930.1","0.4","296","","296","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","9-(2',2'-dimethyl-1'-pivaloxypropylidine)fluorene","","- C23 H26 O2 -","- C23 H26 O2 -","- C92 H104 O8 -","4","1","BK1551","Robinson, Paul D.; Lutfi, Hisham G.; Hou, Yuqing; Meyers, Cal Y.","Unexpected dipivaloylation of 9-lithiated fluorene: formation of 1-(fluoren-9-ylidene)-2,2-dimethylpropyl pivalate","Acta Crystallographica Section C","2000","56","11","1380","1382","10.1107/S0108270100011197","","","0.71069","MoKα","","0.107","0.05","","","","0.153","","","","","","1.029","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011489","10.93","0.0009","12.7162","0.0011","15.7085","0.0013","90","","90","","90","","2183.3","0.3","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","tetracycline hydrochloride","[(4S,4aS,5aS,6R,12aS)-2-aminohydroxymethylene-1,2,3,4,4a,5,5a,6,11,12a-decahydro-6,10,12,12a-tetrahydroxy-6-methyl-1,3,11-trioxonaphthacen-4-yl]dimethylammonium chloride","","- C22 H25 Cl N2 O8 -","- C22 H25 Cl N2 O8 -","- C88 H100 Cl4 N8 O32 -","4","1","","Clegg, William; Teat, Simon J.","Tetracycline hydrochloride: a synchrotron micro-crystal study","Acta Crystallographica Section C","2000","56","11","1343","1345","10.1107/S0108270100010349","","","0.6883","synchrotron","","0.063","0.05","","","","0.116","","","","","","0.969","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011490","8.265","0.003","21.698","0.004","9.525","0.0017","90","","110.794","0.019","90","","1596.9","0.7","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","norfloxacin dihydrate","1-ethyl-6-fluoro-1,4-dihydro-4-oxo-7(1-piperzinyl)-3-quinolinecarboxylic acid","","- C16 H22 F N3 O5 -","- C16 H22 F N3 O5 -","- C64 H88 F4 N12 O20 -","4","1","BM1423","Florence, Alastair J.; Kennedy, Alan R.; Shankland, Norman; Wright, Elaine; Al-Rubayi, Ayad","Norfloxacin dihydrate","Acta Crystallographica Section C","2000","56","11","1372","1373","10.1107/S0108270100010933","","","0.71069","MoKα","","0.1753","0.0525","","","","0.1677","","","","","","0.962","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011495","14.2475","0.0002","14.9756","0.0003","20.7125","0.0005","92.144","0.002","91.799","0.002","90.246","0.002","4413.98","0.15","130","","","","","","","","","","","6","P -1","-P 1","2","","Tetrakis(diethylamino)phosphonium bromide hemihydrate","","- C16 H41 Br N4 O0.5 P -","- C16 H41 Br N4 O0.5 P -","- C128 H328 Br8 N32 O4 P8 -","8","4","DA1144","Liu, Yunqi; Fletcher, Michelle O.; Fronczek, Frank R.","Tetrakis(diethylamino)phosphonium bromide hemihydrate","Acta Crystallographica Section C","2000","56","11","1351","1353","10.1107/S0108270100010453","","","0.71073","MoKα","","0.082","0.036","","","","0.072","","","","","","0.89","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011496","8.749","0.002","8.486","0.002","17.325","0.003","90","","96.62","0.02","90","","1277.7","0.5","193","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","cis-dichloro(dimethyl sulfoxide-S)(2-methoxypyridine-N)platinum(II)","","- C8 H13 Cl2 N O2 Pt S -","- C8 H13 Cl2 N O2 Pt S -","- C32 H52 Cl8 N4 O8 Pt4 S4 -","4","1","DA1145","Georgia M. Arvanitis; Charles E. Holmes; Diana G. Johnson; Michael Berardini","<i>cis</i>-Dichloro(dimethyl sulfoxide-<i>S</i>)(2-methoxypyridine-<i>N</i>)platinum(II)","Acta Crystallographica Section C","2000","56","11","1332","1333","10.1107/S0108270100010465","","","0.71073","MoKα","","","0.029","","","","0.036","","","","","","1.42","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011497","8.795","0.004","15.958","0.005","8.903","0.004","90","","106.78","0.05","90","","1196.3","0.9","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Triazido[N-(2-aminoethyl)-1,3-propanediamine]cobalt(III)","","- C5 H15 Co N12 -","- C5 H15 Co N12 -","- C20 H60 Co4 N48 -","4","1","DA1147","Chun, Hyungphil; Bernal, Ivan","Triazidocobalt(III) complexes with tridentate amine ligands","Acta Crystallographica Section C","2000","56","11","1326","1329","10.1107/S0108270100011793","","","0.71073","MoKα","","0.1115","0.052","","0.1408","","0.1253","","","0.945","","","1.139","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011498","8.56","0.003","9.404","0.002","16.149","0.004","90","","91.65","0.03","90","","1299.4","0.6","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Triazido[N,N-(2-aminoethyl)-methyl-1,3-propanediamine]cobalt(III)","","- C6 H17 Co N12 -","- C6 H17 Co N12 -","- C24 H68 Co4 N48 -","4","1","DA1147","Chun, Hyungphil; Bernal, Ivan","Triazidocobalt(III) complexes with tridentate amine ligands","Acta Crystallographica Section C","2000","56","11","1326","1329","10.1107/S0108270100011793","","","0.71073","MoKα","","0.0341","0.0221","","0.0599","","0.0569","","","1.045","","","1.118","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011499","9.804","0.0012","9.286","0.002","14.209","0.002","90","","94.267","0.014","90","","1290","0.4","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Triazido[N-(3-aminopropyl)-1,3-propanediamine]cobalt(III)","","- C6 H17 Co N12 -","- C6 H17 Co N12 -","- C24 H68 Co4 N48 -","4","1","DA1147","Chun, Hyungphil; Bernal, Ivan","Triazidocobalt(III) complexes with tridentate amine ligands","Acta Crystallographica Section C","2000","56","11","1326","1329","10.1107/S0108270100011793","","","0.71073","MoKα","","0.0534","0.0253","","0.0652","","0.0603","","","1.025","","","1.139","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011500","8.848","0.005","8.931","0.002","9.606","0.003","105.98","0.02","90.51","0.04","106.99","0.03","694.6","0.5","293","","293","","","","","","","","","4","P -1","-P 1","2","","Triazido[3,3'-diamino-N-methyldopropylamine]cobalt(III)","","- C7 H19 Co N12 -","- C7 H19 Co N12 -","- C14 H38 Co2 N24 -","2","1","DA1147","Chun, Hyungphil; Bernal, Ivan","Triazidocobalt(III) complexes with tridentate amine ligands","Acta Crystallographica Section C","2000","56","11","1326","1329","10.1107/S0108270100011793","","","0.71073","MoKα","","0.0351","0.0255","","0.0687","","0.0661","","","1.064","","","1.125","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011501","10.962","0.002","11.407","0.002","11.674","0.002","95.46","0.03","109.57","0.03","114.2","0.03","1207.8","0.7","133","2","133","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H66 Cl12 In4 N6 -","- C24 H66 Cl12 In4 N6 -","- C24 H66 Cl12 In4 N6 -","1","0.5","DE1146","Müller, Peter; Usón, Isabel; Prust, Jörg; Roesky, Herbert W.","Tetrameric indium trichloride, a new modification of a widely used compound","Acta Crystallographica Section C","2000","56","11","1300","1301","10.1107/S0108270100010362","","","0.71073","MoKα","","0.026","0.023","","","","0.054","","","","","","1.138","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011502","6.8865","0.0002","8.084","0.0002","9.8348","0.0001","70.542","0.001","75.896","0.001","71.249","0.001","483.083","0.019","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","N-Propiolyl-1,2-benzisoselenazol-3(2H)-one","","- C10 H9 N O2 Se -","- C10 H9 N O2 Se -","- C20 H18 N2 O4 Se2 -","2","1","DE1150","Peng, Yun Shan; Xu, Han Sheng; Naumov, Pance; Shanmuga Sundara Raj, S.; Fun, Hoong-Kun; Abdul Razak, Ibrahim; Ng, Seik Weng","<i>N</i>-Propionyl-1,2-benzisoselenazol-3(2<i>H</i>)-one","Acta Crystallographica Section C","2000","56","11","1386","1388","10.1107/S0108270100011276","","","0.71073","MoKα","","0.0618","0.056","","","","0.1503","","","","","","1.011","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011503","8.9714","0.0006","11.7112","0.0011","26.718","0.002","90","","97.271","0.005","90","","2784.6","0.4","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethyl methyl 1,4-dihydro-4-(3-nitrophenyl)-2,6-bis(1-piperidylmethyl)pyridine -3,5-dicarboxylate","","- C28 H38 N4 O6 -","- C28 H38 N4 O6 -","- C112 H152 N16 O24 -","4","1","FR1242","Duque, Julio; Novoa de Armas, Héctor; Pomés Hernández, Ramón; Suárez Navarro, Margarita; Ochoa Rodríguez, Estael; Salfrán, Esperanza; Verdecia Reyes, Yamila; Blaton, Norbert. M; Peeters, Oswald M.; De Ranter, Camiel J.","Ethyl methyl 1,4-dihydro-4-(3-nitrophenyl)-2,6-bis(1-piperidylmethyl)pyridine-3,5-dicarboxylate","Acta Crystallographica Section C","2000","56","11","1346","1347","10.1107/S0108270100010416","","","1.54178","CuKα","","0.063","0.054","","0.117","","0.27","","","1.205","","","1.205","","","","has coordinates","291312","2024-04-22","12:47:22",""
"2011504","28.227","0.006","5.991","0.003","12.873","0.003","90","","94.753","0.019","90","","2169.4","1.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Terephthaldehyde Thiosemicarbazone Bis-N,N-Dimethylformamide","","- C16 H26 N8 O2 S2 -","- C16 H26 N8 O2 S2 -","- C64 H104 N32 O8 S8 -","4","0.5","FR1278","Wu, De-Hong; He, Cheng; Duan, Chun-Ying; You, Xiao-Zeng","Terephthalaldehyde bis(thiosemicarbazone) bis(dimethylformamide) solvate","Acta Crystallographica Section C","2000","56","11","1336","1337","10.1107/S0108270100009914","","","0.71073","MoKα","","0.048","0.038","","","","0.11","","","","","","1.027","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011505","21.466","0.003","8.167","0.001","9.495","0.003","90","","93.07","0.02","90","","1662.2","0.6","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C17 H14 Br2 N2 Ni O2 -","- C17 H14 Br2 N2 Ni O2 -","- C68 H56 Br8 N8 Ni4 O8 -","4","0.5","FR1285","Elmali, Ayhan; Zeyrek, C. Tuǧrul; Elerman, Yalc̨ın; Svoboda, Ingrid","[<i>N</i>,<i>N</i>'-Bis(5-bromosalicylidene)-1,3-diaminopropane]nickel(II) and [<i>N</i>,<i>N</i>'-bis(5-chlorosalicylidene)-1,3-diaminopropane]copper(II)","Acta Crystallographica Section C","2000","56","11","1302","1304","10.1107/S0108270100010428","","","0.71073","MoKα","","0.0933","0.032","","","","0.085","","","","","","0.966","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011506","21.022","0.003","8.14","0.002","9.416","0.003","90","","94.06","0.02","90","","1607.2","0.7","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C17 H14 Cl2 Cu N2 O2 -","- C17 H14 Cl2 Cu N2 O2 -","- C68 H56 Cl8 Cu4 N8 O8 -","4","0.5","FR1285","Elmali, Ayhan; Zeyrek, C. Tuǧrul; Elerman, Yalc̨ın; Svoboda, Ingrid","[<i>N</i>,<i>N</i>'-Bis(5-bromosalicylidene)-1,3-diaminopropane]nickel(II) and [<i>N</i>,<i>N</i>'-bis(5-chlorosalicylidene)-1,3-diaminopropane]copper(II)","Acta Crystallographica Section C","2000","56","11","1302","1304","10.1107/S0108270100010428","","","0.71073","MoKα","","0.059","0.037","","","","0.106","","","","","","1.127","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011507","12.2436","0.0006","12.2436","0.0006","8.0708","0.0006","90","","90","","90","","1209.86","0.12","293","2","293","2","","","","","","","","7","P -4","P -4","81","","","","- C12 H22 Hg Mn N6 O4 S4 -","- C12 H22 Hg Mn N6 O4 S4 -","- C24 H44 Hg2 Mn2 N12 O8 S8 -","2","0.5","GD1102","Wang, Xin Qiang; Yu, Wen Tao; Xu, Dong; Lu, Meng Kai; Yuan, Duo Rong; Liu, Jiu Rong; Lu, Guang Tian","Polymeric diaquatetra-μ-thiocyanato-manganese(II)mercury(II) bis(<i>N</i>,<i>N</i>-dimethylacetamide) solvate","Acta Crystallographica Section C","2000","56","11","1305","1307","10.1107/S010827010001043X","","","0.71073","MoKα","","0.0542","0.0328","","","","0.0758","","","","","","1.035","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011508","18.858","0.007","3.864","0.001","8.19","0.007","90","","90","","90","","596.8","0.6","293","2","293","2","","","","","","","","3","P n a 21","P 2c -2n","33","","m-hydroxybenzaldehyde","","- C7 H6 O2 -","- C7 H6 O2 -","- C28 H24 O8 -","4","1","GD1106","Paixão, J. A.; Matos Beja, A.; Ramos Silva, M.; Alte da Veiga, L.; Serra, A.C.","3-Hydroxybenzaldehyde","Acta Crystallographica Section C","2000","56","11","1348","1350","10.1107/S0108270100010441","","","0.71073","MoKα","","0.0548","0.0304","","","","0.0848","","","","","","1.07","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011509","19.8403","0.0004","19.8403","0.0004","6.5068","0.0002","90","","90","","90","","2561.32","0.11","150","","150","","","","","","","","","3","P -4","P -4","81","","1,2-Diphenylbut-3-yn-2-ol","","- C16 H14 O -","- C16 H14 O -","- C128 H112 O8 -","8","2","GD1108","Madhavi, N. N. Laxmi; Desiraju, Gautam R.; Bilton, Clair; Howard, Judith A.K.; Allen, Frank H.","Racemic 1,2-diphenylbut-3-yn-2-ol","Acta Crystallographica Section C","2000","56","11","1359","1360","10.1107/S0108270100011343","","","0.71073","MoKα","","0.045","0.037","","","","0.092","","","","","","1.024","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011510","6.55","0.001","16.931","0.003","6.493","0.001","90","","95.42","0.03","90","","716.8","0.2","150","","150","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4-ethynyl-4-hydroxycyclohexan-1-one","","- C8 H10 O2 -","- C8 H10 O2 -","- C32 H40 O8 -","4","1","GD1109","Bilton, Clair; Howard, Judith A. K.; Madhavi, N. N. Laxmi; Desiraju, Gautam R.; Allen, Frank H.","4-Ethynyl-4-hydroxycyclohexan-1-one and 4-ethynyl-4-hydroxy-2,3,5,6-tetramethylcyclohexa-2,5-dien-1-one","Acta Crystallographica Section C","2000","56","11","1356","1358","10.1107/S0108270100011355","","","0.71073","MoKα","","0.102","0.055","","","","0.122","","","","","","1.07","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011511","9.02","0.002","14.01","0.003","16.612","0.003","90","","93.56","0.03","90","","2095.2","0.8","150","","150","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4-ethynyl-4-hydroxy-2,3,4,5-tetramethylcyclohexa-2,5-diene-1-one","","- C12 H14 O2 -","- C12 H14 O2 -","- C96 H112 O16 -","8","2","GD1109","Bilton, Clair; Howard, Judith A. K.; Madhavi, N. N. Laxmi; Desiraju, Gautam R.; Allen, Frank H.","4-Ethynyl-4-hydroxycyclohexan-1-one and 4-ethynyl-4-hydroxy-2,3,5,6-tetramethylcyclohexa-2,5-dien-1-one","Acta Crystallographica Section C","2000","56","11","1356","1358","10.1107/S0108270100011355","","","0.71073","MoKα","","0.093","0.052","","","","0.145","","","","","","1.01","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011512","6.947","0.002","6.469","0.003","7.478","0.003","90","","110.51","0.03","90","","314.8","0.2","295","2","295","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","2,3-Dihydro-3-methyl-2-nitriminothiazole","","- C4 H5 N3 O2 S -","- C4 H5 N3 O2 S -","- C8 H10 N6 O4 S2 -","2","0.5","GD1113","Kyzioł, Janusz; Daszkiewicz, Zdzisław; Zaleski, Jacek","2,3-Dihydro-3-methyl-2-nitrimino-1,3-thiazole","Acta Crystallographica Section C","2000","56","11","1401","1403","10.1107/S0108270100011604","","","0.71073","MoKα","","0.035","0.034","","","","0.097","","","","","","1.111","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011513","13.039","0.002","15.261","0.0016","21.319","0.005","90","","107.581","0.014","90","","4044.1","1.2","160","2","160","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H25 B9 S -","- C16 H25 B9 S -","- C128 H200 B72 S8 -","8","2","GD1115","Ellis, David; Rosair, Georgina M.; Robertson, Susan; Welch, Alan J.","7,8-Diphenyl-9-dimethylsulfido-10,11-μ-hydro-7,8-dicarba-<i>nido</i>-undecaborane(9)","Acta Crystallographica Section C","2000","56","11","1399","1400","10.1107/S0108270100011471","","","0.71073","MoKα","","0.0755","0.0496","","","","0.1291","","","","","","1.037","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011514","7.247","0.004","57.94","0.003","5.048","0.004","90","","90","","90","","2120","2","296","2","296","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","1,21-Henicosanediol","","","- C21 H44 O2 -","- C21 H44 O2 -","- C84 H176 O8 -","4","1","GG1020","Naotake Nakamura; Kenjiro Uno; Yoshihiro Ogawa","1,21-Henicosanediol","Acta Crystallographica Section C","2000","56","11","1389","1390","10.1107/S0108270100011288","","","1.5418","CuKα","","0.076","0.051","","0.09","","0.083","","","1.67","","","1.896","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011515","11.704","0.001","11.751","0.002","15.64","0.002","91.75","0.01","92.18","0.01","90.55","0.01","2148.3","0.5","298","","","","","","","","","","","5","P -1","-P 1","2","","","","- C45 H55 N O6 P2 -","- C45 H55 N O6 P2 -","- C90 H110 N2 O12 P4 -","2","1","GG1021","Hökelek, Tuncer; Akduran, Nurcan; Begeç, Saliha; Kılıç, Adem; Kılıç, Zeynel","<i>N</i>-[Bis(2,4,6-trimethylphenoxy)phosphinoyl]-<i>P</i>,<i>P</i>,<i>P</i>-tris(2,4,6-trimethylphenoxy)phosphazene","Acta Crystallographica Section C","2000","56","11","1404","1406","10.1107/S010827010001177X","","","1.5418","CuKα","","","0.0683","","","","0.1993","","","","","","1.002","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2011516","10.017","0.003","16.575","0.006","4.883","0.003","95.63","0.03","90.84","0.04","106.28","0.03","773.7","0.6","298","1","","","","","","","","","","5","P -1","-P 1","2","","","","- C14 H14 Cl2 N2 O4 -","- C14 H14 Cl2 N2 O4 -","- C28 H28 Cl4 N4 O8 -","2","1","GG1022","Eishima, Makoto; Ohba, Shigeru; Suzuki, Masumi; Nagasawa, Chiaki; Sugai, Takeshi","Racemic and chiral 1-[<i>N</i>-(chloroacetyl)carbamoylamino]-2,3-dihydro-1<i>H</i>-inden-2-yl chloroacetate","Acta Crystallographica Section C","2000","56","11","1391","1393","10.1107/S010827010001129X","","","0.71073","MoKα","","","0.051","","","","0.141","","","","","","1.02","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011517","11.409","0.002","4.595","0.002","15.667","0.001","90","","105.079","0.009","90","","793.1","0.4","298","1","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C14 H14 Cl2 N2 O4 -","- C14 H14 Cl2 N2 O4 -","- C28 H28 Cl4 N4 O8 -","2","1","GG1022","Eishima, Makoto; Ohba, Shigeru; Suzuki, Masumi; Nagasawa, Chiaki; Sugai, Takeshi","Racemic and chiral 1-[<i>N</i>-(chloroacetyl)carbamoylamino]-2,3-dihydro-1<i>H</i>-inden-2-yl chloroacetate","Acta Crystallographica Section C","2000","56","11","1391","1393","10.1107/S010827010001129X","","","0.71073","MoKα","","","0.057","","","","0.126","","","","","","0.97","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011518","17.202","0.002","10.9235","0.0018","22.3209","0.0016","90","","105.667","0.007","90","","4038.4","0.9","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Tris(nitrato-O,O')bis(triphenylphosphineoxide-O)(ethanol-O)-cerium(III)","","- C38 H36 Ce N3 O12 P2 -","- C38 H35 Ce N3 O12 P2 -","- C152 H140 Ce4 N12 O48 P8 -","4","1","GS1104","Levason, William; Newman, Elizabeth H.; Webster, Michael","(Ethanol-<i>O</i>)tris(nitrato-<i>O</i>,<i>O</i>')bis(triphenylphosphine oxide-<i>O</i>)cerium(III)","Acta Crystallographica Section C","2000","56","11","1308","1309","10.1107/S0108270100010842","","","0.71073","MoKα","","0.0541","0.0313","","","","0.0914","","","","","","1.031","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2011519","7.2821","0.0006","7.2821","0.0006","16.889","0.002","90","","90","","120","","775.62","0.13","293","2","293","2","","","","","","","","5","R -3 m :H","-R 3 2""","166","","Sodium trivanadium disulfate hexahydroxide","","- H6 Na O14 S2 V3 -","- H6 Na O14 S2 V3 -","- H18 Na3 O42 S6 V9 -","3","0.0833333","IZ1003","Dobley, Arthur; Zavalij, Peter Y.; Whittingham, M. Stanley","Sodium trivanadium(III) bis(sulfate) hexahydroxide","Acta Crystallographica Section C","2000","56","11","1294","1295","10.1107/S0108270100011239","","","0.71073","MoKα","","0.0271","0.0263","","","","0.0719","","","","","","1.306","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011520","16.123","0.002","11.684","0.001","15.815","0.002","90","","90.74","0.01","90","","2979","0.6","300","2","300","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis(P,P-di-tert-butylthiophosphinic-N-isopropylamidato-N,S)nickel(II)","","- C22 H50 N2 Ni P2 S2 -","- C22 H50 N2 Ni P2 S2 -","- C88 H200 N8 Ni4 P8 S8 -","4","1","JZ1401","Kuchen, Wilhelm; Wunderlich, Hartmut","Bis(di-<i>tert</i>-butylthiophosphinic isopropylamidato-<i>N</i>,<i>S</i>)nickel(II)","Acta Crystallographica Section C","2000","56","11","1296","1297","10.1107/S0108270100011264","","","0.71073","MoKα","","0.058","0.039","","","","0.116","","","","","","1","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011521","10.193","0.002","14.477","0.003","12.092","0.002","90","","96.29","0.03","90","","1773.6","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4,5-Diazafluoren-9-ol","","- C11 H8 N2 O -","- C11 H8 N2 O -","- C88 H64 N16 O8 -","8","2","NA1481","Tu, Chao; Zhu, Dun-Ru; Xu, Yan; Ke, Xiao-Kang; Guo, Zijian","4,5-Diazafluoren-9-ol","Acta Crystallographica Section C","2000","56","11","1334","1335","10.1107/S0108270100009823","","","0.71073","MoKα","","0.14","0.037","","","","0.085","","","","","","1.023","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2011522","7.1366","0.0005","16.0369","0.001","7.4236","0.0005","90","","98.121","0.001","90","","841.1","0.1","293","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis-(1,5-diazacyclooctane) nickel(II) bromide","","- C12 H28 Br2 N4 Ni -","- C12 H28 Br2 N4 Ni -","- C24 H56 Br4 N8 Ni2 -","2","0.5","OA1103","Du, Miao; Bu, Xian-He; Leng, Xue-Bing; Guo, Ya-Mei; Zhang, Ruo-Hua","Bis(1,5-diazacyclooctane-<i>N</i>,<i>N</i>')nickel(II) dibromide","Acta Crystallographica Section C","2000","56","11","1314","1315","10.1107/S0108270100011598","","","0.71073","MoKα","","","0.0253","","","","0.0649","","","","","","1.146","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011523","8.3945","0.0009","6.4096","0.0007","13.8798","0.0014","90","","103.899","0.004","90","","724.94","0.13","108","2","108","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","4-vinylbenzoic acid","4-vinylbenzoic acid","","- C9 H8 O2 -","- C9 H8 O2 -","- C36 H32 O8 -","4","1","OB1035","Yasuda, Nobuhiro; Uekusa, Hidehiro; Ohashi, Yuji","4-Vinylbenzoic acid and 9-vinylanthracene","Acta Crystallographica Section C","2000","56","11","1364","1366","10.1107/S0108270100010805","","","0.71073","MoKα","","0.0404","0.039","","","","0.1072","","","","","","1.054","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011524","8.2876","0.0016","6.5504","0.0012","14.247","0.002","90","","102.651","0.008","90","","754.7","0.2","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","4-vinylbenzoic acid","4-vinylbenzoic acid","","- C9 H8 O2 -","- C9 H8 O2 -","- C36 H32 O8 -","4","1","OB1035","Yasuda, Nobuhiro; Uekusa, Hidehiro; Ohashi, Yuji","4-Vinylbenzoic acid and 9-vinylanthracene","Acta Crystallographica Section C","2000","56","11","1364","1366","10.1107/S0108270100010805","","","0.71073","MoKα","","0.062","0.0514","","","","0.1388","","","","","","1.071","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011525","9.3213","0.0003","13.6798","0.0004","8.8957","0.0003","90","","109.467","0.001","90","","1069.48","0.06","123","2","123","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","9-vinylanthracene","9-vinylanthracene","","- C16 H12 -","- C16 H12 -","- C64 H48 -","4","1","OB1035","Yasuda, Nobuhiro; Uekusa, Hidehiro; Ohashi, Yuji","4-Vinylbenzoic acid and 9-vinylanthracene","Acta Crystallographica Section C","2000","56","11","1364","1366","10.1107/S0108270100010805","","","0.71073","MoKα","","0.0454","0.0412","","","","0.1151","","","","","","1.067","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011526","9.3873","0.0005","13.9756","0.001","8.9889","0.0007","90","","110.066","0.001","90","","1107.7","0.13","293","2","293","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","9-vinylanthracene","9-vinylanthracene","","- C16 H12 -","- C16 H12 -","- C64 H48 -","4","1","OB1035","Yasuda, Nobuhiro; Uekusa, Hidehiro; Ohashi, Yuji","4-Vinylbenzoic acid and 9-vinylanthracene","Acta Crystallographica Section C","2000","56","11","1364","1366","10.1107/S0108270100010805","","","0.71073","MoKα","","0.0688","0.0556","","","","0.1508","","","","","","1.056","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011527","12.455","0.005","12.401","0.005","11.14","0.005","90","","107.259","0.005","90","","1643.1","1.2","296","2","296","2","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C23 H20 O -","- C23 H20 O -","- C92 H80 O4 -","4","1","OB1037","Isobe, Shin-ichiro; Kubo, Kanji; Thiemann, Thies; Sawada, Tsuyoshi; Yonemitsu, Tadashi; Mataka, Shuntaro","Benzo[<i>i</i>]naphtho[<i>c</i>,<i>d</i>]bicyclo[5.4.1]dodecan-12-one","Acta Crystallographica Section C","2000","56","11","1367","1368","10.1107/S010827010001091X","","","0.71073","MoKα","","0.1569","0.0505","","","","0.1405","","","","","","0.991","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011528","5.317","0.0011","16.642","0.003","19.998","0.004","90","","90","","90","","1769.5","0.6","193","2","193","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C19 H22 O2 S2 -","- C19 H22 O2 S2 -","- C76 H88 O8 S8 -","4","1","OS1121","Kansikas, Jarno; Sipilä, Kaija","(1<i>S</i>,2<i>R</i>,2'<i>S</i>)- and (1<i>S</i>,2<i>S</i>,2'<i>S</i>)-1-phenyl-2-phenylthio-2-(tetrahydropyran-2'-ylthio)ethanol diastereoisomers at 193K","Acta Crystallographica Section C","2000","56","11","1383","1385","10.1107/S0108270100011161","","","0.71073","MoKα","","0.047","0.0405","","","","0.105","","","","","","1.03","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011529","16.699","0.003","18.507","0.004","5.615","0.0011","90","","90","","90","","1735.3","0.6","193","2","193","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C19 H22 O2 S2 -","- C19 H22 O2 S2 -","- C76 H88 O8 S8 -","4","1","OS1121","Kansikas, Jarno; Sipilä, Kaija","(1<i>S</i>,2<i>R</i>,2'<i>S</i>)- and (1<i>S</i>,2<i>S</i>,2'<i>S</i>)-1-phenyl-2-phenylthio-2-(tetrahydropyran-2'-ylthio)ethanol diastereoisomers at 193K","Acta Crystallographica Section C","2000","56","11","1383","1385","10.1107/S0108270100011161","","","0.71073","MoKα","","0.0357","0.032","","","","0.083","","","","","","1.027","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011530","8.304","0.001","12.044","0.002","11.082","0.002","90","","92.47","0.01","90","","1107.3","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tetraaqua(5-fluoro-uracil-1-acetato-O)-copper (II) tetrahydrate","","- C12 H24 Cu F2 N4 O16 -","- C12 H24 Cu F2 N4 O16 -","- C24 H48 Cu2 F4 N8 O32 -","2","0.5","QA0320","Huang, Jian; Li, Yi-Zhi; Sun, Gang-Chun; Dai, Rong-Bin; Li, Qin-Xi; Wang, Liu-Fang; Xia, Chun-Gu","Tetraaqua(5-fluorouracil-1-acetato-<i>O</i>)copper(II) tetrahydrate","Acta Crystallographica Section C","2000","56","11","e489","e490","10.1107/S0108270100013044","","","0.71073","MoKα","","0.021","0.02","","","","0.056","","","","","","1.029","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011531","8.2186","0.0005","25.4368","0.0016","15.6604","0.001","90","","90","","90","","3273.9","0.4","93","2","93","2","","","","","","","","3","P n m a","-P 2ac 2n","62","Bert*Cl","","","- C36 H49 Cl -","- C36 H49 Cl -","- C144 H196 Cl4 -","4","0.5","QA0383","Twamley, Brendan; Ned J. Hardman; Philip P. Power","A terphenyl halide series: 2,6-Trip~2~H~3~C~6~<i>X</i> (Trip = 2,4,6-triisopropylphenyl; <i>X</i> = Cl, Br, I)","Acta Crystallographica Section C","2000","56","11","e514","e515","10.1107/S0108270100013020","","","0.71073","MoKα","","0.093","0.047","","","","0.128","","","","","","0.912","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011532","8.2823","0.0014","25.831","0.004","15.856","0.003","90","","90","","90","","3392.2","1","293","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","Bert*Br","","","- C36 H49 Br -","- C36 H49 Br -","- C144 H196 Br4 -","4","0.5","QA0383","Twamley, Brendan; Ned J. Hardman; Philip P. Power","A terphenyl halide series: 2,6-Trip~2~H~3~C~6~<i>X</i> (Trip = 2,4,6-triisopropylphenyl; <i>X</i> = Cl, Br, I)","Acta Crystallographica Section C","2000","56","11","e514","e515","10.1107/S0108270100013020","","","0.71073","MoKα","","0.059","0.044","","","","0.114","","","","","","1.023","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011533","8.11","0.0013","25.549","0.006","15.978","0.006","90","","90","","90","","3310.7","1.6","130","2","130","2","","","","","","","","3","P n m a","-P 2ac 2n","62","Bert*I","","","- C36 H49 I -","- C36 H49 I -","- C144 H196 I4 -","4","0.5","QA0383","Twamley, Brendan; Ned J. Hardman; Philip P. Power","A terphenyl halide series: 2,6-Trip~2~H~3~C~6~<i>X</i> (Trip = 2,4,6-triisopropylphenyl; <i>X</i> = Cl, Br, I)","Acta Crystallographica Section C","2000","56","11","e514","e515","10.1107/S0108270100013020","","","0.71073","MoKα","","0.074","0.059","","","","0.186","","","","","","1.044","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011534","12.193","0.006","14.439","0.008","16.531","0.009","65.93","0.02","86.36","0.03","71.46","0.03","2512","2","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C100 H58 Au6 Cl4 F30 P6 -","- C100 H58 Au6 Cl4 F30 P6 -","- C100 H58 Au6 Cl4 F30 P6 -","1","0.5","QA0390","Bardají, Manuel; Laguna, Antonio; Villacampa, M. Dolores","Bis[bis(diphenylphosphinomethyl)phenylphosphine]dichlorotetragold(I) bis[chlorotris(pentafluorophenyl)aurate(III)]","Acta Crystallographica Section C","2000","56","11","e487","e488","10.1107/S0108270100012518","","","0.71073","MoKα","","0.086","0.049","","","","0.104","","","","","","0.977","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011535","21.443","0.002","7.959","0.001","10.224","0.002","90","","90","","90","","1744.9","0.4","293","2","293","2","","","","","","","","6","P n a 21","P 2c -2n","33","","3α-Tosyloxymethyltropane(N^8^—B)‒borane","","- C16 H26 B N O3 S -","- C16 H26 B N O3 S -","- C64 H104 B4 N4 O12 S4 -","4","1","QA0392","Batsanov, Andrei S.; Howard, Judith A. K.; O'Hagan, David; Tavasli, Mustafa","3α-Tosyloxymethyltropane(<i>N</i>^8^‒<i>B</i>)borane","Acta Crystallographica Section C","2000","56","11","e512","e513","10.1107/S0108270100013019","","","1.54178","CuKα","","0.066","0.043","","0.115","","0.103","","","1.045","","","1.091","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011536","10.987","0.0016","6.033","0.0008","15.429","0.003","90","","103.989","0.006","90","","992.4","0.3","150","2","150","2","","","","","","","","3","P 1 21 1","P 2yb","4","Ternifoline C","ent-Kaur-16-ene-1,6,7,15-tetrol-7,20-epoxy-1-acetate","","- C22 H32 O6 -","- C22 H32 O6 -","- C44 H64 O12 -","2","1","QA0393","Cox, Philip J.; Meng, Yanhui; Sarker, Satyajit D.; Deng, Qinying; Xu, Guo","Redetermination of ternifoline-C at 150K","Acta Crystallographica Section C","2000","56","11","e516","e517","10.1107/S0108270100013032","","","0.71073","MoKα","","0.111","0.059","","","","0.143","","","","","","0.967","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011537","5.45","0.0011","9.741","0.0019","12.307","0.003","80.27","0.03","85.97","0.03","79.13","0.03","631.9","0.2","173","1","173","1","","","","","","","","5","P -1","-P 1","2","1-octanoyl-5-fluorouracil","5-fluoro-1-octanoylpyrimidine-2,4(1H,3H)-dione","","- C12 H17 F N2 O3 -","- C12 H17 F N2 O3 -","- C24 H34 F2 N4 O6 -","2","1","QA0395","Lehmler, Hans-Joachim; Parkin, Sean","5-Fluoro-1-octanoyluracil","Acta Crystallographica Section C","2000","56","11","e518","e519","10.1107/S0108270100013056","","","0.71073","MoKα","","0.072","0.041","","","","0.1","","","","","","1.046","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011538","11.542","0.004","11.246","0.005","15.641","0.005","90","","105.43","0.03","90","","1957","1.3","294","2","294","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C18 H28 N2 Se2 -","- C18 H28 N2 Se2 -","- C72 H112 N8 Se8 -","4","1","QA0396","Feldmann, Arnold A.; Schmengler, Kai; Laue, Klaus; Marose, Stefan; Kirschbaum, Kristin; Conrad, Olaf; Giolando, Dean M.","Hydrogen bonding in <i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylethylenediammonium bis(benzeneselenolate)","Acta Crystallographica Section C","2000","56","11","e531","e531","10.1107/S0108270100013986","","","0.71073","MoKα","","0.067","0.035","","","","0.085","","","","","","1.006","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011539","11.505","0.002","5.298","0.001","16.886","0.002","90","","94.057","0.009","90","","1026.7","0.3","298","1","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 H22 N2 O6 -","- C22 H21.684 N2 O6 -","- C44 H43.368 N4 O12 -","2","0.5","QA0399","Hosomi, Hiroyuki; Ohba, Shigeru; Ito, Yoshikatsu","Fumaric acid‒<i>trans</i>-cinnamamide(1/2)","Acta Crystallographica Section C","2000","56","11","e507","e508","10.1107/S0108270100013007","","","0.71073","MoKα","","","0.038","","","","0.107","","","","","","1.06","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2011540","11.547","0.002","5.354","0.002","16.82","0.002","90","","94.6","0.01","90","","1036.5","0.4","298","1","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 H22 N2 O6 -","- C22 H21.408 N2 O6 -","- C44 H42.816 N4 O12 -","2","0.5","QA0399","Hosomi, Hiroyuki; Ohba, Shigeru; Ito, Yoshikatsu","Fumaric acid‒<i>trans</i>-cinnamamide(1/2)","Acta Crystallographica Section C","2000","56","11","e507","e508","10.1107/S0108270100013007","","","0.71073","MoKα","","","0.071","","","","0.175","","","","","","1.17","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2011541","9.6821","0.0007","18.4661","0.0012","7.4203","0.0005","93.611","0.005","105.676","0.005","100.636","0.005","1246.43","0.15","298","1","","","","","","","","","","5","P -1","-P 1","2","","","","- C26 H22 Cl2 N2 O6 -","- C26 H22 Cl2 N2 O6 -","- C52 H44 Cl4 N4 O12 -","2","1","QA0400","Hosomi, Hiroyuki; Ohba, Shigeru; Ito, Yoshikatsu","4,5-Dichlorophthalic acid‒<i>trans</i>-cinnamamide(1/2) and 3,4,5,6-tetrachlorophthalic acid‒<i>trans</i>-cinnamamide(1/2)","Acta Crystallographica Section C","2000","56","11","e509","e510","10.1107/S010827010001338X","","","0.71073","MoKα","","","0.047","","","","0.198","","","","","","1.28","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011542","9.937","0.002","15.895","0.004","9.015","0.002","93.48","0.02","110.57","0.01","91.58","0.02","1328.8","0.5","298","1","","","","","","","","","","5","P -1","-P 1","2","","","","- C26 H20 Cl4 N2 O6 -","- C26 H20 Cl4 N2 O6 -","- C52 H40 Cl8 N4 O12 -","2","1","QA0400","Hosomi, Hiroyuki; Ohba, Shigeru; Ito, Yoshikatsu","4,5-Dichlorophthalic acid‒<i>trans</i>-cinnamamide(1/2) and 3,4,5,6-tetrachlorophthalic acid‒<i>trans</i>-cinnamamide(1/2)","Acta Crystallographica Section C","2000","56","11","e509","e510","10.1107/S010827010001338X","","","0.71073","MoKα","","","0.038","","","","0.113","","","","","","1.06","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011544","10.1696","0.0009","6.9695","0.0007","21.526","0.002","90","","92.036","0.005","90","","1524.7","0.2","150","1","150","1","","","","","","","","5","P 1 21 1","P 2yb","4","","Methyl 2-methyl-6-methylthio-1,3-dioxo-4-[(2,3,4,6-tetra-O-acetyl-β-D- glucopyranosyl)amino]-2,3-dihydro-1H-pyrrolo[3,4-c]pyridine-7-carboxylate","","- C25 H29 N3 O13 S -","- C25 H29 N3 O13 S -","- C50 H58 N6 O26 S2 -","2","1","QA0402","Low, John Nicolson; Garcia, Celeste; Melguizo, Manuel; Cobo, Justo; Sánchez, Adolfo; Nogueras, Manuel; López, M. D.","Methyl 2-methyl-6-methylthio-1,3-dioxo-4-[(2,3,4,6-tetra-<i>O</i>-acetyl-β-<small>D</small>-glucopyranosyl)amino]-2,3-dihydro-1<i>H</i>-pyrrolo[3,4-<i>c</i>]pyridine-7-carboxylate","Acta Crystallographica Section C","2000","56","11","e526","e527","10.1107/S0108270100013512","","","0.71073","MoKα","","0.124","0.068","","","","0.16","","","","","","0.965","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2011545","7.163","0.002","39.861","0.009","10.053","0.003","90","","107.4","0.02","90","","2739","1.3","298","1","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C28 H24 N2 O10 -","- C28 H24 N2 O10 -","- C112 H96 N8 O40 -","4","0.5","QA0404","Hosomi, Hiroyuki; Ohba, Shigeru; Ito, Yoshikatsu","Benzene-1,2,4,5-tetracarboxylic acid‒<i>trans</i>-cinnamamide(1/2)","Acta Crystallographica Section C","2000","56","11","e511","e511","10.1107/S0108270100013391","","","0.71073","MoKα","","","0.06","","","","0.158","","","","","","0.95","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2011546","7.8564","0.0007","17.4629","0.0016","9.7865","0.0016","90","","92.132","0.009","90","","1341.7","0.3","294","1","294","1","","","","","","","","6","P 1 21 1","P 2yb","4","","cis-μ-Chloro-μ-p-toluenethiolato-bis[chloro(triethylphosphine)palladium]","","- C19 H37 Cl3 P2 Pd2 S -","- C19 H37 Cl3 P2 Pd2 S -","- C38 H74 Cl6 P4 Pd4 S2 -","2","1","QA0405","Alyea, Elmer C.; Kannan, Shanmugaperumal; Ferguson, George","<i>cis</i>-μ-Chloro-μ-<i>p</i>-toluenethiolato-bis[chloro(triethylphosphine)palladium]","Acta Crystallographica Section C","2000","56","11","e493","e494","10.1107/S0108270100013408","","","0.71073","MoKα","","0.062","0.038","","","","0.068","","","","","","0.975","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011547","11.575","0.003","4.3655","0.0006","15.647","0.004","90","","97.94","0.03","90","","783.1","0.3","180","2","180","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Trimethylphenol","","- C9 H12 O -","- C9 H12 O -","- C36 H48 O4 -","4","1","QA0407","Ziemer, Burkhard; Surygina, Oxana","2,4,6-Trimethylphenol","Acta Crystallographica Section C","2000","56","11","e528","e528","10.1107/S0108270100013524","","","0.71073","MoKα","","0.055","0.039","","","","0.108","","","","","","0.995","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011548","6.1103","0.0002","20.699","0.001","11.7877","0.0005","90","","95.302","0.003","90","","1484.5","0.11","293","2","293","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","Bis(2-(4-pyridyl)-4,4,5,5- tetramethylimidazoline-1-oxyl)Zinc(II) dithiocyanate.","","- C26 H32 N8 O2 S2 Zn -","- C26 H32 N8 O2 S2 Zn -","- C52 H64 N16 O4 S4 Zn2 -","2","0.5","QA0408","Fettouhi, Mohammed","Dithiocyanatobis[4,4,5,5-tetramethyl-2-(4-pyridyl-κ<i>N</i>)-1<i>H</i>-imidazoline-1-oxyl]zinc(II)","Acta Crystallographica Section C","2000","56","11","e495","e496","10.1107/S010827010001341X","","","0.71073","MoKα","","0.075","0.043","","","","0.117","","","","","","1.018","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011549","9.7626","0.0006","12.428","0.0008","16.677","0.0007","90","","90","","90","","2023.4","0.2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C23 H23 N3 O2 -","- C23 H23 N3 O2 -","- C92 H92 N12 O8 -","4","1","QA0412","Roh, Soo-Gyun; Jeong, Jong Hwa","1,3,5-Tri-<i>p</i>-tolylbiuret","Acta Crystallographica Section C","2000","56","11","e529","e530","10.1107/S0108270100013536","","","0.71073","MoKα","","0.067","0.033","","","","0.095","","","","","","0.985","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011550","9.636","0.002","11.237","0.002","16.242","0.003","90","","94.49","0.01","90","","1753.3","0.6","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H44 Br2 N6 Si -","- C32 H44 Br2 N6 Si -","- C64 H88 Br4 N12 Si2 -","2","0.5","QA0413","Bolte, Michael; Hensen, Karl; Faber, Alexander","Tetrakis(3,5-dimethylpyridine)dihydridosilicon dibromide bis(acetonitrile) solvate and 3,5-dimethylpyridinium bromide","Acta Crystallographica Section C","2000","56","11","e524","e525","10.1107/S0108270100013470","","","0.71073","MoKα","","0.076","0.054","","","","0.121","","","","","","1.109","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011551","7.504","0.002","8.144","0.003","8.522","0.003","117.8","0.01","113.43","0.01","93.01","0.01","404.1","0.2","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C7 H10 Br N -","- C7 H10 Br N -","- C14 H20 Br2 N2 -","2","1","QA0413","Bolte, Michael; Hensen, Karl; Faber, Alexander","Tetrakis(3,5-dimethylpyridine)dihydridosilicon dibromide bis(acetonitrile) solvate and 3,5-dimethylpyridinium bromide","Acta Crystallographica Section C","2000","56","11","e524","e525","10.1107/S0108270100013470","","","0.71073","MoKα","","0.059","0.045","","","","0.097","","","","","","1.097","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011552","7.154","0.002","7.933","0.002","13.731","0.003","90","","90","","90","","779.3","0.3","173","2","173","2","","","","","","","","5","P m n a","-P 2ac 2","53","","","","- C12 H14 Cl4 Ge N2 -","- C12 H14 Cl4 Ge N2 -","- C24 H28 Cl8 Ge2 N4 -","2","0.25","QA0414","Bolte, Michael; Hensen, Karl; Faber, Alexander","<i>trans</i>-Tetrachlorobis(4-methylpyridine)germanium(IV)","Acta Crystallographica Section C","2000","56","11","e497","e498","10.1107/S0108270100013482","","","0.71073","MoKα","","0.034","0.026","","","","0.062","","","","","","1.064","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2011553","7.36","0.001","8.36","0.001","13.561","0.001","90","","90","","90","","834.4","0.16","173","2","173","2","","","","","","","","5","P m n a","-P 2ac 2","53","","","","- C12 H14 Br4 Ge N2 -","- C12 H14 Br4 Ge N2 -","- C24 H28 Br8 Ge2 N4 -","2","0.25","QA0420","Bolte, Michael; Hensen, Karl; Faber, Alexander","Complexes of germanium bromides with 4-picoline and 3,4-lutidine","Acta Crystallographica Section C","2000","56","11","e499","e500","10.1107/S0108270100014153","","","0.71073","MoKα","","0.047","0.028","","","","0.056","","","","","","1.075","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2011554","7.477","0.001","17.942","0.005","13.194","0.003","90","","90","","90","","1770","0.7","173","2","173","2","","","","","","","","5","C m c a","-C 2ac 2","64","","","","- C14 H18 Br4 Ge N2 -","- C14 H18 Br4 Ge N2 -","- C56 H72 Br16 Ge4 N8 -","4","","QA0420","Bolte, Michael; Hensen, Karl; Faber, Alexander","Complexes of germanium bromides with 4-picoline and 3,4-lutidine","Acta Crystallographica Section C","2000","56","11","e499","e500","10.1107/S0108270100014153","","","0.71073","MoKα","","0.055","0.036","","","","0.077","","","","","","1.07","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011555","16.588","0.0014","8.3559","0.0007","23.4129","0.0018","90","","104.564","0.004","90","","3140.9","0.4","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C8 H28 As6 N4 O26 Zn7 -","- C8 H28 As6 N4 O26 Zn7 -","- C32 H112 As24 N16 O104 Zn28 -","4","0.5","QA0423","Kongshaug, Kjell Ove; Fjellvåg, Helmer; Lillerud, Karl Petter","A three-dimensional open-framework zinc arsenate, (C~4~H~12~N~2~)~2~[Zn~7~(AsO~4~)~6~(H~2~O)~2~]","Acta Crystallographica Section C","2000","56","11","e503","e504","10.1107/S0108270100013548","","","0.71073","MoKα","","0.056","0.032","","","","0.065","","","","","","0.947","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011556","11.265","0.002","19.946","0.004","10.927","0.002","90","","103.65","0.03","90","","2385.9","0.8","167","2","167","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H27 N3 Si3 -","- C18 H27 N3 Si3 -","- C72 H108 N12 Si12 -","4","1","QA0427","Kouvetakis, John; Groy, Thomas L.","2,4,6-Tris[2-(trimethylsilyl)ethynyl]-1,3,5-triazene: a novel precursor to C‒N two-dimensional structures","Acta Crystallographica Section C","2000","56","11","e533","e533","10.1107/S0108270100014165","","","0.71073","MoKα","","0.106","0.06","","","","0.158","","","","","","1.066","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011557","17.4851","0.0007","17.4851","0.0006","16.2878","0.0009","90","","90","","90","","4979.6","0.4","150","2","150","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","2-Amino-6-chloro-4-(1-phenylethylamino)pyrimidine","","- C12 H13 Cl N4 -","- C12 H13 Cl N4 -","- C192 H208 Cl16 N64 -","16","1","QA0429","Lynch, Daniel E.; McClenaghan, Ian","2-Amino-6-chloro-4-(1-phenylethylamino)pyrimidine","Acta Crystallographica Section C","2000","56","11","e534","e534","10.1107/S0108270100014177","","","0.71073","MoKα","","0.09","0.051","","","","0.134","","","","","","1.012","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011558","9.9036","0.0002","19.9452","0.0004","13.666","0.0003","90","","133.561","0.001","90","","1956.12","0.08","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Anilino-3-nitropyridine","","- C11 H9 N3 O2 -","- C11 H9 N3 O2 -","- C88 H72 N24 O16 -","8","2","QA0430","Lynch, Daniel E.; McClenaghan, Ian","4-Anilino-3-nitropyridine","Acta Crystallographica Section C","2000","56","11","e535","e535","10.1107/S0108270100014189","","","0.71073","MoKα","","0.066","0.044","","","","0.12","","","","","","1.037","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011559","13.6482","0.0002","14.1294","0.0002","14.1343","0.0002","119.958","0.0007","95.9391","0.0006","92.8349","0.0007","2332.6","0.06","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","4,6-Dichloro-2-methylthiopyrimidine","","- C5 H4 Cl2 N2 S -","- C5 H4 Cl2 N2 S -","- C60 H48 Cl24 N24 S12 -","12","6","QA0431","Lynch, Daniel E.; McClenaghan, Ian","4,6-Dichloro-2-(methylthio)pyrimidine","Acta Crystallographica Section C","2000","56","11","e536","e536","10.1107/S0108270100014190","","","0.71073","MoKα","","0.058","0.037","","","","0.099","","","","","","1.042","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011560","5.0386","0.0001","10.3948","0.0002","12.7421","0.0003","67.2038","0.0012","84.4066","0.001","81.2678","0.0012","607.56","0.02","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","2-Chloro-3-(4-morpholino)-1,4-naphthoquinone","","- C14 H12 Cl N O3 -","- C14 H12 Cl N O3 -","- C28 H24 Cl2 N2 O6 -","2","1","QA0432","Lynch, Daniel E.; McClenaghan, Ian","2-Chloro-3-morpholino-1,4-naphthoquinone","Acta Crystallographica Section C","2000","56","11","e537","e537","10.1107/S0108270100014207","","","0.71073","MoKα","","0.044","0.039","","","","0.142","","","","","","1.16","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011561","10.642","0.003","11.719","0.002","10.977","0.003","90","","108.04","0.02","90","","1301.7","0.6","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","1a,2a-Epoxy-24(R)-acyloxycholesta-4,6-dien-3-one hydrate","","- C29 H44 O5 -","- C29 H44 O5 -","- C58 H88 O10 -","2","1","QB9203","Rajalakshmi, K.; Pattabhi, Vasantha; Venkatesan, C. S.; Nadamuni, G.; Srikrishna, A.","24(<i>R</i>)-Acetyloxy-1α,2α-epoxycholesta-4,6-dien-3-one hydrate. Erratum","Acta Crystallographica Section C","2000","56","11","e538","e538","10.1107/S0108270100012993","","","1.5418","CuKα","","0.072","0.056","","","","0.162","","","","","","1.123","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011562","9.495","0.0011","8.4241","0.001","10.0938","0.0012","90","","95.876","0.002","90","","803.13","0.16","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","meso-2,2'-Diphenyl-3,3',4,4'-tetrahydro-2,2'-bifuran-5,5'(2H,2'H)-dione","","- C20 H18 O4 -","- C20 H18 O4 -","- C40 H36 O8 -","2","0.5","QD0025","Billing, David G.; Holzapfel, Cedric W.; Blann, Kevin; Williams, D. Bradley G.","<i>meso</i>-2,2'-Diphenyl-3,3',4,4'-tetrahydro-2,2'-bifuran-5,5'(2<i>H</i>,2'<i>H</i>)-dione","Acta Crystallographica Section C","2000","56","11","e522","e523","10.1107/S0108270100013081","","","0.71073","MoKα","","0.067","0.046","","","","0.144","","","","","","1.013","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011563","12.9459","0.0009","13.1082","0.0009","13.9889","0.0009","90","","90.3","0.002","90","","2373.8","0.3","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","tris(benzohydroxamato)iron(III) trihydrate","","","- C21 H24 Fe N3 O9 -","- C21 H24 Fe N3 O9 -","- C84 H96 Fe4 N12 O36 -","4","1","QD0034","Marmion, Celine J.; Murphy, Terry; Starikova, Zoya; Nolan, Kevin B.","Redetermination of <i>fac</i>-tris(benzohydroxamato)iron(III) trihydrate","Acta Crystallographica Section C","2000","56","11","e491","e492","10.1107/S010827010001307X","","","0.71073","MoKα","","0.107","0.041","","","","0.072","","","","","","0.73","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011564","6.507","0.001","7.448","0.002","7.735","0.002","109.25","0.04","95.11","0.04","109.52","0.05","325.1","0.2","180","2","","","","","","","","","","5","P -1","-P 1","2","","","","- C6 H22 Cu N4 O8 -","- C6 H22 Cu N4 O8 -","- C6 H22 Cu N4 O8 -","1","0.5","QD0038","Chapman, James; Pickett, Nigel L.; Kolawole, Gabriel; Motevalli, Majid; O'Brien, Paul","<i>trans</i>-Bis[2,3-diamino-(<i>R</i>,<i>S</i>)-propionato-<i>N</i>,<i>N</i>']diaquacopper(II) dihydrate","Acta Crystallographica Section C","2000","56","11","e501","e502","10.1107/S0108270100013500","","","0.71073","MoKα","","","0.039","","","","0.106","","","","","","1.054","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011565","7.933","0.007","9.328","0.006","12.814","0.009","90","","91.76","0.04","90","","947.8","1.2","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","1,3,5-Trichloro-2,4-dinitrobenzene","1,3,5-Trichloro-2,4-dinitrobenzene","","- C6 H Cl3 N2 O4 -","- C6 H Cl3 N2 O4 -","- C24 H4 Cl12 N8 O16 -","4","1","QD0039","Kruger, Paul E.; Mackie, Philip R.; Nieuwenhuyzen, Mark","Redetermination of 1,3,5-trichloro-2,4-dinitrobenzene","Acta Crystallographica Section C","2000","56","11","e532","e532","10.1107/S0108270100013998","","","0.71073","MoKα","","0.082","0.054","","","","0.154","","","","","","0.889","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011566","8.849","0.0018","9.206","0.0013","9.8438","0.0019","63.196","0.014","76.908","0.015","73.937","0.013","683","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","N-(4-Methylphenyl)-N-2-propynyl-N-5-nitro-2-furfurylamine","","- C15 H14 N2 O3 -","- C15 H14 N2 O3 -","- C30 H28 N4 O6 -","2","1","","Hergold-Brundić, Antonija; Pavlović, Gordana; Mance, Ana Dunja; Jakopčić, Krešimir","N-(4-Methylphenyl)-N-(5-nitrofurfuryl)-N-prop-2-ynylamine","Acta Crystallographica, Section C: Crystal Structure Communications","2000","56","11","e520","e521","10.1107/s0108270100013068","","","0.71073","MoKα","","0.078","0.039","","","","0.101","","","","","","0.973","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011567","16.0495","0.0011","10.524","0.0013","15.6324","0.0012","90","","104.232","0.002","90","","2559.4","0.4","295","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H26 Cl2 N2 O2 Zn -","- C28 H26 Cl2 N2 O2 Zn -","- C112 H104 Cl8 N8 O8 Zn4 -","4","0.5","SK1401","Ülkü, Dinçer; Arıcı, Cengiz; Tahir, M. Nawaz; Atakol, Orhan","Dichlorobis[2-(<i>o</i>-tolyliminiomethyl)phenolato-<i>O</i>]zinc(II)","Acta Crystallographica Section C","2000","56","11","1298","1299","10.1107/S0108270100009008","","","0.71073","MoKα","","","0.028","","","","0.037","","","","","","1.04","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011568","11.682","0.002","38.168","0.006","14.245","0.002","90","","112.63","0.01","90","","5862.5","1.6","297","2","297","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tris(2,6-di-tert-butyl-4-methylphenoxo-) (triphenylphosphine oxide) samarium","","- C63 H84 O4 P Sm -","- C63 H84 O4 P Sm -","- C252 H336 O16 P4 Sm4 -","4","1","SK1411","Yao, Yingming; Shen, Qi; Yu, Kaibei","Tris(2,6-di-<i>tert</i>-butyl-4-methylphenolato-<i>O</i>)(triphenylphosphine oxide-<i>O</i>)samarium(III)","Acta Crystallographica Section C","2000","56","11","1330","1331","10.1107/S0108270100010192","","","0.71073","MoKα","","0.064","0.033","","0.084","","0.057","","","0.847","","","0.972","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011569","5.926","0.002","9.489","0.003","13.452","0.005","90","","90","","90","","756.4","0.4","173","2","173","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","bicyclo[2.2.1]hept-2-ene-endo-cis-5,6-dicarboxylic anhydride","","- C9 H8 O3 -","- C9 H8 O3 -","- C36 H32 O12 -","4","1","SK1412","Bolte, Michael; Degen, Alexander; Egert, Ernst","Diels‒Alder adducts of maleic anhydride and dienes: new compounds by crystallization","Acta Crystallographica Section C","2000","56","11","1338","1342","10.1107/S0108270100010131","","","0.71073","MoKα","","0.043","0.041","","","","0.11","","","","","","1.138","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011570","29.639","0.004","29.639","0.004","8.119","0.002","90","","90","","120","","6176.8","1.9","173","2","173","2","","","","","","","","4","R -3 :H","-R 3","148","","1,2,3,4,7,7-hexachlorobicyclo[2.2.1]hept-2-ene-endo-cis-5,6-dicarboxylic anhydride diethyl ether solvate","","- C9.64 H3.6 Cl6 O3.16 -","- C9.66333 H3.65 Cl6 O3.17 -","- C173.94 H65.7 Cl108 O57.06 -","18","1","SK1412","Bolte, Michael; Degen, Alexander; Egert, Ernst","Diels‒Alder adducts of maleic anhydride and dienes: new compounds by crystallization","Acta Crystallographica Section C","2000","56","11","1338","1342","10.1107/S0108270100010131","","","0.71073","MoKα","","0.046","0.032","","","","0.078","","","","","","1.06","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2011571","10.999","0.002","7.389","0.001","10.41","0.002","90","","98.75","0.03","90","","836.2","0.3","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","bicyclo[2.2.1]hept-2-ene-endo-cis-5,6-dicarboxylic acid","","- C9 H10 O4 -","- C9 H10 O4 -","- C36 H40 O16 -","4","1","SK1412","Bolte, Michael; Degen, Alexander; Egert, Ernst","Diels‒Alder adducts of maleic anhydride and dienes: new compounds by crystallization","Acta Crystallographica Section C","2000","56","11","1338","1342","10.1107/S0108270100010131","","","0.71073","MoKα","","0.079","0.059","","","","0.152","","","","","","1.095","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011572","7.499","0.001","7.924","0.002","11.873","0.002","90","","101.65","0.01","90","","691","0.2","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","1,2,3,4,7,7-hexachlorobicyclo[2.2.1]hept-2-ene-endo-cis-5,6-dicarboxylic acid","","- C9 H4 Cl6 O4 -","- C9 H4 Cl6 O4 -","- C18 H8 Cl12 O8 -","2","1","SK1412","Bolte, Michael; Degen, Alexander; Egert, Ernst","Diels‒Alder adducts of maleic anhydride and dienes: new compounds by crystallization","Acta Crystallographica Section C","2000","56","11","1338","1342","10.1107/S0108270100010131","","","0.71073","MoKα","","0.02","0.019","","","","0.048","","","","","","1.044","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011573","8.443","0.001","24.809","0.001","13.594","0.001","90","","90.38","0.01","90","","2847.4","0.4","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,2,3,4,7,7-hexachlorobicyclo[2.2.1]hept-2-ene-endo-cis-5,6-dicarboxylic acid","","- C9 H4 Cl6 O4 -","- C9 H4 Cl6 O4 -","- C72 H32 Cl48 O32 -","8","2","SK1412","Bolte, Michael; Degen, Alexander; Egert, Ernst","Diels‒Alder adducts of maleic anhydride and dienes: new compounds by crystallization","Acta Crystallographica Section C","2000","56","11","1338","1342","10.1107/S0108270100010131","","","0.71073","MoKα","","0.03","0.026","","","","0.061","","","","","","1.142","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011574","8.616","0.003","9.281","0.002","10.46","0.004","100.53","0.02","94","0.02","95.06","0.02","816","0.5","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","ethyl 1,2,3,4,7,7-hexachloro-6-carboxybicyclo[2.2.1]hept-2-ene-endo-cis-5-carboxylate monohydrate","","- C11 H10 Cl6 O5 -","- C11 H10 Cl6 O5 -","- C22 H20 Cl12 O10 -","2","1","SK1412","Bolte, Michael; Degen, Alexander; Egert, Ernst","Diels‒Alder adducts of maleic anhydride and dienes: new compounds by crystallization","Acta Crystallographica Section C","2000","56","11","1338","1342","10.1107/S0108270100010131","","","0.71073","MoKα","","0.123","0.056","","","","0.136","","","","","","1.003","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2011575","8.9463","0.0001","21.7605","0.0001","19.0038","0.0002","90","","100.69","0.001","90","","3635.38","0.06","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C42 H30 N4 Ni S4 -","- C42 H30 N4 Ni S4 -","- C168 H120 N16 Ni4 S16 -","4","1","","Shanmuga Sundara Raj, S.; Fun, Hoong-Kun; Wu, Ji; Tian, Yu-Peng; Xie, Fu-Xin; Shao, Ze-Huai; Li, Sheng-Li","Intra- and intermolecular C—H...π interactions in bis[benzyl 3-(fluoren-9-ylidene)dithiocarbazato-N^3^,S]nickel(II)","Acta Crystallographica, Section C: Crystal Structure Communications","2000","56","11","1321","1322","10.1107/s0108270100011628","","","0.71073","MoKα","","0.082","0.064","","","","0.111","","","","","","0.964","","","","has coordinates","218380","2020-10-21","18:00:00",""
"2011577","10.9465","0.0011","18.972","0.002","11.0469","0.0012","90","","110.643","0.002","90","","2146.9","0.4","160","2","160","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Tris(1,3-di-t-butyl-propane-1,3-dionato)(4-dimethylaminopyridine)terbium(III)","","- C40 H67 N2 O6 Tb -","- C40 H67 N2 O6 Tb -","- C80 H134 N4 O12 Tb2 -","2","1","SK1415","Clegg, William; Sage, Ian; Oswald, Iain; Brough, Peter; Bourhill, Grant; e-mail: bgourhill@dera.gov.uk","Two isostructural triboluminescent lanthanide complexes","Acta Crystallographica Section C","2000","56","11","1323","1325","10.1107/S0108270100011641","","","0.71073","MoKα","","0.031","0.029","","","","0.054","","","","","","1.186","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011578","10.9846","0.0005","18.9758","0.0008","11.0865","0.0005","90","","110.833","0.002","90","","2159.8","0.17","160","2","160","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Tris(1,3-di-t-butyl-propane-1,3-dionato)(4-dimethylaminopyridine)samarium(III)","","- C40 H67 N2 O6 Sm -","- C40 H67 N2 O6 Sm -","- C80 H134 N4 O12 Sm2 -","2","1","SK1415","Clegg, William; Sage, Ian; Oswald, Iain; Brough, Peter; Bourhill, Grant","Two isostructural triboluminescent lanthanide complexes","Acta Crystallographica Section C","2000","56","11","1323","1325","10.1107/S0108270100011641","","","0.71073","MoKα","","0.037","0.026","","","","0.047","","","","","","0.938","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011579","14.937","0.003","9.316","0.005","18.262","0.002","90","","98.877","0.012","90","","2510.8","1.5","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","4,17,20-trimethoxy-2,15-dioxapentacyclo[26.2.2.1^3,7^.0^16,21^]triaconta- 1(28),3,5,7(29),10,12,14(30),16,18,20,24927),25-dodecaene","","- C31 H30 O5 -","- C31 H30 O5 -","- C124 H120 O20 -","4","1","SX1103","Mombrú, Alvaro W.; Suescun, Leopoldo; Pandolfi, Enrique; Seoane, Gustavo; López, Gloria; Mariezcurrena, Raúl","Marchantin M trimethyl ether","Acta Crystallographica Section C","2000","56","11","1374","1376","10.1107/S0108270100011173","","","0.71069","MoKα","","0.1593","0.0544","","","","0.1933","","","","","","0.983","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011580","17.0481","0.0004","17.0481","0.0004","13.7568","0.0003","90","","90","","90","","3998.24","0.16","123","2","123","2","","","","","","","","5","I -4","I -4","82","Tetraphenylphosphonium perchlorate","Tetraphenylphosphonium perchlorate","","- C24 H20 Cl O4 P -","- C24 H20 Cl O4 P -","- C192 H160 Cl8 O32 P8 -","8","1","TA1294","Batten, Stuart R.; Harris, Alexander R.; Murray, Keith S.","Phase change in tetraphenylphosphonium perchlorate","Acta Crystallographica Section C","2000","56","11","1394","1395","10.1107/S0108270100011562","","","0.71073","MoKα","","0.0495","0.0381","","","","0.1037","","","","","","1.052","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011581","10.306","0.003","12.953","0.004","28.826","0.009","90","","90","","90","","3848","2","163","2","163","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C36 H44 I2 O6 P2 -","- C36 H44 I2 O6 P2 -","- C144 H176 I8 O24 P8 -","4","1","TA1297","Gainsford, Graeme J.; Lensink, Cornelis; Hart, Joanne B.; Falshaw, Andrew","1<small>D</small>-3,4-Di-<i>O</i>-(diphenylmethylphosphonio)-1,2,5,6-tetra-<i>O</i>-methyl-<i>chiro</i>-inositol diiodide","Acta Crystallographica Section C","2000","56","11","1396","1398","10.1107/S0108270100011574","","","0.71073","MoKα","","0.0271","0.0225","","","","0.0513","","","","","","1.045","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011582","8.43","0.001","10.305","0.003","12.38","0.002","89.9","0.02","82.31","0.01","68.62","0.01","991.2","0.4","293","","293","","","","","","","","","6","P -1","-P 1","2","","","","- C38 H56 Cu N2 P2 S4 -","- C38 H54 Cu N2 P2 S4 -","- C38 H54 Cu N2 P2 S4 -","1","0.5","TA1299","Horn, E.; Kurosawa, K.; Tiekink, E. R. T.","Bis[<i>N</i>-phenyl(dicyclohexylthiophosphinoyl)thiomethanamido-<i>S</i>,<i>S</i>']copper(II)","Acta Crystallographica Section C","2000","56","11","1319","1320","10.1107/S0108270100011586","","","0.71073","MoKα","","","0.044","","","","0.031","","","","","","1.75","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2011583","12.499","0.002","13.173","0.002","14.615","0.003","85.16","0.02","79.05","0.02","66.15","0.02","2160.7","0.7","293","","293","","","","","","","","","7","P -1","-P 1","2","","","","- C50 H39 Cu N2 O2 P2 S2 -","- C50 H39 Cu N2 O2 P2 S2 -","- C100 H78 Cu2 N4 O4 P4 S4 -","2","1","TA1301","Nakahodo, T.; Horn, E.; Tiekink, E.R.T.","(Benzoxazole-2-thiolato-<i>S</i>)(benzoxazole-2-thione-<i>S</i>)bis(triphenylphosphine)copper(I)","Acta Crystallographica Section C","2000","56","11","1316","1318","10.1107/S0108270100011483","","","0.71073","MoKα","","","0.038","","","","0.026","","","","","","1.99","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2011584","7.62","0.002","10.411","0.002","26.813","0.005","90","","97.92","0.02","90","","2106.8","0.8","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Pyrazolo[3,4-d]pyrimidine","1-[4,6-dimethylthio-2H-pyrazolo[3,4-d]pyrimidin-2-yl]-4,6-dimethylthio-1H- pyrazolo[3,4-d]pyrimidine","","- C17 H20 N8 S4 -","- C17 H20 N8 S4 -","- C68 H80 N32 S16 -","4","1","VJ1110","Maulik, Prakas R.; Avasthi, Kamlakar; Sarkhel, Sanjay; Chandra, Tilak; Rawat, Diwan S.; Logsdon, Brad; Jacobson, Robert A.","Disappearance of intramolecular stacking due to one-atom movement or increment of a `propylene linker' in pyrazolo[3,4-<i>d</i>]pyrimidine-based flexible models","Acta Crystallographica Section C","2000","56","11","1361","1363","10.1107/S0108270100010775","","","0.71073","MoKα","","0.0656","0.0519","","0.1688","","0.1424","","","0.836","","","0.804","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011585","31.736","0.007","8.308","0.002","17.467","0.004","90","","115.12","0.02","90","","4169.8","1.8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Pyrazolo[3,4-d]pyrimidine","1-[4-(4-methoxy-6-methylthio-1H-pyrazolo[3,4-d]pyrimidin-1-yl)butyl]- 5-methyl-6-methylthio-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-4-one","","- C18 H22 N8 O2 S2 -","- C18 H22 N8 O2 S2 -","- C144 H176 N64 O16 S16 -","8","1","VJ1110","Maulik, Prakas R.; Avasthi, Kamlakar; Sarkhel, Sanjay; Chandra, Tilak; Rawat, Diwan S.; Logsdon, Brad; Jacobson, Robert A.","Disappearance of intramolecular stacking due to one-atom movement or increment of a `propylene linker' in pyrazolo[3,4-<i>d</i>]pyrimidine-based flexible models","Acta Crystallographica Section C","2000","56","11","1361","1363","10.1107/S0108270100010775","","","0.71073","MoKα","","0.046","0.041","","","","0.121","","","","","","1.054","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011586","7.6042","0.0008","9.0007","0.0011","10.8647","0.0016","97.974","0.019","98.5","0.02","108.63","0.02","683.06","0.19","293","2","293","2","","","","","","","","5","P -1","-P 1","2","2,2'-bipyridinium diperchlorate","2,2'-bipyridinium diperchlorate","","- C10 H10 Cl2 N2 O8 -","- C10 H10 Cl2 N2 O8 -","- C20 H20 Cl4 N4 O16 -","2","1","AV1046","Ma, Guibin; Ilyukhin, Andrey; Glaser, Julius","2,2'-Bipyridinium bis(perchlorate)","Acta Crystallographica Section C","2000","56","12","1473","1475","10.1107/S0108270100012452","","","0.71073","MoKα","","0.086","0.048","","","","0.148","","","","","","1.014","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011587","11.824","0.002","17.573","0.002","11.96","0.002","90","","110.24","0.01","90","","2331.6","0.6","292","2","292","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,2-Diphenyl-2-(phenyldiazenyl)-2-tosylethanone","","- C27 H22 N2 O3 S -","- C27 H22 N2 O3 S -","- C108 H88 N8 O12 S4 -","4","1","AV1053","Wolf, Wojciech M.","1,2-Diphenyl-2-(phenyldiazenyl)-2-tosylethanone, an example of a fungicide containing a sulfonyl group","Acta Crystallographica Section C","2000","56","12","1444","1446","10.1107/S0108270100011537","","","1.54178","CuKα","","0.0564","0.0418","","","","0.1329","","","","","","1.034","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011588","12.2978","0.0002","10.9183","0.0002","30.59","0.0005","90","","90","","90","","4107.35","0.12","150","2","150","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C9 H20 B10 Co2 O5 S2 -","- C9 H20 B10 Co2 O5 S2 -","- C72 H160 B80 Co16 O40 S16 -","8","1","BJ1001","Londesborough, Michael G.S.; Bould, Jonathan; Holub, Josef; Kennedy, John D.; Thornton-Pett, Mark; Štíbr, Bohumil","[1,1,2,2-(CO)~4~-1,2-μ-(CO)-4,11-(SMe~2~)~2~-<i>closo</i>-1,2-Co~2~B~10~H~8~]","Acta Crystallographica Section C","2000","56","12","1423","1424","10.1107/S0108270100012282","","","0.71073","MoKα","","0.0517","0.0316","","","","0.0613","","","","","","1.026","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011589","17.94","0.003","8.9381","0.0008","19.8691","0.0016","90","","96.121","0.01","90","","3167.8","0.7","186","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H36 Cr N10 O8 Pr -","- C18 H36 Cr N10 O8 Pr -","- C72 H144 Cr4 N40 O32 Pr4 -","4","1","BJ1006","Combs, Robert A.; Farmer, J. Matt; Kautz, Jason A.","A cyanide-bridged bimetallic complex, [CrPr(CN)~6~(C~3~H~7~NO)~4~(H~2~O)~3~]·H~2~O","Acta Crystallographica Section C","2000","56","12","1420","1422","10.1107/S010827010001204X","","","0.71073","MoKα","","0.0306","0.0266","","","","0.0706","","","","","","1.097","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011590","5.4017","0.0005","8.3903","0.0007","4.6325","0.0004","102.237","0.007","93.676","0.008","104.154","0.006","197.46","0.03","293","2","293","2","","","","","","","","5","P 1","P 1","1","","Diaquabis[3,7-dihydro-1H-purine-2,6-dione]lithium(I)","","- C5 H7 Li N4 O4 -","- C5 H7 Li N4 O4 -","- C5 H7 Li N4 O4 -","1","1","BK1536","Okabe, Nobuo; Tsujita, Michihiro","<i>catena</i>-Poly[[diaqualithium(I)]-μ-[9<i>H</i>-purine-2,6(1<i>H</i>,3<i>H</i>)-dionato-<i>O</i>^2^:<i>N</i>^7^]]","Acta Crystallographica Section C","2000","56","12","1418","1419","10.1107/S0108270100011999","","","0.71073","MoKα","","0.055","0.032","","","","0.096","","","","","","0.868","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2011591","9.166","0.003","14.603","0.003","12.192","0.003","90","","97.43","0.02","90","","1618.2","0.7","296","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(μ-pyridine-2,6-carboxylato-N,O,O':O)bis[triaquamanganese(II)]‒ pyridine-2,6-dicarboxylic acid (1/2)","","- C28 H28 Mn2 N4 O22 -","- C28 H28 Mn2 N4 O22 -","- C56 H56 Mn4 N8 O44 -","2","0.5","BK1553","Okabe, Nobuo; Oya, Naomi","Bis(μ-pyridine-2,6-carboxylato-<i>O</i>,<i>N</i>,<i>O</i>':<i>O</i>)bis[triaquamanganese(II)]‒pyridine-2,6-dicarboxylic acid (1/2)","Acta Crystallographica Section C","2000","56","12","1416","1417","10.1107/S0108270100012786","","","0.71069","MoKα","","","0.037","","","","0.122","","","","","","1.101","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011592","16.591","0.002","8.8487","0.0007","30.996","0.009","90","0.016","90","0.012","90","0.009","4550.5","1.5","295","2","295","2","","","","","","","","3","P n a 21","P 2c -2n","33","","","","- C32 H22 O4 -","- C32 H22 O4 -","- C256 H176 O32 -","8","2","BK1564","Potenza, Joseph A.; Emge, Thomas J.; Albaneze, Jennifer; Knapp, Spencer; Schugar, Harvey J.","A spiro-linked pyrene‒naphthoquinone","Acta Crystallographica Section C","2000","56","12","1494","1495","10.1107/S0108270100012750","","","1.5418","CuKα","","0.1253","0.0441","","","","0.0847","","","","","","0.99","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011593","11.9913","0.0002","19.8605","0.0003","25.1833","0.0003","90","","100.024","0.0009","90","","5905.93","0.15","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis{2,6-bis[3-(2,4,6-trimethylphenyl)pyrazol-1-yl-N^2^]pyridine-N}zinc(II) diperchlorate bis(nitromethane) solvate","","- C60 H64 Cl2 N12 O12 Zn -","- C60 H64 Cl2 N12 O12 Zn -","- C240 H256 Cl8 N48 O48 Zn4 -","4","1","BM1431","Malcolm A. Halcrow; Colin A. Kilner; Mark Thornton-Pett","Bis{2,6-bis[3-(2,4,6-trimethylphenyl)pyrazol-1-yl-κ<i>N</i>^2^]pyridine-κ<i>N</i>}zinc(II) diperchlorate bis(nitromethane) solvate","Acta Crystallographica Section C","2000","56","12","1425","1426","10.1107/S0108270100012981","","","0.71073","MoKα","","0.086","0.048","","","","0.136","","","","","","1.039","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011594","9.038","0.002","19.13","0.004","9.93","0.002","90","","108.79","0.02","90","","1625.4","0.6","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C34 H28 Au2 Cl2 Fe P2 -","- C34 H28 Au2 Cl2 Fe P2 -","- C68 H56 Au4 Cl4 Fe2 P4 -","2","0.5","BM1433","Crespo, Olga; Gimeno, M. Concepcion; Jones, Peter G.; Laguna, Antonio","Solvent-free [μ-ferrocene-1,1'-diylbis(diphenylphosphine-<i>P</i>)]bis[chlorogold(I)]","Acta Crystallographica Section C","2000","56","12","1433","1434","10.1107/S010827010001310X","","","0.71073","MoKα","","0.056","0.033","","","","0.0712","","","","","","0.899","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011595","7.748","0.002","14.164","0.003","6.268","0.002","91.54","0.02","95.3","0.02","88.25","0.02","684.4","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Triammonium cis-diaqua-cis-dioxo-trans-disulfatovanadate hemitrihydrate","","- H19 N3 O13.5 S2 V -","- H19 N3 O13.5 S2 V -","- H38 N6 O27 S4 V2 -","2","1","BR1299","Hashimoto, Masato; Kubata, Michiru; Yagasaki, Atsushi","(NH~4~)~3~[VO~2~(SO~4~)~2~(H~2~O)~2~]·1.5H~2~O","Acta Crystallographica Section C","2000","56","12","1411","1412","10.1107/S0108270100012063","","","0.71069","MoKα","","0.0427","0.0319","","","","0.1003","","","","","","1.053","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2011596","8.4915","0.0012","11.1454","0.0013","12.6558","0.0013","90","","90","","90","","1197.8","0.3","293","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- B4 K Li O7 -","- B4 K Li O7 -","- B32 K8 Li8 O56 -","8","2","BR1301","Ono, Yasuhiro; Nakaya, Michiko; Kajitani, Tsuyoshi; Sugawara, Tamotsu; Watanabe, Noriko; Shiraishi, Hiroyuki; Komatsu, Ryuichi","Lithium potassium borate and lithium rubidium borate: new non-linear optical crystals","Acta Crystallographica Section C","2000","56","12","1413","1415","10.1107/S0108270100013445","","","0.71073","MoKα","","","0.0244","","","","0.0553","","","","","","1.123","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011597","8.6257","0.0012","11.2576","0.0013","12.8531","0.0015","90","","90","","90","","1248.1","0.3","293","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- B4 Li O7 Rb -","- B4 Li O7 Rb -","- B32 Li8 O56 Rb8 -","8","2","BR1301","Ono, Yasuhiro; Nakaya, Michiko; Kajitani, Tsuyoshi; Sugawara, Tamotsu; Watanabe, Noriko; Shiraishi, Hiroyuki; Komatsu, Ryuichi","Lithium potassium borate and lithium rubidium borate: new non-linear optical crystals","Acta Crystallographica Section C","2000","56","12","1413","1415","10.1107/S0108270100013445","","","0.71073","MoKα","","","0.05","","","","0.0754","","","","","","1.198","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011598","11.665","0.003","10.614","0.002","11.121","0.004","90","","117.8","0.02","90","","1218","0.6","100","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(2-nitrobenzenesulfonyl)-2-amino isobutyric acid","","- C10 H12 N2 O6 S -","- C10 H12 N2 O6 S -","- C40 H48 N8 O24 S4 -","4","1","DA1155","Hammarström, Lars G. J.; Zhang, Tao; Giraldés, José; McLaughlin, Mark L.; Billodeaux, Damon R.; Fronczek, Frank R.","Two <i>N</i>-<i>ortho</i>-nitrobenzenesulfonyl α,α-disubstituted amino acid adducts","Acta Crystallographica Section C","2000","56","12","1484","1486","10.1107/S0108270100012464","","","0.71073","MoKα","","","0.042","","","","0.109","","","","","","1.031","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011599","15.978","0.0012","14.984","0.0011","13.436","0.001","90","","113.568","0.006","90","","2948.4","0.4","100","","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(2-nitrobenzenesulfonyl)-1-amino-1-cyclohexane carboxylic acid","","- C13 H16 N2 O6 S -","- C13 H16 N2 O6 S -","- C104 H128 N16 O48 S8 -","8","2","DA1155","Hammarström, Lars G. J.; Zhang, Tao; Giraldés, José; McLaughlin, Mark L.; Billodeaux, Damon R.; Fronczek, Frank R.","Two <i>N</i>-<i>ortho</i>-nitrobenzenesulfonyl α,α-disubstituted amino acid adducts","Acta Crystallographica Section C","2000","56","12","1484","1486","10.1107/S0108270100012464","","","0.71073","MoKα","","0.072","0.043","","","","0.116","","","","","","1.093","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011600","12.225","0.005","15.052","0.005","14.135","0.005","90","","91.797","0.005","90","","2599.7","1.6","168","2","168","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","tetra-μ-acetato-O:O'-bis{[μ-1,4-bis(2-pyridyloxy)phenylene-N,C^2^:N',C^6^] dipalladium(II)} bis(trichloromethane) dihydrate","","- C42 H38 Cl6 N4 O14 Pd4 -","- C42 H34 Cl6 N4 O14 Pd4 -","- C84 H68 Cl12 N8 O28 Pd8 -","2","0.5","DE1153","O'Keefe, Brendan J.; Steel, Peter J.","Cyclometallated compounds. XV. A tetranuclear acetate-bridged cyclopalladated molecular box","Acta Crystallographica Section C","2000","56","12","1440","1441","10.1107/S0108270100011768","","","0.71073","MoKα","","0.095","0.05","","","","0.134","","","","","","1.028","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2011601","10.856","0.003","25.323","0.008","14.795","0.007","90","","94.68","0.03","90","","4054","3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","cis-Tetracarbonyl[bis(tricyclohexylphosphine)]molybdenum(0)","","- C40 H66 Mo O4 P2 -","- C40 H66 Mo O4 P2 -","- C160 H264 Mo4 O16 P8 -","4","1","FR1291","Cortes-Figueroa, Jose E.; Leon-Velazquez, Madeline S.; Ramos, Johanna; Jasinski, Jerry P.; Keene, David A.; Zubkowski, Jeffrey D.; Valente, Edward J.","<i>cis</i>-Tetracarbonylbis(tricyclohexylphosphine)molybdenum(0) and pentacarbonyl(tricyclohexylphosphine)molybdenum(0)","Acta Crystallographica Section C","2000","56","12","1435","1437","10.1107/S0108270100013111","","","0.71073","MoKα","","0.127","0.055","","","","0.08","","","","","","0.931","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011602","11.785","0.003","16.76","0.007","12.779","0.004","90","","92.15","0.02","90","","2522.3","1.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","pentacarbonyl(tricyclohexylphosphine)molybdenum(0)","","- C23 H33 Mo O5 P -","- C23 H33 Mo O5 P -","- C92 H132 Mo4 O20 P4 -","4","1","FR1291","Cortes-Figueroa, Jose E.; Leon-Velazquez, Madeline S.; Ramos, Johanna; Jasinski, Jerry P.; Keene, David A.; Zubkowski, Jeffrey D.; Valente, Edward J.","<i>cis</i>-Tetracarbonylbis(tricyclohexylphosphine)molybdenum(0) and pentacarbonyl(tricyclohexylphosphine)molybdenum(0)","Acta Crystallographica Section C","2000","56","12","1435","1437","10.1107/S0108270100013111","","","0.71073","MoKα","","0.074","0.045","","","","0.091","","","","","","0.901","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2011603","8.767","0.002","12.228","0.002","8.6","0.003","94.12","0.02","90.07","0.03","105.44","0.01","886.2","0.4","293","","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C17 H24 N2 O6 -","- C17 H24 N2 O6 -","- C34 H48 N4 O12 -","2","1","FR1294","Smith, Graham; Bott, Raymond C.; Wermuth, Urs D.","The 1:1 adduct of Kemp's triacid with 2-aminopyridine","Acta Crystallographica Section C","2000","56","12","1505","1506","10.1107/S0108270100012968","","","0.7107","MoKα","","0.115","0.049","","","","0.168","","","","","","1.024","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011604","18.6901","0.0019","10.031","0.002","17.781","0.002","90","","109.91","0.008","90","","3134.3","0.8","296","","296","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Cis,cis,cis-Tetramethyl 1,2,4,5-cyclohexanetetracarboxylate","","- C14 H20 O8 -","- C14 H20 O8 -","- C112 H160 O64 -","8","1","FR1298","Robinson, Paul D.; Hua, Duy H.; Fan, Jingmei; Liu, Lanzhu; McGill, James W.; Arshid, Mohammed; Meyers, Cal Y.","<i>cis</i>,<i>cis</i>,<i>cis</i>-Tetramethyl 1,2,4,5-cyclohexanetetracarboxylate","Acta Crystallographica Section C","2000","56","12","1471","1472","10.1107/S0108270100013123","","","0.71069","MoKα","","0.184","0.04","","","","0.128","","","","","","0.958","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011605","9.73","0.001","10.661","0.002","17.898","0.003","90","","90","","90","","1856.6","0.5","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","(+)-Gibberellin C","(+)-2β,4aα-dihydroxy-1,7-dimethyl-8-oxo-4bβ,7α-gibbane-1α,10β- dicarboxylic acid-1,4a-lactone","","- C19 H26 O7 -","- C19 H26 O7 -","- C76 H104 O28 -","4","1","FR1300","Thompson, Hugh W.; Brunskill, Andrew P. J.; Lalancette, Roger A.","(+)-Gibberellin C: hydrogen-bonding pattern of the monohydrate of a non-racemic pentacyclic diterpenoid","Acta Crystallographica Section C","2000","56","12","1507","1509","10.1107/S0108270100013135","","","0.71073","MoKα","","0.117","0.053","","","","0.108","","","","","","1.02","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011606","6.0507","0.0005","9.657","0.0009","15.4541","0.0014","82.093","0.008","78.738","0.006","75.898","0.005","855.08","0.13","123","1","123","1","","","","","","","","4","P -1","-P 1","2","","2,2,4,4-Tetramethyl-1,5-diphenyl-6,7,8-trioxa-3-thiabicyclo[3.2.1]octane","","- C20 H22 O3 S -","- C20 H22 O3 S -","- C40 H44 O6 S2 -","2","1","FR1303","Cuthbertson, Eric; Frampton, Christopher S.; MacNicol, David D.","2,2,4,4-Tetramethyl-1,5-diphenyl-6,7,8-trioxa-3-thiabicyclo[3.2.1]octane","Acta Crystallographica Section C","2000","56","12","1510","1511","10.1107/S0108270100013147","","","0.71073","MoKα","","0.04","0.033","","","","0.097","","","","","","1.017","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011607","13.908","0.002","15.3513","0.0018","7.186","0.0006","90","","90","","90","","1534.3","0.3","296","","296","","","","","","","","","3","C m c 21","C 2c -2","36","","sp-9-methyl-9-pivaloylfluorene","","- C19 H20 O -","- C19 H20 O -","- C76 H80 O4 -","4","0.5","GD1104","Meyers, Cal Y.; Lutfi, Hisham G.; Varol, Pninit; Hou, Yuqing; Robinson, Paul D.","The surprising <i>sp</i> rotameric structure of 9-methyl-9-pivaloylfluorene","Acta Crystallographica Section C","2000","56","12","1468","1470","10.1107/S010827010001235X","","","0.71069","MoKα","","0.072","0.043","","","","0.138","","","","","","1.024","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011609","12.8258","0.0002","15.1039","0.0001","14.7734","0.0002","90","","114.228","0.001","90","","2609.82","0.06","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[Zn^2+^]~2~[μ-{11,23-dimethyl-3,7,15,19-tetraazatricyclo[19.3.1.1^9,13^] hexacosa-1(25),2,7,9,11,13(26),14,19,21,23-decaene-25,26-diolato-N^3^, N^7^,O^25^,O^26^:N^15^,N^19^,O^25^,O^26^}]^2-^ 2[ClO~4~]^-^, bis(8-methylquinoline), 2(C~2~H~5~OH)","","- C48 H60 Cl2 N6 O14 Zn2 -","- C48 H60 Cl2 N6 O14 Zn2 -","- C96 H120 Cl4 N12 O28 Zn4 -","2","0.5","GG1016","Fang, Jiang-Lin; Huang, Wei; Chantrapromma, Suchada; Shanmuga Sundara Raj, S.; Razak, Ibrahim Abdul; Fun, Hoong-Kun; Gou, Shao-Hua; Wang, Hong-Sen","A donor‒acceptor compound composed of a dinuclear zinc(II) complex of a Robson macrocycle with 8-methylquinoline","Acta Crystallographica Section C","2000","56","12","1429","1430","10.1107/S0108270100012373","","","0.71073","MoKα","","0.073","0.044","","","","0.115","","","","","","0.94","","","","has coordinates,has disorder","176760","2020-10-21","18:00:00",""
"2011610","18.526","0.004","6.96","0.0015","12.759","0.003","90","","109.512","0.016","90","","1550.7","0.6","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Amino-5-chloro-1,3-benzoxazol-3-ium 2-[(3,4-dichlorophenyl)oxy]acetate","","- C15 H11 Cl3 N2 O4 -","- C15 H11 Cl3 N2 O4 -","- C60 H44 Cl12 N8 O16 -","4","1","GG1018","Lynch, Daniel E.; Daly, David; Parsons, Simon","2-Amino-5-chloro-1,3-benzoxazol-3-ium 2-(3,4-dichlorophenoxy)acetate","Acta Crystallographica Section C","2000","56","12","1478","1479","10.1107/S0108270100012385","","","1.5418","CuKα","","0.05","0.042","","","","0.115","","","","","","1.06","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011611","8.018","0.008","20.134","0.013","7.389","0.008","90","","90","","90","","1192.8","1.9","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","4'-Thio-α-thymidine(R)-S-oxide","","- C10 H14 N2 O5 S -","- C10 H13.604 N2 O5 S -","- C40 H54.416 N8 O20 S4 -","4","1","GS1102","Sun, Ming; Macculloch, Alasdair C.; Hamor, Thomas A.; Walker, Richard T.","5-Methyl-2'-deoxy-4'-thio-α-uridine (<i>R</i>)-<i>S</i>-oxide","Acta Crystallographica Section C","2000","56","12","1492","1493","10.1107/S0108270100012798","","","0.71073","MoKa","","0.0302","0.0299","","","0.0821","0.0822","","","","1.095","1.095","1.094","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011612","5.116","0.0001","13.008","0.0002","15.189","0.0001","90","","96.853","0.001","90","","1003.59","0.03","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Tetraaquabis(3,5-dicarboxybenzoate-O)cobalt(II)","","- C18 H18 Co O16 -","- C18 H18 Co O16 -","- C36 H36 Co2 O32 -","2","0.5","GS1105","Guillou, Nathalie; Livage, Carine; Marrot, Jerôme; Férey, Gerard","Tetraaquabis(3,5-dicarboxybenzoato-<i>O</i>)cobalt(II)","Acta Crystallographica Section C","2000","56","12","1427","1428","10.1107/S0108270100012312","","","0.71073","MoKα","","0.03","0.025","","","","0.073","","","","","","1.09","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011613","9.665","0.0005","19.662","0.0009","11.123","0.002","90","","89.602","0.005","90","","2113.7","0.4","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","Piv-L-Sip-L-Ala-NH^i^Pr","N-(3,3-dimethyl-1-pivaloyl-1-aza-3-sila-5-cyclopentylcarbonyl)-L-alanine isopropylamide","","- C17 H33 N3 O3 Si -","- C17 H33 N3 O3 Si -","- C68 H132 N12 O12 Si4 -","4","2","GS1107","Vivet, Bertrand; Cavelier, Florine; Martinez, Jean; Didierjean, Claude; Marraud, Michel; Aubry, Andre","A silaproline-containing dipeptide","Acta Crystallographica Section C","2000","56","12","1452","1454","10.1107/S0108270100012294","","","0.7107","MoKα","","0.069","0.055","","","","0.143","","","","","","1.072","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011614","5.6004","0.0002","11.8172","0.0005","17.865","0.007","90","","98.71","0.16","90","","1168.7","0.7","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-Hydroxyphenyl 2-methylpyrazolo[1,5-a]pyrimidin-6-yl ketone","","- C14 H11 N3 O2 -","- C14 H11 N3 O2 -","- C56 H44 N12 O8 -","4","1","GS1109","Quiroga, Jairo; Insuasty, Braulio; Abonia, Rodrigo; Mejía, Diana; Nogueras, Manuel; Sánchez, Adolfo; Cobo, Justo; Low, John Nicolson","2-Hydroxyphenyl 2-methylpyrazolo[1,5-<i>a</i>]pyrimidin-6-yl ketone","Acta Crystallographica Section C","2000","56","12","1455","1456","10.1107/S0108270100012324","","","0.71073","MoKα","","0.093","0.052","","","","0.144","","","","","","1.014","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011615","7.4978","0.0015","11.265","0.002","12.322","0.003","108.12","0.03","99.38","0.03","94.75","0.03","966","0.4","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","2,4-bis(2-hydroxybenzoyl)-2,3-dihydro-1H-pyrido[2,1-b][1,3]benzothiazole","","- C25 H19 N O4 S -","- C25 H19 N O4 S -","- C50 H38 N2 O8 S2 -","2","1","GS1110","Quiroga, Jairo; Insuasty, Braulio; Abonia, Rodrigo; Hernández, Pedro; Cobo, Justo; Nogueras, Manuel; Sánchez, Adolfo; Low, John Nicolson","Weak and strong hydrogen-bonding patterns in the structure of 2,4-bis(2-hydroxybenzoyl)-2,3-dihydro-1<i>H</i>-pyrido[2,1-<i>b</i>][1,3]benzothiazole","Acta Crystallographica Section C","2000","56","12","1460","1461","10.1107/S0108270100012397","","","0.71073","MoKα","","0.0557","0.0411","","","","0.1107","","","","","","1.049","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011616","12.513","0.0003","9.4275","0.0003","10.6441","0.0003","90","","90","","90","","1255.65","0.06","150","2","150","2","","","","","","","","4","P n a 21","P 2c -2n","33","","5,5-dimethyl-3-(5-methyl-1H-pyrazol-3-ylamino)cyclohex-3-en-1-one","","- C12 H17 N3 O -","- C12 H17 N3 O -","- C48 H68 N12 O4 -","4","1","GS1111","Quiroga, Jairo; Insuasty, Braulio; Abonia, Rodrigo; Mejía, Diana; Cobo, Justo; Nogueras, Manuel; Sanchez, Adolfo; Low, John Nicolson","5,5-Dimethyl-3-(5-methyl-1<i>H</i>-pyrazol-3-ylamino)cyclohex-3-en-1-one","Acta Crystallographica Section C","2000","56","12","1457","1459","10.1107/S0108270100012300","","","0.71073","MoKα","","0.057","0.048","","","","0.122","","","","","","1.053","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2011617","5.025","0.0003","7.0977","0.0003","10.1196","0.0005","70.826","0.003","81.868","0.003","81.163","0.003","335.25","0.03","153","2","153","2","","","","","","","","4","P -1","-P 1","2","2,3-Pyrazinedicarboxamide","Pyrazine-2,3-dicarboxamide","","- C6 H6 N4 O2 -","- C6 H6 N4 O2 -","- C12 H12 N8 O4 -","2","1","JZ1424","Vishweshwar, Peddy; Nangia, Ashwini; Lynch, Vincent M.","Pyrazine-2,3-dicarboxamide","Acta Crystallographica Section C","2000","56","12","1512","1514","10.1107/S0108270100013421","","","0.71073","MoKα","","0.037","0.035","","","","0.101","","","","","","1.058","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011618","8.5877","0.0007","9.7161","0.0017","11.1425","0.001","113.138","0.008","97.516","0.004","98.551","0.007","826.92","0.19","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","bis(μ ~2~-hydroxo)bis(diipropylgallium). 1,4,8,11-tetramethyl-1,4,8,11-tetraazacyclotetradecane","","- C26 H62 Ga2 N4 O2 -","- C26 H62 Ga2 N4 O2 -","- C26 H62 Ga2 N4 O2 -","1","0.5","JZ1426","Boag, Neil M.; Coward, Kathleen M.; Jones, Anthony C.; Pemble, Martyn E.; Thompson, J. Robin","Di-μ-hydroxo-bis(diisopropylgallium)‒1,4,8,11-tetramethyl-1,4,8,11-tetraazacyclotetradecane (1/1)","Acta Crystallographica Section C","2000","56","12","1438","1439","10.1107/S0108270100012816","","","0.71073","MoKα","","0.0319","0.0263","","0.0654","","0.0654","","","1.036","","","1.036","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011619","5.0955","0.0003","13.2155","0.0007","20.167","0.0011","90","","90","","90","","1358.04","0.13","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","L-Phenylalanyl-L-valine","","- C14 H20 N2 O3 -","- C14 H20 N2 O3 -","- C56 H80 N8 O12 -","4","1","JZ1429","Görbitz, Carl Henrik","An NH~3~^+^···phenyl interaction in <small>L</small>-phenylalanyl-<small>L</small>-valine","Acta Crystallographica Section C","2000","56","12","1496","1498","10.1107/S0108270100012762","","","0.71073","MoKα","","0.03","0.0277","","","","0.0703","","","","","","1.056","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011620","10.53","0.004","11.873","0.003","8.798","0.004","90.76","0.04","113.31","0.04","112.05","0.02","919.2","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","p-Toluenesulfon-(2-p-tolylthio)anilide","4-methyl-N-[2-(p-tolylsulfanyl)phenyl]benzenesulfonamide","","- C20 H19 N O2 S2 -","- C20 H19 N O2 S2 -","- C40 H38 N2 O4 S4 -","2","1","OA1105","Banerjee, Surajit; Mukherjee, Alok K.; Nandi, Bidisha; Kundu, Nitya G.; Helliwell, Madeleine","4-Methyl-<i>N</i>-[2-(<i>p</i>-tolylsulfanyl)phenyl]benzenesulfonamide","Acta Crystallographica Section C","2000","56","12","1490","1491","10.1107/S0108270100012725","","","1.5418","CuKα","","0.0645","0.0494","","","","0.1467","","","","","","1.031","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011621","11.331","0.003","10.183","0.002","9.962","0.002","90","","90","","90","","1149.5","0.4","296.2","","","","","","","","","","","3","I b a m","-I 2 2c","72","","","","- C14 H10 N4 -","- C14 H10 N4 -","- C56 H40 N16 -","4","0.25","QA0384","Sakamoto, Jun; Nakagawa, Takashi; Kanehisa, Nobuko; Kai, Yasushi; Katsura, Masahiro","1<i>H</i>,1'<i>H</i>-2,2'-Bibenzimidazole","Acta Crystallographica Section C","2000","56","12","e596","e597","10.1107/S0108270100014761","","","0.7107","MoKα","","","0.0425","","","","0.1274","","","","","","1.061","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011622","8.3083","0.0007","11.5075","0.0009","13.36","0.002","90","","96.034","0.009","90","","1270.2","0.2","225","2","225","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C6 H19 Cl2 N3 Ti -","- C6 H19 Cl2 N3 Ti -","- C24 H76 Cl8 N12 Ti4 -","4","1","QA0394","Kirschbaum, Kristin; Conrad, Olaf; Giolando, Dean M.","The pentacoordinate titanium complex [TiCl~2~(NMe~2~)~2~(HNMe~2~)]","Acta Crystallographica Section C","2000","56","12","e541","e541","10.1107/S0108270100014773","","","0.71073","MoKα","","0.048","0.03","","","","0.04","","","","","","1.294","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2011623","15.87","0.001","7.3481","0.0008","14.262","0.001","90","","102.032","0.005","90","","1626.6","0.2","298.2","","298.2","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","lansoprazole","2-({[3-methyl-4-(2,2,2-trifluroethoxy)-2-pyridinyl]methyl}- sulfinyl)-1H-benzimidazole","","- C16 H14 F3 N3 O2 S -","- C16 H14 F3 N3 O2 S -","- C64 H56 F12 N12 O8 S4 -","4","1","QA0397","Vyas, K.; Sivalakshmidevi, A.; Om Reddy, G.","Lansoprazole, an antiulcerative drug","Acta Crystallographica Section C","2000","56","12","e572","e573","10.1107/S0108270100014943","","","1.5418","CuKα","","0.049","0.047","","0.078","","0.077","","","1.916","","","1.939","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011624","11.735","0.001","9.775","0.001","20.695","0.002","90","","90","","90","","2373.9","0.4","150","2","150","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","1-(1,3-Dithian-2-yl)-2-phenylethanone","","- C12 H14 O S2 -","- C12 H14 O S2 -","- C96 H112 O8 S16 -","8","1","QA0403","Batsanov, Andrei S.; Howard, Judith A. K.; O'Hagan, David; Tavasli, Mustafa","1-(1,3-Dithian-2-yl)-2-phenylethanone","Acta Crystallographica Section C","2000","56","12","e567","e568","10.1107/S0108270100014785","","","0.71073","MoKα","","0.036","0.03","","","","0.08","","","","","","1.094","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011625","11.385","0.002","9.951","0.002","20.745","0.004","90","","92.72","0.03","90","","2347.6","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[Cd(phen)(tren)](NO~3~)~2~(H~2~O)","(1,10-phenanthroline)[tris(2-aminoethyl)amine]cadmium(II) dinitrate hydrate","","- C18 H28 Cd N8 O7 -","- C18 H28 Cd N8 O7 -","- C72 H112 Cd4 N32 O28 -","4","1","QA0409","Zhang, Hao; Cai, Jiwen; Yang, Guang; Xue, Gen-Qiang; Ji, Liang-Nian","A supramolecular cadmium(II) complex: (1,10-phenanthroline)[tris(2-aminoethyl)amine]cadmium(II) dinitrate hydrate","Acta Crystallographica Section C","2000","56","12","e562","e563","10.1107/S0108270100016279","","","0.71073","MoKα","","0.035","0.03","","","","0.087","","","","","","1.096","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2011626","8.854","0.001","12.122","0.001","17.708","0.002","90","","90","","90","","1900.6","0.3","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","eudesmane sesquiterpenoid","3β-angloyloxy-4αacetoxy-5αH-furanoeudesmane","","- C22 H30 O5 -","- C22 H30 O5 -","- C88 H120 O20 -","4","1","QA0410","Wang, Qiguang; Ma, Chunling; Zhai, Jianjun","Furanoeudesmane-B, a new eudesmane sesquiterpenoid from <i>Myoporum bontioides</i>","Acta Crystallographica Section C","2000","56","12","e569","e569","10.1107/S0108270100014797","","","0.71073","MoKα","","0.056","0.04","","0.039","","0.039","","","1.421","","","1.421","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011627","18.085","0.0006","6.067","0.0002","15.983","0.0006","90","","113.28","0.002","90","","1610.9","0.1","120","","120","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethyl 2-Benzyl-2-nitro-3-phenylpropanoate","","- C18 H19 N O4 -","- C18 H19 N O4 -","- C72 H76 N4 O16 -","4","1","QA0411","Miller, Tod J.; Fu, Yanwen; Fronczek, Frank R.; Hammer, Robert P.","Ethyl 2-benzyl-2-nitro-3-phenylpropanoate","Acta Crystallographica Section C","2000","56","12","e574","e575","10.1107/S0108270100014955","","","0.71073","MoKα","","0.064","0.039","","","","0.094","","","","","","1.037","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011628","6.559","0.0011","23.134","0.005","6.746","0.0012","90","","119.071","0.015","90","","894.7","0.3","293","2","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H26 N4 O12 -","- C10 H26 N4 O12 -","- C20 H52 N8 O24 -","2","0.5","QA0416","Bergstrom, Christina L.; Luck, Rudy L.; Luehrs, Dean C.","Tetraammonium benzene-1,2,4,5-tetracarboxylate tetrahydrate","Acta Crystallographica Section C","2000","56","12","e591","e591","10.1107/S0108270100015687","","","0.71069","MoKα","","","0.039","","","","0.104","","","","","","1.074","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011629","11.13","0.002","11.732","0.002","12.258","0.002","99.66","0.02","110.34","0.01","110.23","0.01","1330.6","0.5","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C46 H68 N6 Ni3 O16 -","- C46 H68 N6 Ni3 O16 -","- C46 H68 N6 Ni3 O16 -","1","0.5","QA0417","Martin, Cassandra J.; Hockless, David C. R.; Taylor, Max R.; Martin, Lisandra L.","Bis(di-μ-acetato-aqua{2-[<i>N</i>-ethyl-<i>N</i>-(2-hydroxy-4-methylbenzyl)aminomethyl]-1-methylbenzimidazole}nickel)nickel(II) tetrahydrate","Acta Crystallographica Section C","2000","56","12","e549","e549","10.1107/S0108270100014967","","","1.5418","CuKα","","0.099","0.058","","0.053","","0.047","","","1.927","","","1.75","","","","has coordinates","203508","2020-10-21","18:00:00",""
"2011630","4.5377","0.0002","6.9065","0.0002","12.3009","0.0005","90","","90.372","0.002","90","","385.5","0.03","200","0.1","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C8 H10 O3 -","- C8 H10 O3 -","- C16 H20 O6 -","2","1","QA0418","Harper, James K.; Arif, Atta M.; Li, J. Y.; Strobel, Gary; Grant, David M.","Terrein","Acta Crystallographica Section C","2000","56","12","e570","e571","10.1107/S0108270100014803","","","0.71073","MoKα","","","0.035","","","","0.09","","","","","","1.049","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011631","15.995","0.002","6.865","0.001","21.934","0.005","90","","94.16","0.02","90","","2402.1","0.7","213","2","213","2","","","","","","","","4","I 1 2 1","I 2y","5","","","","- C11 H13 N3 O4 -","- C11 H13 N3 O4 -","- C88 H104 N24 O32 -","8","2","QA0419","Swenson, Dale C.; Nair, Vasu; Bera, Sanjib","A dideoxydidehydronucleoside derivative","Acta Crystallographica Section C","2000","56","12","e600","e601","10.1107/S0108270100017005","","","0.71073","MoKα","","0.058","0.035","","","","0.098","","","","","","1.095","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011632","15.1607","0.0007","12.786","0.0009","23.316","0.001","90","","90","","90","","4519.7","0.4","293","2","293","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C30 H52 Cu2 F12 N10 O2 P2 -","- C30 H52 Cu2 F12 N10 O2 P2 -","- C120 H208 Cu8 F48 N40 O8 P8 -","4","0.5","QA0421","Kim, Jun Hwan; Roh, Soo-Gyun; Jeong, Jong Hwa","Di-μ-methoxo-bis({<i>N</i>,<i>N</i>'-bis[2-(3,5-dimethylpyrazol-1-yl)ethyl]amine-κ^3^<i>N</i>}copper(II)) bis(hexafluorophosphate)","Acta Crystallographica Section C","2000","56","12","e543","e544","10.1107/S0108270100014815","","","0.71073","MoKα","","0.149","0.069","","","","0.189","","","","","","1.38","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2011633","19.096","0.003","19.096","0.003","19.096","0.003","90","","90","","90","","6963.5","1.9","120","2","120","2","","","","","","","","6","P 21 3","P 2ac 2ab 3","198","","","","- C70 H77 Li O4 S9 Ti2 -","- C69.96 H76.92 Li O3.99 S9 Ti2 -","- C279.84 H307.68 Li4 O15.96 S36 Ti8 -","4","0.333333","QA0422","Puke, Carsten; Schmengler, Kai; Kirschbaum, Kristin; Conrad, Olaf; Giolando, Dean M.","The titanium‒thiolate complex [Li(C~4~H~8~O)~4~][Ti~2~(SC~6~H~5~)~9~]","Acta Crystallographica Section C","2000","56","12","e542","e542","10.1107/S0108270100014979","","","0.71073","MoKα","","0.0699","0.0462","","","","0.1269","","","","","","0.981","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2011634","7.5279","0.0003","10.4817","0.0004","24.7865","0.0011","90","","90","","90","","1955.78","0.14","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C9 H21 Br4 N O Sn2 -","- C9 H21 Br4 N O Sn2 -","- C36 H84 Br16 N4 O4 Sn8 -","4","1","QA0424","König, Uwe-Christoph; Berkei, Michael; Hirsch, Claudia; Preut, Hans; Mitchell, Terence Nigel","Bromodimethyl(<i>N</i>-methylpyrrolidin-2-one-<i>O</i>)tin(IV)-di-μ-bromo-bromodimethyltin(IV)","Acta Crystallographica Section C","2000","56","12","e550","e551","10.1107/S0108270100014980","","","0.71069","MoKα","","0.06","0.036","","","","0.065","","","","","","0.903","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011635","8.307","0.0005","8.9554","0.0004","14.3472","0.0008","80.407","0.003","84.441","0.002","63.194","0.002","939.02","0.09","100","","100","","","","","","","","","3","P -1","-P 1","2","decabromodiphenyl ether","1-(2,3,4,5,6-pentabromophenoxy)-2,3,4,5,6-pentabromobenzene","","- C12 Br10 O -","- C12 Br10 O -","- C24 Br20 O2 -","2","1","QA0425","Mrse, Anthony A.; Watkins, Steven F.; Fronczek, Frank R.","Rerefinement of decabromodiphenyl ether from new area-detector data","Acta Crystallographica Section C","2000","56","12","e576","e577","10.1107/S0108270100015699","","","0.71073","MoKα","","0.117","0.043","","","","0.085","","","","","","0.892","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011636","9.3674","0.0003","11.0111","0.0003","13.6724","0.0004","94.198","0.001","92.139","0.001","98.968","0.001","1387.57","0.07","293","2","293","2","","","","","","","","9","P -1","-P 1","2","","Chloro[eta^6^:eta^1^:eta^1^-{1-(3-(2-(diphenylphosphanyl)ethyl)benzyl) -3,5-dimethyl-1H-pyrazole}]ruthenium(II) trifluoromethanesulfonate","","- C27 H27 Cl F3 N2 O3 P Ru S -","- C27 H27 Cl F3 N2 O3 P Ru S -","- C54 H54 Cl2 F6 N4 O6 P2 Ru2 S2 -","2","1","QA0428","Therrien, Bruno; Ward, Thomas R.","Chloro(1-{3-[2-(diphenylphosphanyl-κ<i>P</i>)ethyl]-η^6^-benzyl}-3,5-dimethyl-1<i>H</i>-pyrazole-κ<i>N</i>^2^)ruthenium(II) trifluoromethanesulfonate","Acta Crystallographica Section C","2000","56","12","e561","e561","10.1107/S0108270100015705","","","0.71073","MoKα","","0.075","0.051","","","","0.12","","","","","","1.183","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011637","10.004","0.002","17.151","0.004","14.472","0.003","90","","101.06","0.02","90","","2437","0.9","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","tris-(2-benzoylamino-ethyl)amine","","- C27 H30 N4 O3 -","- C27 H30 N4 O3 -","- C108 H120 N16 O12 -","4","1","QA0433","Goldcamp, Michael J.; Krause Bauer, Jeanette A.; Baldwin, Michael J.","Tris[2-(benzoylamino)ethyl]amine","Acta Crystallographica Section C","2000","56","12","e602","e603","10.1107/S0108270100017017","","","0.71073","MoKα","","0.146","0.059","","","","0.165","","","","","","1.004","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011638","12.282","0.003","12.407","0.003","4.2191","0.0008","90","","95.55","0.03","90","","639.9","0.3","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C10 H8 Br2 N2 Pb -","- C10 H8 Br2 N2 Pb -","- C20 H16 Br4 N4 Pb2 -","2","0.25","QA0434","Cui, Yong; Ren, Jing; Chen, Gang; Yu, Weichao; Qian, Yitai","Poly[lead(II)-μ-4,4-bipyridine-<i>N</i>:<i>N</i>'-di-μ-bromo]","Acta Crystallographica Section C","2000","56","12","e552","e553","10.1107/S0108270100014992","","","0.71073","MoKα","","0.049","0.048","","","","0.128","","","","","","1.108","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011639","6.371","0.004","8.824","0.008","34.303","0.01","90","","90","","90","","1928","2","293","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C19 H28 N2 O4 -","- C19 H28 N2 O4 -","- C76 H112 N8 O16 -","4","1","QA0435","Fountoulaki, Fani; Renate Geßmann; Hans Brückner; Kokkinidis, Michael","The peptide (<i>Z</i>)-Pro‒Leuol","Acta Crystallographica Section C","2000","56","12","e578","e579","10.1107/S010827010001502X","","","1.5418","CuKα","","0.117","0.067","","0.093","","0.093","","","1.995","","","1.995","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011640","7.419","0.004","7.522","0.004","21.814","0.008","90","","90","","90","","1217.3","1","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","4-Acetyl-2,4-dihydro-5-methyl-2-phenyl-3H-pyrazole-3-one hydrate","","- C12 H14 N2 O3 -","- C12 H14 N2 O3 -","- C48 H56 N8 O12 -","4","1","QA0436","Gloe, Karsten; Uzoukwu, Bieluonwu A.; Rademacher, Otto; 4-Acetyl-2,4-dihydro-5-methyl-2-phenyl-3H-pyrazole-3-one hydrate","4-Acetyl-5-methyl-2-phenyl-1,2-dihydro-3<i>H</i>-pyrazol-3-one hydrate","Acta Crystallographica Section C","2000","56","12","e580","e581","10.1107/S0108270100015031","","","0.71073","MoKα","","0.042","0.037","","","","0.103","","","","","","1.059","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011641","7.0198","0.0002","12.0153","0.0005","24.669","0.002","90","","90","","90","","2080.7","0.2","293","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","5α-9(11)(16)-pregnadien-3β-ol-20-oxime acetate","","- C23 H33 N O3 -","- C23 H33 N O3 -","- C92 H132 N4 O12 -","4","1","QA0437","Novoa de Armas, Héctor; Peeters, Oswald M.; Blaton, Norbert M.; De Ranter, Camiel J.; Ruíz Garcia, José A.; Reyes Moreno, Mayra; Alvarez Ginarte, Yoanna M.","20-Hydroxyimino-5α-pregna-9(11),16-dien-3β-yl acetate and 17-oxo-5α-androst-9(11)-en-3β-yl acetate","Acta Crystallographica Section C","2000","56","12","e582","e583","10.1107/S0108270100015043","","","1.5418","CuKα","","0.0459","0.0389","","0.111","","0.111","","","1.057","","","1.057","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2011642","10.112","0.001","7.7821","0.0006","12.0922","0.0009","90","","91.73","0.01","90","","951.13","0.14","293","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","5α-9(11)-androsten-3β-ol-17-one acetate","","- C21 H30 O3 -","- C21 H30 O3 -","- C42 H60 O6 -","2","1","QA0437","Novoa de Armas, Héctor; Peeters, Oswald M.; Blaton, Norbert M.; De Ranter, Camiel J.; Ruíz Garcia, José A.; Reyes Moreno, Mayra; Alvarez Ginarte, Yoanna M.","20-Hydroxyimino-5α-pregna-9(11),16-dien-3β-yl acetate and 17-oxo-5α-androst-9(11)-en-3β-yl acetate","Acta Crystallographica Section C","2000","56","12","e582","e583","10.1107/S0108270100015043","","","1.5418","CuKα","","0.078","0.0479","","0.147","","0.147","","","1.055","","","1.055","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2011643","10.2673","0.0001","10.3671","0.0002","17.3596","0.0001","95.459","0.001","103.172","0.001","96.048","0.001","1775.57","0.04","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Bis(1,3-diphenylpropane-1,3-dionato-O,O')(diphenyl sulfoxide-S)dioxouranium(VI)","","- C42 H32 O7 S U -","- C42 H32 O7 S U -","- C84 H64 O14 S2 U2 -","2","1","QA0438","Kannan, S.; Shanmuga Sundara Raj, S.; Fun, Hoong-Kun","Bis(1,3-diphenylpropane-1,3-dionato-<i>O</i>,<i>O</i>')(diphenyl sulfoxide-<i>O</i>)dioxouranium(VI)","Acta Crystallographica Section C","2000","56","12","e545","e546","10.1107/S0108270100014827","","","0.71073","MoKα","","0.057","0.045","","","","0.107","","","","","","0.976","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011644","10.397","0.0015","10.397","0.0015","29.262","0.006","90","","90","","90","","3163.2","0.9","212","2","212","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","none","tetracis(diethyldithiocarbamato)tellurium(IV)","","- C20 H40 N4 S8 Te -","- C20 H40 N4 S8 Te -","- C80 H160 N16 S32 Te4 -","4","0.5","QA0439","Virovets, Alexander V.; Kalinina, Irina V.; Fedin, Vladimir P.; Fenske, Dieter","Tetragonal polymorphic modification of tetrakis(<i>N</i>,<i>N</i>-diethyldithiocarbamato-<i>S</i>,<i>S</i>')tellurium(IV)","Acta Crystallographica Section C","2000","56","12","e589","e590","10.1107/S0108270100015389","","","0.71073","MoKα","","0.04","0.029","","","","0.057","","","","","","1.125","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2011645","22.3858","0.0004","22.3858","0.0004","22.3858","0.0004","90","","90","","90","","11218.1","0.3","150","0.1","150","1","","","","","","","","4","I -4 3 d","I -4bd 2c 3","220","Chlorotrineophylstannane","Chloro-Tris(2-Methyl-2-Phenylpropyl)-Tin","","- C30 H39 Cl Sn -","- C30 H39 Cl Sn -","- C480 H624 Cl16 Sn16 -","16","0.333333","QA0440","Low, John Nicolson; Wardell, J.; Bomfim, João a. S.; Wardell, Solange M. S. V.","Chlorotris(2-methyl-2-phenylpropyl)tin(IV) at 150K","Acta Crystallographica Section C","2000","56","12","e554","e554","10.1107/S0108270100015067","","","0.71073","MoKα","","0.063","0.042","","","","0.123","","","","","","1.043","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011646","6.786","0.0014","9.174","0.0018","14.982","0.003","90","","101.42","0.03","90","","914.2","0.3","176","2","176","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C6 H18 Al2 Cl4 O2 Si2 -","- C6 H18 Al2 Cl4 O2 Si2 -","- C12 H36 Al4 Cl8 O4 Si4 -","2","0.5","QA0441","Kouvetakis, John; Ritter, Cole; Groy, Thomas L.","The centrosymmetric dimer of dichloro(trimethylsiloxy)aluminium","Acta Crystallographica Section C","2000","56","12","e564","e564","10.1107/S0108270100017261","","","0.71073","MoKα","","0.088","0.054","","","","0.155","","","","","","1.097","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011647","21.763","0.002","22.955","0.002","30.767","0.002","90","","90","","90","","15370","2","150","2","150","2","","","","","","","","6","I b c a","-I 2b 2c","73","","","","- C98 H83 Ag B N P4 -","- C98 H83 Ag B N P4 -","- C784 H664 Ag8 B8 N8 P32 -","8","0.5","QA0442","Ellis, Dianne D.; Spek, Anthony L.","Tetrakis(triphenylphosphine)silver(I) tetraphenylborate acetonitrile solvate","Acta Crystallographica Section C","2000","56","12","e547","e548","10.1107/S0108270100015079","","","0.71073","MoKα","","0.128","0.058","","","","0.14","","","","","","1.013","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011648","10.3124","0.0002","8.6888","0.0003","13.3156","0.0003","90","","97.2427","0.0015","90","","1183.59","0.05","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Ethyl-2-amino-4-phenyl-1,3-thiazole-5-carboxylate","","- C12 H12 N2 O2 S -","- C12 H12 N2 O2 S -","- C48 H48 N8 O8 S4 -","4","1","QA0444","Lynch, Daniel E.; McClenaghan, Ian","Ethyl 2-amino-4-phenyl-1,3-thiazole-5-carboxylate","Acta Crystallographica Section C","2000","56","12","e586","e586","10.1107/S0108270100015201","","","0.71073","MoKα","","0.043","0.037","","","","0.102","","","","","","1.013","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011649","11.197","0.002","8.932","0.002","6.976","0.002","90","","90.21","0.02","90","","697.7","0.3","298","1","","","","","","","","","","3","P 1 21 1","P 2yb","4","(-)-epi-inosose","(-)-2L-(2,3,4,6/5)-2,3,4,5,6-pentahydroxycyclohexanone","","- C6 H10 O6 -","- C6 H10 O6 -","- C24 H40 O24 -","4","2","QA0445","Hosomi, Hiroyuki; Ohba, Shigeru; Ogawa, Seiichiro; Takahashi, Atsushi","(‒)-<i>epi</i>-Inosose-2","Acta Crystallographica Section C","2000","56","12","e584","e585","10.1107/S0108270100015092","","","0.71073","MoKα","","","0.024","","","","0.068","","","","","","1.13","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011650","11.9231","0.0007","5.4888","0.0003","12.3788","0.0008","90","","91.527","0.003","90","","809.82","0.08","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(Phenyl)thiosemicarbazide","","- C7 H9 N3 S -","- C7 H9 N3 S -","- C28 H36 N12 S4 -","4","1","QA0447","Lynch, Daniel E.; McClenaghan, Ian","Redetermination of 4-(phenyl)thiosemicarbazide","Acta Crystallographica Section C","2000","56","12","e587","e587","10.1107/S0108270100015390","","","0.71073","MoKα","","0.052","0.04","","","","0.132","","","","","","1.13","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011651","13.115","0.003","24.305","0.003","6.388","0.003","90","","90","","90","","2036.2","1.1","298.2","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C21 H20 F3 N O4 -","- C21 H20 F3 N O4 -","- C84 H80 F12 N4 O16 -","4","1","QA0448","Sato, Shoichi; Yamazaki, Takashi; Shinohara, Noriyasu; Kitazume, Tomoya","(<i>S</i>)-4-Benzyl-3-[(<i>R</i>)-4,4,4-trifluoro-3-(4-methoxyphenyl)butanoyl]-1,3-oxazolidin-2-one","Acta Crystallographica Section C","2000","56","12","e592","e593","10.1107/S0108270100015717","","","0.7107","MoKα","","","0.0483","","","","0.1371","","","","","","1.998","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011652","6.7416","0.0001","9.8984","0.0002","17.3338","0.0003","90","","91.82","0.001","90","","1156.12","0.04","173","","173","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C6 H7 Br4 N Ti -","- C6 H7 Br4 N Ti -","- C24 H28 Br16 N4 Ti4 -","4","1","QA0449","Hensen, Karl; Lemke, Alexander; Bolte, Michael","Tetrabromo(2-methylpyridine-<i>N</i>)titanate(IV)","Acta Crystallographica Section C","2000","56","12","e565","e566","10.1107/S0108270100015407","","","0.71073","MoKα","","0.093","0.055","","0.106","0.095","0.106","","","1.088","","","1.088","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011653","7.0907","0.0014","8.0793","0.0016","23.07","0.005","90","","96.1","0.03","90","","1314.1","0.5","150","2","150","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","5-(methylfur-2-yl)-1-phenylpent-4-ene-1,3-dione","","- C16 H14 O3 -","- C16 H14 O3 -","- C64 H56 O12 -","4","1","QA0450","Arrieta, Antonio F; Haglund, Kjersti Ann; Mostad, Arvid","Conjugation and hydrogen bonding in a curcumin analogue","Acta Crystallographica Section C","2000","56","12","e594","e595","10.1107/S0108270100015729","","","0.71073","MoKα","","0.06","0.04","","","","0.098","","","","","","1.067","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011654","10.355","0.001","11.815","0.002","9.9","0.001","105.06","0.01","97.47","0.01","107.58","0.01","1086","0.3","298","1","","","","","","","","","","5","P -1","-P 1","2","","","","- C50 H44 Co N7 O5 -","- C50 H42 Co N7 O5 -","- C50 H42 Co N7 O5 -","1","0.5","QA0451","Ohba, Shigeru; Eishima, Makoto; Seki, Hiroshi","Aquanitro(α,β,γ,δ-tetraphenylporphyrinato)cobalt(III) <i>N</i>,<i>N</i>-dimethylformamide disolvate","Acta Crystallographica Section C","2000","56","12","e555","e556","10.1107/S0108270100015109","","","0.71073","MoKα","","","0.043","","","","0.123","","","","","","1.01","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2011655","6.601","0.002","12.721","0.002","14.072","0.001","90","","97.06","0.01","90","","1172.7","0.4","298","1","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C4 H16 Cl Co N6 O5 -","- C4 H16 Cl Co N6 O5 -","- C16 H64 Cl4 Co4 N24 O20 -","4","1","QA0452","Ohba, Shigeru; Eishima, Makoto","<i>trans</i>-Chlorobis(ethylenediamine-<i>N</i>,<i>N</i>')nitrocobalt(III) nitrate","Acta Crystallographica Section C","2000","56","12","e557","e558","10.1107/S0108270100015122","","","0.71073","MoKα","","","0.032","","","","0.082","","","","","","1.1","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2011656","8.349","0.002","12.644","0.003","6.556","0.003","103.19","0.03","105.11","0.03","77.3","0.02","641","0.4","298","1","","","","","","","","","","6","P -1","-P 1","2","","","","- C4 H16 Cl2 Co N5 O6 -","- C4 H16 Cl2 Co N5 O6 -","- C8 H32 Cl4 Co2 N10 O12 -","2","1","QA0453","Ohba, Shigeru; Eishima, Makoto","<i>trans</i>-Chlorobis(ethylenediamine-<i>N</i>,<i>N</i>')nitrocobalt(III) perchlorate","Acta Crystallographica Section C","2000","56","12","e559","e560","10.1107/S0108270100015134","","","0.71073","MoKα","","","0.042","","","","0.112","","","","","","1.18","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2011657","11.2926","0.0006","10.4429","0.0004","11.2028","0.0004","90","","115.829","0.015","90","","1189.14","0.17","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Chloro-3-pyrrolidino-1,4-naphthoquinone","","- C14 H12 Cl N O2 -","- C14 H12 Cl N O2 -","- C56 H48 Cl4 N4 O8 -","4","1","QA0454","Lynch, Daniel E.; McClenaghan, Ian","2-Chloro-3-(pyrrolidin-1-yl)-1,4-naphthoquinone","Acta Crystallographica Section C","2000","56","12","e588","e588","10.1107/S0108270100015730","","","0.71073","MoKα","","0.084","0.044","","","","0.118","","","","","","0.972","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011658","6.0228","0.0003","24.792","0.001","12.189","0.001","90","","100.928","0.001","90","","1787.02","0.19","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2-(4-Acetyl-3,5-dihydroxy-2-methylphenoxy)-4,6-dimethoxy-3-methylbenzoic acid","","- C19 H20 O8 -","- C19 H20 O8 -","- C76 H80 O32 -","4","1","QA0457","Chantrapromma, Suchada; Fun, Hoong-Kun; Razak, Ibrahim Abdul; Saewon, Nisakorn; Karalai, Chatchanok; Chantrapromma, Kan","2-(4-Acetyl-3,5-dihydroxy-2-methylphenoxy)-4,6-dimethoxy-3-methylbenzoic acid","Acta Crystallographica Section C","2000","56","12","e598","e599","10.1107/S0108270100016280","","","0.71073","MoKα","","0.136","0.08","","","","0.231","","","","","","0.961","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011659","7.2902","0.0007","23.644","0.002","12.0207","0.0009","90","","106.448","0.006","90","","1987.2","0.3","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Bis(N-methyl-2-chloropyridinium)-iodide-triiodide","","","- C12 H14 Cl2 I4 N2 -","- C12 H14 Cl2 I4 N2 -","- C48 H56 Cl8 I16 N8 -","4","1","QA0458","Heigel, Erik; Bock, Hans; Seibel, Andreas","Bis(2-chloro-<i>N</i>-methylpyridinium) iodide triiodide","Acta Crystallographica Section C","2000","56","12","e604","e605","10.1107/S0108270100017315","","","0.71073","MoKα","","0.048","0.036","","","","0.085","","","","","","1.095","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011660","5.31997","0.00014","5.31997","0.00014","9.5567","0.0003","90","","90","","120","","234.238","0.011","295","","295","","","","","","","","","3","P 3","P 3","143","Sodium Titanate","sodium titanate","","- Na4 O12 Ti5 -","- Na4 O12 Ti5 -","- Na4 O12 Ti5 -","1","0.333333","QD0006","Avdeev, Maxim; Kholkin, Andrei","Low-temperature Na~4~Ti~5~O~12~ from X-ray and neutron powder diffraction data","Acta Crystallographica Section C","2000","56","12","e539","e540","10.1107/S0108270100014839","","","1.54056","CuKα~1~","","","","","","","","","","5.37","","","","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011661","29.456","0.006","15.44","0.003","8.19","0.0016","90","","99.52","0.03","90","","3673.5","1.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(4-nitrobenzyl)maleonitriledithioether","","- C18 H12 N4 O4 S2 -","- C18 H12 N4 O4 S2 -","- C144 H96 N32 O32 S16 -","8","1","SK1375","Ren, Xiao-Ming; Xu, Yan; Hu, Chuan-Jiang; Meng, Qing-Jin; Lu, Chang-Sheng; Wang, Hua-Ting","2,3-Bis(4-nitrobenzylthio)maleonitrile","Acta Crystallographica Section C","2000","56","12","1499","1500","10.1107/S010827010001283X","","","0.71073","MoKα","","0.0663","0.0332","","","","0.1004","","","","","","1.012","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011662","7.47","0.001","14.681","0.002","27.079","0.004","90","","90","","90","","2969.7","0.7","223","2","223","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","alpha-Onocerin","8(26),14(27)-Onoceradiene-3,21-diol","","- C30.5 H50.5 Cl1.5 O2 -","- C30.5 H50.5 Cl1.5 O2 -","- C122 H202 Cl6 O8 -","4","1","SK1405","Fröhlich, Roland; Pauli, Guido F.","α-Onocerin chloroform hemisolvate","Acta Crystallographica Section C","2000","56","12","1476","1477","10.1107/S0108270100012403","","","1.54178","CuKα","","0.127","0.076","","","","0.228","","","","","","0.991","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011663","29.038","0.006","7.233","0.001","9.629","0.002","90","","95.45","0.03","90","","2013.3","0.7","120","2","120","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","glycyl-dl-leucine","dl-2-(2-amino-acetylamino)-4-metyhl-pentanoic acid","","- C8 H16 N2 O3 -","- C8 H16 N2 O3 -","- C64 H128 N16 O24 -","8","1","SK1407","Bombicz, Petra; Dittrich, Birger; Strumpel, Marianna; Nabein, Hans-Peter; Luger, Peter","Racemic dipeptide glycyl-<small>DL</small>-leucine at 120K","Acta Crystallographica Section C","2000","56","12","1447","1449","10.1107/S0108270100011616","","","0.71073","MoKα","","0.0447","0.0409","","","","0.1148","","","","","","1.073","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011664","24.7585","0.0004","11.446","0.0002","16.5815","0.0001","90","","112.689","0.001","90","","4335.32","0.11","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","Structure of hexakis(imidazole)nickel(II) bis(O,O'-disopropyl dithiophosphate)","","- C30 H52 N12 Ni O4 P2 S4 -","- C30 H52 N12 Ni O4 P2 S4 -","- C120 H208 N48 Ni4 O16 P8 S16 -","4","0.5","SK1416","Hao, Qingli; Jian, Fangfang; Yang, Xujie; Wang, Xin; Razak, Ibrahim Abdul; Shanmuga Sundara Raj, S.; Fun, Hoong-Kun","Hexakis(1<i>H</i>-imidazole-κ<i>N</i>^3^)nickel(II) bis[<i>O</i>,<i>O</i>'-diisopropyl dithiophosphate(1‒)]","Acta Crystallographica Section C","2000","56","12","1431","1432","10.1107/S0108270100012841","","","0.71073","MoKα","","0.121","0.072","","","","0.227","","","","","","1.07","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011665","23.6968","0.0015","7.651","0.0005","15.1664","0.001","90","","92.36","0.001","90","","2747.4","0.3","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","N-(2-Nitrophenylthio)saccharin","","- C13 H8 N2 O5 S2 -","- C13 H8 N2 O5 S2 -","- C104 H64 N16 O40 S16 -","8","1","SK1418","Glidewell, Christopher; Low, John N.; Wardell, James L.","Hydrogen-bonded dimers in <i>N</i>-(2-nitrophenylthio)saccharin","Acta Crystallographica Section C","2000","56","12","1462","1464","10.1107/S0108270100012415","","","0.71073","MoKα","","0.053","0.033","","","","0.081","","","","","","0.921","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011666","8.2214","0.0004","11.4293","0.0005","14.3861","0.0006","90","","90","","90","","1351.79","0.1","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2-Nitrophenyl-β-D-thiogalactopyranoside","","- C12 H15 N O7 S -","- C12 H15 N O7 S -","- C48 H60 N4 O28 S4 -","4","1","SK1419","Glidewell, Christopher; Low, John N.; Wardell, James L.","Conformational preferences and supramolecular aggregation in 2-nitrophenylthiolates: 2-nitrophenyl-β-<small>D</small>-thiogalactopyranoside","Acta Crystallographica Section C","2000","56","12","1465","1467","10.1107/S0108270100012427","","","0.71073","MoKα","","0.03","0.027","","","","0.074","","","","","","1.011","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011667","4.3048","0.001","18.108","0.003","13.3152","0.0017","90","","95.847","0.013","90","","1032.5","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2,4-dibromo-3-methoxy-6-nitrobenzaldehyde","","- C8 H5 Br2 N O4 -","- C8 H5 Br2 N O4 -","- C32 H20 Br8 N4 O16 -","4","1","SK1420","Paixão, J. A.; Matos Beja, A.; Ramos Silva, M.; Alte da Veiga, L.; Serra, A.C.","2,4-Dibromo-3-methoxy-6-nitrobenzaldeyde: effect of substituents on ring geometry","Acta Crystallographica Section C","2000","56","12","1501","1502","10.1107/S0108270100012853","","","0.71073","MoKα","","0.113","0.035","","","","0.099","","","","","","0.981","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011668","5.0186","0.0005","9.6408","0.0009","14.5082","0.0014","90","","98.21","0.01","90","","694.76","0.12","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","7-NI","7-Nitro-1H-indazole","","- C7 H5 N3 O2 -","- C7 H5 N3 O2 -","- C28 H20 N12 O8 -","4","1","SX1105","Sopková-de Oliveira Santos, Jana; Collot, Valerie; Rault, Sylvain","7-Nitro-1<i>H</i>-indazole, an inhibitor of nitric oxide synthase","Acta Crystallographica Section C","2000","56","12","1503","1504","10.1107/S0108270100012956","","","0.71073","MoKα","","0.058","0.046","","","","0.135","","","","","","1.056","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011669","19.3044","0.0004","10.6009","0.0003","11.6549","0.0003","90","","125.527","0.002","90","","1941.1","0.1","150","2","150","2","","","","","","","","5","C 1 c 1","C -2yc","9","","trans-4-[4-(Dimethylamino)phenyliminomethyl]-N-phenylpyridinium hexafluorophosphate","","- C20 H20 F6 N3 P -","- C20 H20 F6 N3 P -","- C80 H80 F24 N12 P4 -","4","1","SX1113","Coe, Benjamin J.; Harris, James A.; Gelbrich, Thomas; Hursthouse, Michael B.","<i>trans</i>-4-[4-(Dimethylamino)phenyliminomethyl]-<i>N</i>-phenylpyridinium hexafluorophosphate","Acta Crystallographica Section C","2000","56","12","1487","1489","10.1107/S0108270100012543","","","0.71073","MoKα","","0.042","0.036","","","","0.092","","","","","","0.998","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011670","10.191","0.007","10.963","0.01","12.621","0.0011","102.23","0.06","114.58","0.03","100.64","0.06","1192.7","1.6","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","13,13a-Dihydro-9-methyl-13-methoxy-1-benzopyrano[4,3-i]- dinaphtho[2,1-c;1',2'-f]-2,8-dioxabicyclo[3,3,1]nonane","","- C32 H24 O4 -","- C32 H24 O4 -","- C64 H48 O8 -","2","1","VJ1108","Sahana, Sirin; Bandyopadhyay, Chandrakanta; Chaudhuri, Siddhartha","13,13a-Dihydro-13-methoxy-9-methyl-1-benzopyrano[4,3-<i>i</i>]dinaphtho[2,1-<i>c</i>;1',2'-<i>f</i>]-2,8-dioxabicyclo[3.3.1]nonane","Acta Crystallographica Section C","2000","56","12","1450","1451","10.1107/S010827010001180X","","","1.5418","CuKα","","0.0614","0.0504","","","","0.1514","","","","","","1.039","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2011671","19.2711","0.001","9.769","0.003","10.2592","0.001","90","0.01","103.666","0.013","90","0.01","1876.7","0.6","293","2","293","2","","","","","","","","5","C 1 2 1","C 2y","5","","Ethyl 2-[N-(tert-butyloxycarbonyl)-L-alanylamino]-4-methyl-1,3-thiazole-5 -carboxylate","","- C15 H23 N3 O5 S -","- C15 H23 N3 O5 S -","- C60 H92 N12 O20 S4 -","4","1","VJ1112","Singh, Umesh Prasad; Thomas, Mini; Seshadri, T.P.; Bhattacharya, Santanu","Ethyl 2-[<i>N</i>-(<i>tert</i>-butyloxycarbonyl)-<small>L</small>-alanylamino]-4-methyl-1,3-thiazole-5-carboxylate reveals a <i>trans</i> orientation of the preceding amide N—H with respect to the thiazole-ring sulfur","Acta Crystallographica Section C","2000","56","12","1482","1483","10.1107/S0108270100012439","","","1.5418","CuKα","","0.0405","0.0379","","","","0.1088","","","","","","1.035","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011672","7.609","0.003","9.63","0.002","12.858","0.002","110.14","0.01","94.8","0.02","96.83","0.02","870.4","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","3-Chlorophenyl-N-phenylnitrone","N-(benzylidene)(3-chlorophenyl)N-oxide","","- C20 H16 Cl N O3 -","- C20 H16 Cl N O3 -","- C40 H32 Cl2 N2 O6 -","2","1","VJ1113","Chandrasekar, S.; Panchanatheswaran, K.","<i>N</i>-(3-Chlorophenyl)-α-phenylnitrone: association with benzoic acid through hydrogen bonding","Acta Crystallographica Section C","2000","56","12","1442","1443","10.1107/S0108270100011379","","","1.5418","CuKα","","0.0638","0.0512","","0.1457","0.1352","","","","1.052","1.103","1.103","","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2019349","9.7313","0.0008","9.2898","0.0011","8.115","0.001","90","","104.252","0.008","90","","711.03","0.14","180","2","180","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","t-butylperthiophosphonic anhydride","","- C8 H18 P2 S4 -","- C8 H18 P2 S4 -","- C16 H36 P4 S8 -","2","0.25","","Ziemer, Burkhard; Steinberger, Hans-Uwe","A monoclinic polymorph of bis(tert-butylperthiophosphonic) dianhydride","Acta Crystallographica Section C Crystal Structure Communications","2000","56","3","e95","","10.1107/S0108270100002390","","","0.71073","MoKα","","0.025","0.025","","","","0.064","","","","","","1.145","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2101955","9.572","0.003","10.039","0.003","10.548","0.003","90","","90","","90","","1013.6","0.5","110","5","110","5","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Glycyl-L-Threonine Dihydrate","Glycyl-L-Threonine Dihydrate","","- C6 H16 N2 O6 -","- C6 H16 N2 O6 -","- C24 H64 N8 O24 -","4","1","AN0564","Benabicha, Farid; Pichon-Pesme, Virginie; Jelsch, Christian; Lecomte, Claude; Khmou, Ahmed","Experimental charge density and electrostatic potential of glycyl-<small>L</small>-threonine dihydrate","Acta Crystallographica Section B","2000","56","1","155","165","10.1107/S0108768199014251","","","0.71068","MoKα","","","0.0247","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2101956","13.3213","0.0004","14.0499","0.0004","16.0491","0.0006","90","","110.549","0.002","90","","2812.67","0.16","100","0.1","100","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Meso-5,5,7,12,12,14-Hexamethyl-1,4,8,11-tetra- azacyclotetradecane‒terephthalic acid‒water (1/1/4).","","- C24 H50 N4 O8 -","- C24 H50 N4 O8 -","- C96 H200 N16 O32 -","4","1","BM0023","Lough, Alan J.; Gregson, Richard M.; Ferguson, George; Glidewell, Christopher","Two different three-dimensional hydrogen-bonded framework structures in two hydrated adducts <i>meso</i>-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradecane‒terephthalic acid‒water (1/1/4) and (1/1/6)","Acta Crystallographica Section B","2000","56","1","85","93","10.1107/S0108768199011544","","","0.71073","MoKα","","0.084","0.0412","","","","0.0988","","","","","","0.914","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2101957","8.1772","0.0003","12.3974","0.0004","16.8804","0.0005","90","","116.231","0.002","90","","1535.04","0.09","100","0.1","100","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","meso-5,5,7,12,12,14-Hexamethyl-1,4,8,11-tetra- azacyclotetradecane‒terephthalic acid‒water (1/1/6)","","- C24 H54 N4 O10 -","- C24 H54 N4 O10 -","- C48 H108 N8 O20 -","2","0.5","BM0023","Lough, Alan J.; Gregson, Richard M.; Ferguson, George; Glidewell, Christopher","Two different three-dimensional hydrogen-bonded framework structures in two hydrated adducts <i>meso</i>-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradecane‒terephthalic acid‒water (1/1/4) and (1/1/6)","Acta Crystallographica Section B","2000","56","1","85","93","10.1107/S0108768199011544","","","0.71073","MoKα","","0.0534","0.038","","","","0.1077","","","","","","0.978","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2101958","8.542","0.001","13.408","0.001","8.638","0.001","90","","99.7","0.01","90","","975.18","0.18","297","","297","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-methyl-idole-3-acetic acid","","- C11 H11 N O2 -","- C11 H11 N O2 -","- C44 H44 N4 O8 -","4","1","HA0181","Nigović, Biljana; Antolić, Snježana; Kojić-Prodić, Biserka; Kiralj, Rudolf; Magnus, Volker; Salopek, Branka","Correlation of structural and physico-chemical parameters with the bioactivity of alkylated derivatives of indole-3-acetic acid, a phytohormone (auxin)","Acta Crystallographica Section B","2000","56","1","94","111","10.1107/S0108768199006199","","","0.71073","MoKα","","","0.039","","","0.043","","","","","0.39","0.39","","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2101959","8.68","0.001","7.624","0.001","15.044","0.001","90","","101.87","0.006","90","","974.27","0.18","103","","103","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-methyl-indole-3-acetic acid","","- C11 H11 N O2 -","- C11 H11 N O2 -","- C44 H44 N4 O8 -","4","1","HA0181","Nigović, Biljana; Antolić, Snježana; Kojić-Prodić, Biserka; Kiralj, Rudolf; Magnus, Volker; Salopek, Branka","Correlation of structural and physico-chemical parameters with the bioactivity of alkylated derivatives of indole-3-acetic acid, a phytohormone (auxin)","Acta Crystallographica Section B","2000","56","1","94","111","10.1107/S0108768199006199","","","0.71073","MoKα","","","0.035","","","0.041","","","","","0.41","0.41","","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2101960","6.216","0.001","38.627","0.001","8.031","0.001","90","","90","","90","","1928.3","0.4","297","","297","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","6-Methyl-indole-3-acetic acid","","- C11 H11 N O2 -","- C11 H11 N O2 -","- C88 H88 N8 O16 -","8","1","HA0181","Nigović, Biljana; Antolić, Snježana; Kojić-Prodić, Biserka; Kiralj, Rudolf; Magnus, Volker; Salopek, Branka","Correlation of structural and physico-chemical parameters with the bioactivity of alkylated derivatives of indole-3-acetic acid, a phytohormone (auxin)","Acta Crystallographica Section B","2000","56","1","94","111","10.1107/S0108768199006199","","","0.71073","MoKα","","","0.049","","","0.041","","","","","0.99","0.99","","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2101961","19.353","0.001","5.074","0.001","10.275","0.001","90","","109","0.006","90","","954","0.2","297","","297","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","7-Methyl-indole-3-acetic acid","","- C11 H11 N O2 -","- C11 H11 N O2 -","- C44 H44 N4 O8 -","4","1","HA0181","Nigović, Biljana; Antolić, Snježana; Kojić-Prodić, Biserka; Kiralj, Rudolf; Magnus, Volker; Salopek, Branka","Correlation of structural and physico-chemical parameters with the bioactivity of alkylated derivatives of indole-3-acetic acid, a phytohormone (auxin)","Acta Crystallographica Section B","2000","56","1","94","111","10.1107/S0108768199006199","","","0.71073","MoKα","","","0.041","","","0.036","","","","","0.47","0.47","","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2101962","9.288","0.001","7.44","0.001","14.776","0.001","90","","103.53","0.006","90","","992.72","0.19","297","","297","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-ethyl-indole-3-acetic acid","","- C12 H13 N O2 -","- C12 H13 N O2 -","- C48 H52 N4 O8 -","4","1","HA0181","Nigović, Biljana; Antolić, Snježana; Kojić-Prodić, Biserka; Kiralj, Rudolf; Magnus, Volker; Salopek, Branka","Correlation of structural and physico-chemical parameters with the bioactivity of alkylated derivatives of indole-3-acetic acid, a phytohormone (auxin)","Acta Crystallographica Section B","2000","56","1","94","111","10.1107/S0108768199006199","","","0.71073","MoKα","","","0.042","","","0.046","","","","","0.62","0.62","","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2101963","22.455","0.001","5.286","0.001","9.313","0.001","90","","110.89","0.01","90","","1032.8","0.2","103","","103","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","6-ethyl-indole-3-acetic acid","","- C12 H13 N O2 -","- C12 H13 N O2 -","- C48 H52 N4 O8 -","4","1","HA0181","Nigović, Biljana; Antolić, Snježana; Kojić-Prodić, Biserka; Kiralj, Rudolf; Magnus, Volker; Salopek, Branka","Correlation of structural and physico-chemical parameters with the bioactivity of alkylated derivatives of indole-3-acetic acid, a phytohormone (auxin)","Acta Crystallographica Section B","2000","56","1","94","111","10.1107/S0108768199006199","","","0.71073","MoKα","","","0.066","","","","0.052","","","","","","0.91","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2101964","17.81","0.0005","5.175","0.0004","9.534","0.0004","90","","106.7","0.006","90","","841.66","0.08","103","","103","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","indole-3-acetic acid","","- C10 H9 N O2 -","- C10 H9 N O2 -","- C40 H36 N4 O8 -","4","1","HA0181","Nigović, Biljana; Antolić, Snježana; Kojić-Prodić, Biserka; Kiralj, Rudolf; Magnus, Volker; Salopek, Branka","Correlation of structural and physico-chemical parameters with the bioactivity of alkylated derivatives of indole-3-acetic acid, a phytohormone (auxin)","Acta Crystallographica Section B","2000","56","1","94","111","10.1107/S0108768199006199","","","0.71073","MoKα","","","0.0382","","","","0.0396","","","","","","0.86","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2101965","8.39","0.002","9.894","0.002","18.908","0.003","105.06","0.02","94.91","0.01","93.82","0.02","1503.6","0.6","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C46 H104 N14 O12 -","- C46 H104 N14 O12 -","- C46 H104 N14 O12 -","1","0.5","HR0043","Feng Xue; Thomas C. W. Mak","Channel- and layer-type anionic host structures in inclusion compounds of urea, tetraalkylammonium terephthalate/trimesate and water","Acta Crystallographica Section B","2000","56","1","142","154","10.1107/S0108768199011283","","","0.71073","MoKα","","0.1041","0.0503","","","","0.1642","","","","","","1.029","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2101966","9.432","0.001","12.601","0.001","14.804","0.001","79.98","0.01","79.2","0.01","84.18","0.01","1697.7","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C25 H58 N4 O10 -","- C25 H58 N4 O10 -","- C50 H116 N8 O20 -","2","1","HR0043","Feng Xue; Thomas C. W. Mak","Channel- and layer-type anionic host structures in inclusion compounds of urea, tetraalkylammonium terephthalate/trimesate and water","Acta Crystallographica Section B","2000","56","1","142","154","10.1107/S0108768199011283","","","0.71073","MoKα","","0.0824","0.069","","","","0.1925","","","","","","1.112","","","","has coordinates,has disorder,has Fobs","176768","2020-10-21","18:00:00",""
"2101967","13.25","0.001","14.034","0.001","15.26","0.001","72.46","0.01","78.32","0.01","66.95","0.01","2478.1","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C35 H86 N7 O15.5 -","- C35 H86 N7 O15.5 -","- C70 H172 N14 O31 -","2","1","HR0043","Feng Xue; Thomas C. W. Mak","Channel- and layer-type anionic host structures in inclusion compounds of urea, tetraalkylammonium terephthalate/trimesate and water","Acta Crystallographica Section B","2000","56","1","142","154","10.1107/S0108768199011283","","","0.71073","MoKα","","0.0853","0.0723","","","","0.2151","","","","","","1.083","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2101968","16.467","0.003","33.109","0.008","8.344","0.001","90","","90","","90","","4549.2","1.5","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C35 H78 N6 O13 -","- C35 H78 N6 O13 -","- C140 H312 N24 O52 -","4","1","HR0043","Feng Xue; Thomas C. W. Mak","Channel- and layer-type anionic host structures in inclusion compounds of urea, tetraalkylammonium terephthalate/trimesate and water","Acta Crystallographica Section B","2000","56","1","142","154","10.1107/S0108768199011283","","","0.71073","MoKα","","0.1692","0.0577","","","","0.1732","","","","","","0.953","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2101969","6.793","0.003","13.85","0.01","11.42","0.005","90","","102.71","0.04","90","","1048.1","1","223","2","223","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N-n-Propyl N,N-Dimethyl Ammonio Acetic Acid Bromide","","- C7 H16 Br N O2 -","- C7 H16 Br N O2 -","- C28 H64 Br4 N4 O8 -","4","1","JZ0007","Rudert, Rainer; Schulz, Burkhard; Reck, Günter; Vollhardt, Dieter; Kriwanek, Jörg","<i>N</i>-<i>n</i>-Alkyl <i>N,N</i>-dimethylammonioacetic acid bromides: the first complete series of crystal and molecular structure determinations of an amphiphilic compound with alkyl chain lengths <i>n</i>~=~1,..., 16","Acta Crystallographica Section B","2000","56","1","124","131","10.1107/S0108768199007740","","","0.71069","MoKα","","0.0482","0.0375","","0.1064","","0.0997","","","0.876","","","0.903","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2101970","6.771","0.003","7.599","0.002","12.273","0.005","94.17","0.03","92.04","0.03","98.83","0.03","621.6","0.4","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","N-n-Pentyl N,N-Dimethyl Ammonio Acetic Acid Bromide","","- C9 H20 Br N O2 -","- C9 H19 Br N O2 -","- C18 H38 Br2 N2 O4 -","2","1","JZ0007","Rudert, Rainer; Schulz, Burkhard; Reck, Günter; Vollhardt, Dieter; Kriwanek, Jörg","<i>N</i>-<i>n</i>-Alkyl <i>N,N</i>-dimethylammonioacetic acid bromides: the first complete series of crystal and molecular structure determinations of an amphiphilic compound with alkyl chain lengths <i>n</i>~=~1,..., 16","Acta Crystallographica Section B","2000","56","1","124","131","10.1107/S0108768199007740","","","0.71069","MoKα","","0.1529","0.0953","","0.2576","","0.2239","","","1.531","","","1.772","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2101971","6.739","0.006","7.525","0.002","13.67","0.02","85.61","0.06","86.18","0.09","79.81","0.04","679.3","1.2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","N-n-Hexyl N,N-Dimethyl Ammonio Acetic Acid Bromide","","- C10 H22 Br N O2 -","- C10 Br N O2 -","- C20 Br2 N2 O4 -","2","1","JZ0007","Rudert, Rainer; Schulz, Burkhard; Reck, Günter; Vollhardt, Dieter; Kriwanek, Jörg","<i>N</i>-<i>n</i>-Alkyl <i>N,N</i>-dimethylammonioacetic acid bromides: the first complete series of crystal and molecular structure determinations of an amphiphilic compound with alkyl chain lengths <i>n</i>~=~1,..., 16","Acta Crystallographica Section B","2000","56","1","124","131","10.1107/S0108768199007740","","","1.54178","CuKα","","0.387","0.3871","","0.7018","","0.7018","","","7.801","","","7.807","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2101972","6.872","0.002","7.519","0.001","14.107","0.001","85.59","0.01","87.2","0.02","81.44","0.02","718.1","0.2","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","N-n-Heptyl N,N-Dimethyl Ammonio Acetic Acid Bromide","","- C11 H24 Br N O2 -","- C11 H24 Br N O2 -","- C22 H48 Br2 N2 O4 -","2","1","JZ0007","Rudert, Rainer; Schulz, Burkhard; Reck, Günter; Vollhardt, Dieter; Kriwanek, Jörg","<i>N</i>-<i>n</i>-Alkyl <i>N,N</i>-dimethylammonioacetic acid bromides: the first complete series of crystal and molecular structure determinations of an amphiphilic compound with alkyl chain lengths <i>n</i>~=~1,..., 16","Acta Crystallographica Section B","2000","56","1","124","131","10.1107/S0108768199007740","","","0.71069","MoKα","","","0.065","","","","0.069","","","","","","0.97","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2101973","7.613","0.001","9.236","0.003","11.853","0.004","90","","98.08","0.02","90","","825.2","0.4","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N,N-Trimethyl Ammonio Acetic Acid Bromide","","- C5 H12 Br N O2 -","- C5 H12 Br N O2 -","- C20 H48 Br4 N4 O8 -","4","1","JZ0007","Rudert, Rainer; Schulz, Burkhard; Reck, Günter; Vollhardt, Dieter; Kriwanek, Jörg","<i>N</i>-<i>n</i>-Alkyl <i>N,N</i>-dimethylammonioacetic acid bromides: the first complete series of crystal and molecular structure determinations of an amphiphilic compound with alkyl chain lengths <i>n</i>~=~1,..., 16","Acta Crystallographica Section B","2000","56","1","124","131","10.1107/S0108768199007740","","","0.71069","MoKα","","0.0337","0.0258","","0.0956","","0.0832","","","0.796","","","0.757","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2101974","6.778","0.004","7.484","0.001","21.348","0.005","87.34","0.02","86.96","0.03","79.04","0.03","1060.9","0.7","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","N-n-Tetradecyl N,N-Dimethyl Ammonio Acetic Acid Bromide","","- C18 H38 Br N O2 -","- C18 H38 Br N O2 -","- C36 H76 Br2 N2 O4 -","2","1","JZ0007","Rudert, Rainer; Schulz, Burkhard; Reck, Günter; Vollhardt, Dieter; Kriwanek, Jörg","<i>N</i>-<i>n</i>-Alkyl <i>N,N</i>-dimethylammonioacetic acid bromides: the first complete series of crystal and molecular structure determinations of an amphiphilic compound with alkyl chain lengths <i>n</i>~=~1,..., 16","Acta Crystallographica Section B","2000","56","1","124","131","10.1107/S0108768199007740","","","0.71069","MoKα","","0.0406","0.0343","","0.1178","","0.1013","","","0.97","","","0.944","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2101975","6.762","0.003","7.466","0.002","23.4","0.02","86.9","0.05","83.14","0.05","78.87","0.03","1150.3","1.2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","N-n-Hexadecyl N,N-Dimethyl Ammonio Acetic Acid Bromide","","- C20 H42 Br N O2 -","- C20 H42 Br N O2 -","- C40 H84 Br2 N2 O4 -","2","1","JZ0007","Rudert, Rainer; Schulz, Burkhard; Reck, Günter; Vollhardt, Dieter; Kriwanek, Jörg","<i>N</i>-<i>n</i>-Alkyl <i>N,N</i>-dimethylammonioacetic acid bromides: the first complete series of crystal and molecular structure determinations of an amphiphilic compound with alkyl chain lengths <i>n</i>~=~1,..., 16","Acta Crystallographica Section B","2000","56","1","124","131","10.1107/S0108768199007740","","","0.71069","MoKα","","0.0484","0.0386","","0.1088","","0.103","","","0.894","","","0.924","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2101976","8.6323","0.0019","9.943","0.003","12.582","0.002","98.783","0.017","102.785","0.015","115.746","0.011","909.8","0.4","294","1","294","1","","","","","","","","4","P -1","-P 1","2","","Meso-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazayclotetradecane- 2,2'-biphenol (1/2)","","- C40 H56 N4 O4 -","- C40 H56 N4 O4 -","- C40 H56 N4 O4 -","1","0.5","NA0090","Gregson, Richard M.; Glidewell, Christopher; Ferguson, George; Lough, Alan J.","<i>meso</i>-5,5,7,12,12,14-Hexamethyl-1,4,8,11-tetraazacyclotetradecane as a building block in supramolecular chemistry; salts formed with 2,2'-biphenol, 4,4'-biphenol, 4,4'-thiodiphenol, 4,4'-sulfonyldiphenol, 3- and 4-hydroxybenzoic acids, 3,5-dihydroxybenzoic acid and phenylphosphonic acid; supramolecular structures in zero, one, two and three dimensions","Acta Crystallographica Section B","2000","56","1","39","57","10.1107/S0108768199006072","","","0.71073","MoKα","","0.0854","0.0523","","","","0.1334","","","","","","1.03","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2101977","10.659","0.005","17.892","0.005","11.679","0.005","90","","103.107","0.005","90","","2169.3","1.5","294","1","294","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Meso-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazayclotetradecane- 4,4'-thiobiphenol-methanol (1/2/2)","","- C42 H64 N4 O6 S2 -","- C42 H64 N4 O6 S2 -","- C84 H128 N8 O12 S4 -","2","0.5","NA0090","Gregson, Richard M.; Glidewell, Christopher; Ferguson, George; Lough, Alan J.","<i>meso</i>-5,5,7,12,12,14-Hexamethyl-1,4,8,11-tetraazacyclotetradecane as a building block in supramolecular chemistry; salts formed with 2,2'-biphenol, 4,4'-biphenol, 4,4'-thiodiphenol, 4,4'-sulfonyldiphenol, 3- and 4-hydroxybenzoic acids, 3,5-dihydroxybenzoic acid and phenylphosphonic acid; supramolecular structures in zero, one, two and three dimensions","Acta Crystallographica Section B","2000","56","1","39","57","10.1107/S0108768199006072","","","0.71073","MolybdenumKα","","0.0774","0.0375","","","","0.103","","","","","","1.042","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2101978","10.7736","0.001","18.1167","0.0018","11.5532","0.0014","90","","101.136","0.009","90","","2212.5","0.4","294","1","294","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Meso-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazayclotetradecane- 4,4'-tsulfonylbiphenol-methanol (1/2/2)","","- C42 H64 N4 O10 S2 -","- C42 H64 N4 O10 S2 -","- C84 H128 N8 O20 S4 -","2","0.5","NA0090","Gregson, Richard M.; Glidewell, Christopher; Ferguson, George; Lough, Alan J.","<i>meso</i>-5,5,7,12,12,14-Hexamethyl-1,4,8,11-tetraazacyclotetradecane as a building block in supramolecular chemistry; salts formed with 2,2'-biphenol, 4,4'-biphenol, 4,4'-thiodiphenol, 4,4'-sulfonyldiphenol, 3- and 4-hydroxybenzoic acids, 3,5-dihydroxybenzoic acid and phenylphosphonic acid; supramolecular structures in zero, one, two and three dimensions","Acta Crystallographica Section B","2000","56","1","39","57","10.1107/S0108768199006072","","","0.71073","MoKα","","0.1209","0.0461","","","","0.1077","","","","","","0.958","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2101979","8.0814","0.0009","10.1981","0.0012","10.78","0.0016","79.789","0.01","80.728","0.01","80.28","0.01","853.89","0.19","294","1","294","1","","","","","","","","4","P -1","-P 1","2","","Meso-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazayclotetradecane- 3-hydroxybenzoic acid-methanol (1/2/2)","","- C32 H56 N4 O8 -","- C32 H56 N4 O8 -","- C32 H56 N4 O8 -","1","0.5","NA0090","Gregson, Richard M.; Glidewell, Christopher; Ferguson, George; Lough, Alan J.","<i>meso</i>-5,5,7,12,12,14-Hexamethyl-1,4,8,11-tetraazacyclotetradecane as a building block in supramolecular chemistry; salts formed with 2,2'-biphenol, 4,4'-biphenol, 4,4'-thiodiphenol, 4,4'-sulfonyldiphenol, 3- and 4-hydroxybenzoic acids, 3,5-dihydroxybenzoic acid and phenylphosphonic acid; supramolecular structures in zero, one, two and three dimensions","Acta Crystallographica Section B","2000","56","1","39","57","10.1107/S0108768199006072","","","0.71073","MoKα","","0.0996","0.0482","","","","0.1183","","","","","","0.943","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2101980","9.4481","0.0007","9.8905","0.0006","18.0942","0.0012","88.704","0.005","78.675","0.004","77.525","0.004","1618.43","0.19","100","1","100","1","","","","","","","","4","P -1","-P 1","2","","Meso-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazayclotetradecane- 4-hydroxybenzoic acid-methanol (1/2/1)","","- C31 H52 N4 O7 -","- C31 H52 N4 O7 -","- C62 H104 N8 O14 -","2","1","NA0090","Gregson, Richard M.; Glidewell, Christopher; Ferguson, George; Lough, Alan J.","<i>meso</i>-5,5,7,12,12,14-Hexamethyl-1,4,8,11-tetraazacyclotetradecane as a building block in supramolecular chemistry; salts formed with 2,2'-biphenol, 4,4'-biphenol, 4,4'-thiodiphenol, 4,4'-sulfonyldiphenol, 3- and 4-hydroxybenzoic acids, 3,5-dihydroxybenzoic acid and phenylphosphonic acid; supramolecular structures in zero, one, two and three dimensions","Acta Crystallographica Section B","2000","56","1","39","57","10.1107/S0108768199006072","","","0.71073","MoKα","","0.1521","0.052","","","","0.1199","","","","","","0.843","","","","has coordinates,has disorder","176768","2020-10-21","18:00:00",""
"2101981","8.7391","0.0002","26.1558","0.0007","10.7871","0.0002","90","","107.267","0.013","90","","2354.57","0.19","100","1","100","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Meso-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazayclotetradecane- phenylphosphonic acid-water (1/4/2)","","- C40 H68 N4 O14 P4 -","- C40 H68 N4 O14 P4 -","- C80 H136 N8 O28 P8 -","2","0.5","NA0090","Gregson, Richard M.; Glidewell, Christopher; Ferguson, George; Lough, Alan J.","<i>meso</i>-5,5,7,12,12,14-Hexamethyl-1,4,8,11-tetraazacyclotetradecane as a building block in supramolecular chemistry; salts formed with 2,2'-biphenol, 4,4'-biphenol, 4,4'-thiodiphenol, 4,4'-sulfonyldiphenol, 3- and 4-hydroxybenzoic acids, 3,5-dihydroxybenzoic acid and phenylphosphonic acid; supramolecular structures in zero, one, two and three dimensions","Acta Crystallographica Section B","2000","56","1","39","57","10.1107/S0108768199006072","","","0.71073","MoKα","","0.0563","0.0402","","","","0.1011","","","","","","1.032","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2101982","8.9162","0.0013","11.8903","0.001","14.5229","0.0018","90","","100.419","0.007","90","","1514.3","0.3","294","1","294","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Meso-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazayclotetradecane- 3,5-dihydroxybenzoic acid (1/2)","","- C30 H48 N4 O8 -","- C30 H48 N4 O8 -","- C60 H96 N8 O16 -","2","0.5","NA0090","Gregson, Richard M.; Glidewell, Christopher; Ferguson, George; Lough, Alan J.","<i>meso</i>-5,5,7,12,12,14-Hexamethyl-1,4,8,11-tetraazacyclotetradecane as a building block in supramolecular chemistry; salts formed with 2,2'-biphenol, 4,4'-biphenol, 4,4'-thiodiphenol, 4,4'-sulfonyldiphenol, 3- and 4-hydroxybenzoic acids, 3,5-dihydroxybenzoic acid and phenylphosphonic acid; supramolecular structures in zero, one, two and three dimensions","Acta Crystallographica Section B","2000","56","1","39","57","10.1107/S0108768199006072","","","0.71073","MoKα","","0.0609","0.0419","","","","0.1116","","","","","","1.052","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2101983","9.9634","0.001","18.8981","0.0019","12.2344","0.0011","90","","97.725","0.007","90","","2282.7","0.4","294","1","294","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Meso-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazayclotetradecane- 4,4'-biphenol (1/3)","","- C52 H66 N4 O6 -","- C52 H66 N4 O6 -","- C104 H132 N8 O12 -","2","0.5","NA0090","Gregson, Richard M.; Glidewell, Christopher; Ferguson, George; Lough, Alan J.","<i>meso</i>-5,5,7,12,12,14-Hexamethyl-1,4,8,11-tetraazacyclotetradecane as a building block in supramolecular chemistry; salts formed with 2,2'-biphenol, 4,4'-biphenol, 4,4'-thiodiphenol, 4,4'-sulfonyldiphenol, 3- and 4-hydroxybenzoic acids, 3,5-dihydroxybenzoic acid and phenylphosphonic acid; supramolecular structures in zero, one, two and three dimensions","Acta Crystallographica Section B","2000","56","1","39","57","10.1107/S0108768199006072","","","0.71073","MoKα","","0.1244","0.0527","","","","0.1262","","","","","","0.931","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2101984","21.595","0.003","14.518","0.002","7.953","0.0007","90","","90","","90","","2493.4","0.5","293","1","294","1","","","","","","","","5","P b c a","-P 2ac 2ab","61","","(E)-1-(4-methyl-2-nitrobenzenethiolato)-2-phenylethene","","- C15 H13 N O2 S -","- C15 H13 N O2 S -","- C120 H104 N8 O16 S8 -","8","1","NA0092","Low, John N.; Storey, Emily J.; McCarron, Mary; Wardell, James L.; Ferguson, George; Glidewell, Christopher","Conformational preferences in 2-nitrophenylthiolates: interplay between intra- and intermolecular forces; structures of (<i>E</i>)-1-(4-methyl-2-nitrobenzenethiolato)-2-phenylethene, <i>S</i>-(2-nitrophenyl)benzenecarbothiolate and 1-(2-nitrophenylthio)-2,5-pyrrolidinedione","Acta Crystallographica Section B","2000","56","1","58","67","10.1107/S0108768199009702","","","0.71073","MoKα","","0.1586","0.0655","","","","0.1441","","","","","","0.91","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2101985","7.51","0.05","21.16","0.05","7.66","0.05","90","","92.043","0.01","90","","1216","12","294","1","294","1","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","S-(2-Nitrophenyl)benzenecarbothiolate","","- C13 H9 N O3 S -","- C13 H9 N O3 S -","- C52 H36 N4 O12 S4 -","4","1","NA0092","Low, John N.; Storey, Emily J.; McCarron, Mary; Wardell, James L.; Ferguson, George; Glidewell, Christopher","Conformational preferences in 2-nitrophenylthiolates: interplay between intra- and intermolecular forces; structures of (<i>E</i>)-1-(4-methyl-2-nitrobenzenethiolato)-2-phenylethene, <i>S</i>-(2-nitrophenyl)benzenecarbothiolate and 1-(2-nitrophenylthio)-2,5-pyrrolidinedione","Acta Crystallographica Section B","2000","56","1","58","67","10.1107/S0108768199009702","","","0.71073","MoKα","","0.0849","0.0441","","","","0.1522","","","","","","0.917","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2101986","7.918","0.005","13.132","0.005","10.983","0.005","90","","110.7","0.3","90","","1068","2","294","1","294","1","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","1-(2-Nitrophenylthio)-2,5-pyrrolidinedione","","- C10 H8 N2 O4 S -","- C10 H8 N2 O4 S -","- C40 H32 N8 O16 S4 -","4","1","NA0092","Low, John N.; Storey, Emily J.; McCarron, Mary; Wardell, James L.; Ferguson, George; Glidewell, Christopher","Conformational preferences in 2-nitrophenylthiolates: interplay between intra- and intermolecular forces; structures of (<i>E</i>)-1-(4-methyl-2-nitrobenzenethiolato)-2-phenylethene, <i>S</i>-(2-nitrophenyl)benzenecarbothiolate and 1-(2-nitrophenylthio)-2,5-pyrrolidinedione","Acta Crystallographica Section B","2000","56","1","58","67","10.1107/S0108768199009702","","","0.71073","MoKα","","0.0658","0.0352","","","","0.1215","","","","","","0.858","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2101987","20.0511","0.0001","19.8757","0.0001","13.36823","0.00009","90","","90","","90","","5327.64","0.05","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- H3.6 O24 Si11.04 -","- O24 Si12 -","- O192 Si96 -","8","1","NA0094","Artioli, G.; Lamberti, C.; Marra, G.L.","Neutron powder diffraction study of orthorhombic and monoclinic defective silicalite","Acta Crystallographica Section B","2000","56","1","2","10","10.1107/S0108768199008927","","neutron","1.22","neutron","","","","","","","","","","","","","","","","","has coordinates","278244","2022-09-28","13:56:22",""
"2101988","19.8352","0.0002","20.0903","0.0002","13.3588","0.0001","90","","90.892","0.001","90","","5322.77","0.09","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- H3.6 O24 Si11.04 -","- O48 Si24 -","- O192 Si96 -","4","1","NA0094","Artioli, G.; Lamberti, C.; Marra, G.L.","Neutron powder diffraction study of orthorhombic and monoclinic defective silicalite","Acta Crystallographica Section B","2000","56","1","2","10","10.1107/S0108768199008927","","neutron","1.22","neutron","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:54",""
"2101989","10.4698","0.0009","10.277","0.0009","25.449","0.002","90","","98.429","0.001","90","","2708.7","0.4","293","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C15 H14 O3 S -","- C15 H14 O3 S -","- C120 H112 O24 S8 -","8","2","NA0095","Olivato, Paulo R.; Guerrero, Sandra A.; Zukerman-Schpector, J.","Preferred conformations in the solid state of some α-(<i>p</i>-phenylsulfinyl)-<i>p</i>-substituted acetophenones","Acta Crystallographica Section B","2000","56","1","112","117","10.1107/S0108768199008599","","","0.71073","MoKα","","0.2386","0.0568","","0.1492","","0.1044","","","0.929","","","0.929","","","","has coordinates,has disorder,has Fobs","176768","2020-10-21","18:00:00",""
"2101990","5.5704","0.0008","8.619","0.001","30.356","0.005","90","","90","","90","","1457.4","0.4","293","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C15 H13 N O5 S -","- C15 H13 N O5 S -","- C60 H52 N4 O20 S4 -","4","1","NA0095","Olivato, Paulo R.; Guerrero, Sandra A.; Zukerman-Schpector, J.","Preferred conformations in the solid state of some α-(<i>p</i>-phenylsulfinyl)-<i>p</i>-substituted acetophenones","Acta Crystallographica Section B","2000","56","1","112","117","10.1107/S0108768199008599","","","0.71073","MoKα","","0.2164","0.1067","","0.3371","","0.2887","","","1.009","","","1.009","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2101991","6.7468","0.0008","7.4303","0.0007","15.201","0.002","85.25","0.01","79.56","0.01","75.39","0.01","724.64","0.15","293","","","","","","","","","","","5","P -1","-P 1","2","","","","- C15 H13 N O5 S -","- C15 H13 N O5 S -","- C30 H26 N2 O10 S2 -","2","1","NA0095","Olivato, Paulo R.; Guerrero, Sandra A.; Zukerman-Schpector, J.","Preferred conformations in the solid state of some α-(<i>p</i>-phenylsulfinyl)-<i>p</i>-substituted acetophenones","Acta Crystallographica Section B","2000","56","1","112","117","10.1107/S0108768199008599","","","0.71073","MoKα","","0.0507","0.0412","","0.1236","","0.1129","","","1.076","","","1.076","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2101992","13.7305","0.0005","14.9948","0.0006","19.4209","0.0009","90","","90","","90","","3998.5","0.3","294","1","294","1","","","","","","","","5","P c c n","-P 2ab 2ac","56","","Bis(2-aminoethyl)amine-4,4'-sulfonyldiphenol (1/3)","","- C40 H43 N3 O12 S3 -","- C40 H43 N3 O12 S3 -","- C160 H172 N12 O48 S12 -","4","0.5","NA0096","Glidewell, Christopher; Ferguson, George; Gregson, Richard M.; Campana, Charles F.","Supramolecular chemistry of amine‒phenol adducts; novel three-dimensional framework structures in adducts of bis(2-aminoethyl)amine with 4,4'-sulfonyldiphenol, 1,1,1-tris(4-hydroxyphenyl)ethane and 3,5-dihydroxybenzoic acid, and in the methanol-solvated adduct of tris(2-aminoethyl)amine with 4,4'-biphenol","Acta Crystallographica Section B","2000","56","1","68","84","10.1107/S0108768199009714","","","0.7107","MoKα","","0.0646","0.0391","","","","0.1077","","","","","","1.042","","","","has coordinates,has disorder,has Fobs","176768","2020-10-21","18:00:00",""
"2101993","10.7171","0.0009","11.2112","0.0011","15.5547","0.0019","101.069","0.009","92.924","0.009","97.291","0.009","1813.9","0.3","294","1","294","1","","","","","","","","4","P -1","-P 1","2","","Bis(2-aminoethyl)amine‒1,1,1-tris(4-hydroxyphenyl)ethane‒ methanol (1/4/1)","","- C85 H89 N3 O13 -","- C85 H85 N3 O13 -","- C85 H85 N3 O13 -","1","0.5","NA0096","Glidewell, Christopher; Ferguson, George; Gregson, Richard M.; Campana, Charles F.","Supramolecular chemistry of amine‒phenol adducts; novel three-dimensional framework structures in adducts of bis(2-aminoethyl)amine with 4,4'-sulfonyldiphenol, 1,1,1-tris(4-hydroxyphenyl)ethane and 3,5-dihydroxybenzoic acid, and in the methanol-solvated adduct of tris(2-aminoethyl)amine with 4,4'-biphenol","Acta Crystallographica Section B","2000","56","1","68","84","10.1107/S0108768199009714","","","0.71073","MoKα","","0.0851","0.0534","","","","0.1638","","","","","","1.092","","","","has coordinates,has disorder,has Fobs","176768","2020-10-21","18:00:00",""
"2101994","8.2469","0.0007","10.527","0.002","23.052","0.003","90","","98.144","0.009","90","","1981.1","0.5","294","1","294","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Bis(2-aminoethyl)amine-3,5-dihydroxybenzoic acid (1/2)","","- C18 H25 N3 O8 -","- C18 H25 N3 O8 -","- C72 H100 N12 O32 -","4","1","NA0096","Glidewell, Christopher; Ferguson, George; Gregson, Richard M.; Campana, Charles F.","Supramolecular chemistry of amine‒phenol adducts; novel three-dimensional framework structures in adducts of bis(2-aminoethyl)amine with 4,4'-sulfonyldiphenol, 1,1,1-tris(4-hydroxyphenyl)ethane and 3,5-dihydroxybenzoic acid, and in the methanol-solvated adduct of tris(2-aminoethyl)amine with 4,4'-biphenol","Acta Crystallographica Section B","2000","56","1","68","84","10.1107/S0108768199009714","","","0.71073","MoKα","","0.1528","0.0561","","","","0.0826","","","","","","0.831","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2101995","10.0041","0.0002","41.5502","0.0007","10.2715","0.0001","90","","112.746","0.001","90","","3937.52","0.11","293","1","293","1","","","","","","","","4","P 1 21 1","P 2yb","4","","Tris(2-aminoethyl)amine-4,4'-biphenol-methanol (1/3/1)","","- C86 H104 N8 O14 -","- C86 H104 N8 O14 -","- C172 H208 N16 O28 -","2","1","NA0096","Glidewell, Christopher; Ferguson, George; Gregson, Richard M.; Campana, Charles F.","Supramolecular chemistry of amine‒phenol adducts; novel three-dimensional framework structures in adducts of bis(2-aminoethyl)amine with 4,4'-sulfonyldiphenol, 1,1,1-tris(4-hydroxyphenyl)ethane and 3,5-dihydroxybenzoic acid, and in the methanol-solvated adduct of tris(2-aminoethyl)amine with 4,4'-biphenol","Acta Crystallographica Section B","2000","56","1","68","84","10.1107/S0108768199009714","","","0.71073","MoKα","","0.0837","0.0572","","","","0.1433","","","","","","1.047","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2101996","3.5024","0.0006","5.5209","0.0005","5.3789","0.0009","90","","90","","90","","104.01","0.03","30","","30","","","","","","","","","3","I m 2 m","I -2 -2","44","","Sodium Nitrite","","- N Na O2 -","- N Na O2 -","- N2 Na2 O4 -","2","0.25","OS0030","Gohda, Takashi","X-ray study of deformation density and spontaneous polarization in ferroelectric NaNO~2~","Acta Crystallographica Section B","2000","56","1","11","16","10.1107/S010876819901054X","","","0.71073","MoKα","","","0.014","","","","0.0215","","","","","","1.7937","","","","has coordinates","283803","2023-05-16","08:05:53",""
"2101997","9.732","0.003","13.328","0.004","7.654","0.003","90","","90","","90","","992.8","0.6","","","293","2","","","","","","","","3","P n a m","-P 2c 2n","62","","Rubidium Tetra Bromo Cobaltate","","- Br2 Co0.5 Rb -","- Br2 Co0.5 Rb -","- Br16 Co4 Rb8 -","8","1","SH0133","Friese, K.; Madariaga, G.; Breczewski, T.","Incommensurately modulated phase of Rb~2~CoBr~4~ at 295 and 200K","Acta Crystallographica Section B","2000","56","1","17","21","10.1107/S0108768199010629","","","0.71073","MoKα","","0.0778","0.0414","","","","0.1003","","","","","","0.81","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2101998","9.691","0.004","13.278","0.005","7.63","0.006","90","","90","","90","","981.8","0.9","200","","","","","","","","","","","3","P n a m","-P 2c 2n","62","","","","- Br4 Co Rb2 -","- Br4 Co Rb2 -","- Br16 Co4 Rb8 -","4","0.5","SH0133","Friese, K.; Madariaga, G.; Breczewski, T.","Incommensurately modulated phase of Rb~2~CoBr~4~ at 295 and 200K","Acta Crystallographica Section B","2000","56","1","17","21","10.1107/S0108768199010629","","","0.71073","MoKα","","0.0515","0.2971","","0.0375","","","","","1.77","0.88","0.88","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2101999","5.7827","0.0001","5.7827","0.0001","14.2702","0.0004","90","","90","","120","","413.259","0.015","10","","","","","","","","","","","4","R 3 c :H","R 3 -2""c","161","","lead hafnate titanate","","- Hf0.8 O3 Pb Ti0.2 -","- Hf0.8 O3 Pb Ti0.2 -","- Hf4.8 O18 Pb6 Ti1.2 -","6","0.333333","SH0134","Christophe Muller; Jean-Louis Baudour; Cédric Bedoya; Françoise Bouree; Jean-Louis Soubeyroux; Marc Roubin","Octahedral deformations and cationic displacements in the ferroelectric PbHf~0.8~Ti~0.2~O~3~: a neutron powder diffraction study from 10 to 770K","Acta Crystallographica Section B","2000","56","1","27","38","10.1107/S0108768199011453","","neutron","1.2251","neutron","","","","","","","","","","2.02","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2102000","5.7871","0.0001","5.7871","0.0001","14.2735","0.0004","90","","90","","120","","413.984","0.015","150","","","","","","","","","","","4","R 3 c :H","R 3 -2""c","161","","lead hafnate titanate","","- Hf0.8 O3 Pb Ti0.2 -","- Hf0.8 O3 Pb Ti0.2 -","- Hf4.8 O18 Pb6 Ti1.2 -","6","0.333333","SH0134","Christophe Muller; Jean-Louis Baudour; Cédric Bedoya; Françoise Bouree; Jean-Louis Soubeyroux; Marc Roubin","Octahedral deformations and cationic displacements in the ferroelectric PbHf~0.8~Ti~0.2~O~3~: a neutron powder diffraction study from 10 to 770K","Acta Crystallographica Section B","2000","56","1","27","38","10.1107/S0108768199011453","","neutron","1.2251","neutron","","","","","","","","","","2","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2102001","5.7943","0.0001","5.7943","0.0001","14.2742","0.0005","90","","90","","120","","415.035","0.018","290","","","","","","","","","","","4","R 3 c :H","R 3 -2""c","161","","lead hafnate titanate","","- Hf0.8 O3 Pb Ti0.2 -","- Hf0.8 O3 Pb Ti0.2 -","- Hf4.8 O18 Pb6 Ti1.2 -","6","0.333333","SH0134","Christophe Muller; Jean-Louis Baudour; Cédric Bedoya; Françoise Bouree; Jean-Louis Soubeyroux; Marc Roubin","Octahedral deformations and cationic displacements in the ferroelectric PbHf~0.8~Ti~0.2~O~3~: a neutron powder diffraction study from 10 to 770K","Acta Crystallographica Section B","2000","56","1","27","38","10.1107/S0108768199011453","","neutron","1.2251","neutron","","","","","","","","","","2.28","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2102002","5.8025","0.0002","5.8025","0.0002","14.2648","0.0004","90","","90","","120","","415.94","0.02","440","","","","","","","","","","","4","R 3 c :H","R 3 -2""c","161","","lead hafnate titanate","","- Hf0.8 O3 Pb Ti0.2 -","- Hf0.8 O3 Pb Ti0.2 -","- Hf4.8 O18 Pb6 Ti1.2 -","6","0.333333","SH0134","Christophe Muller; Jean-Louis Baudour; Cédric Bedoya; Françoise Bouree; Jean-Louis Soubeyroux; Marc Roubin","Octahedral deformations and cationic displacements in the ferroelectric PbHf~0.8~Ti~0.2~O~3~: a neutron powder diffraction study from 10 to 770K","Acta Crystallographica Section B","2000","56","1","27","38","10.1107/S0108768199011453","","neutron","1.2251","neutron","","","","","","","","","","3","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2102003","4.1072","0.0001","4.1072","0.0001","4.1072","0.0001","90","","90","","90","","69.285","0.003","520","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","lead hafnate titanate","","- Hf0.8 O3 Pb Ti0.2 -","- Hf0.8 O3 Pb Ti0.2 -","- Hf0.8 O3 Pb Ti0.2 -","1","0.0208333","SH0134","Christophe Muller; Jean-Louis Baudour; Cédric Bedoya; Françoise Bouree; Jean-Louis Soubeyroux; Marc Roubin","Octahedral deformations and cationic displacements in the ferroelectric PbHf~0.8~Ti~0.2~O~3~: a neutron powder diffraction study from 10 to 770K","Acta Crystallographica Section B","2000","56","1","27","38","10.1107/S0108768199011453","","neutron","1.2251","neutron","","","","","","","","","","2.37","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2102004","9.314","","9.314","","9.314","","90","","90","","90","","807.99","","","","","","","","","","","","","3","F m -3m","-F 4 2 3","","","","","- Cu6 O8 Pb -","- Cu6 O8 Pb -","- Cu24 O32 Pb4 -","4","","SH0137","Winkler, Björn; Chall, Michael; Pickard, Chris J.; Milman, Victor; White, Jim","Structure of Cu~6~PbO~8~","Acta Crystallographica Section B","2000","56","1","22","26","10.1107/S0108768199011015","","","0.71","Mo","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102005","8.623","","8.623","","8.623","","90","","90","","90","","641.2","","","","","","","","","","","","","3","F m -3m","-F 4 2 3","","","","","- Cu6 O8 Pb -","- Cu6 O8 Pb -","- Cu24 O32 Pb4 -","4","","SH0137","Winkler, Björn; Chall, Michael; Pickard, Chris J.; Milman, Victor; White, Jim","Structure of Cu~6~PbO~8~","Acta Crystallographica Section B","2000","56","1","22","26","10.1107/S0108768199011015","","","0.71","Mo","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102006","5.52","","5.52","","13.52","","90","","90","","120","","356.768","","","","","","","","","","","","","3","R -3 c","-R 3 2""c","","","","","- F Nb O2 -","- F3 Nb O3 -","- F18 Nb6 O18 -","6","","AD0088","Carlson, Stefan; Larsson, Ann-Kristin; Rohrer, Franziska E.","High-pressure transformations of NbO~2~F","Acta Crystallographica Section B","2000","56","2","189","196","10.1107/S0108768199015311","","","0.3738","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2102007","5.3067","0.0004","5.3067","0.0004","13.5495","0.0008","90","","90","","120","","330.45","0.04","","","","","","","","","","","","3","R -3 c","-R 3 2""c","","","","","- F Nb O2 -","- F3 Nb O3 -","- F18 Nb6 O18 -","6","","AD0088","Carlson, Stefan; Larsson, Ann-Kristin; Rohrer, Franziska E.","High-pressure transformations of NbO~2~F","Acta Crystallographica Section B","2000","56","2","189","196","10.1107/S0108768199015311","","","0.3738","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2102008","5.2357","0.0003","5.2357","0.0003","13.5542","0.0012","90","","90","","120","","321.78","0.04","","","","","","","","","","","","3","R -3 c","-R 3 2""c","","","","","- F Nb O2 -","- F3 Nb O3 -","- F18 Nb6 O18 -","6","","AD0088","Carlson, Stefan; Larsson, Ann-Kristin; Rohrer, Franziska E.","High-pressure transformations of NbO~2~F","Acta Crystallographica Section B","2000","56","2","189","196","10.1107/S0108768199015311","","","0.3738","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2102009","5.1232","0.0004","5.1232","0.0004","13.6017","0.0017","90","","90","","120","","309.18","0.05","","","","","","","","","","","","3","R -3 c","-R 3 2""c","","","","","- F Nb O2 -","- F3 Nb O3 -","- F18 Nb6 O18 -","6","","AD0088","Carlson, Stefan; Larsson, Ann-Kristin; Rohrer, Franziska E.","High-pressure transformations of NbO~2~F","Acta Crystallographica Section B","2000","56","2","189","196","10.1107/S0108768199015311","","","0.3738","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2102010","4.9462","0.0004","4.9462","0.0004","13.6689","0.0018","90","","90","","120","","289.61","0.05","","","","","","","","","","","","3","R -3 c","-R 3 2""c","","","","","- F Nb O2 -","- F3 Nb O3 -","- F18 Nb6 O18 -","6","","AD0088","Carlson, Stefan; Larsson, Ann-Kristin; Rohrer, Franziska E.","High-pressure transformations of NbO~2~F","Acta Crystallographica Section B","2000","56","2","189","196","10.1107/S0108768199015311","","","0.3738","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2102011","4.8552","0.0003","4.8552","0.0003","13.7","0.0014","90","","90","","120","","279.68","0.04","","","","","","","","","","","","3","R -3 c","-R 3 2""c","","","","","- F Nb O2 -","- F3 Nb O3 -","- F18 Nb6 O18 -","6","","AD0088","Carlson, Stefan; Larsson, Ann-Kristin; Rohrer, Franziska E.","High-pressure transformations of NbO~2~F","Acta Crystallographica Section B","2000","56","2","189","196","10.1107/S0108768199015311","","","0.3738","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2102012","4.8232","0.0003","4.8232","0.0003","13.7125","0.0018","90","","90","","120","","276.26","0.04","","","","","","","","","","","","3","R -3 c","-R 3 2""c","","","","","- F Nb O2 -","- F3 Nb O3 -","- F18 Nb6 O18 -","6","","AD0088","Carlson, Stefan; Larsson, Ann-Kristin; Rohrer, Franziska E.","High-pressure transformations of NbO~2~F","Acta Crystallographica Section B","2000","56","2","189","196","10.1107/S0108768199015311","","","0.3738","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2102013","6.98","0.001","8.915","0.002","11.566","0.002","90","","98.54","0.03","90","","711.7","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Acetaminophen","4-acetaminophenol","","- C8 H9 N O2 -","- C8 H9 N O2 -","- C32 H36 N4 O8 -","4","1","AV0025","Boldyreva, Elena V.; Shakhtshneider, Tatiana P.; Vasilchenko, Marina A.; Ahsbahs, Hans; Uchtmann, H.","Anisotropic crystal structure distortion of the monoclinic polymorph of acetaminophen at high hydrostatic pressures","Acta Crystallographica Section B","2000","56","2","299","309","10.1107/S0108768199013634","","","0.71073","MoKα","","0.1002","0.0352","","","","0.0532","","","","","","0.838","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102014","6.885","0.001","8.5819","0.0007","11.519","0.001","90","","99.12","0.01","90","","672.01","0.13","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Acetaminophen","4-acetaminophenol","","- C8 H9 N O2 -","- C8 H9 N O2 -","- C32 H36 N4 O8 -","4","1","AV0025","Boldyreva, Elena V.; Shakhtshneider, Tatiana P.; Vasilchenko, Marina A.; Ahsbahs, Hans; Uchtmann, H.","Anisotropic crystal structure distortion of the monoclinic polymorph of acetaminophen at high hydrostatic pressures","Acta Crystallographica Section B","2000","56","2","299","309","10.1107/S0108768199013634","","","0.71073","MoKα","","0.0859","0.0325","","","","0.0546","","","","","","0.919","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102015","6.82","0.001","8.374","0.001","11.559","0.001","90","","99.32","0.01","90","","651.43","0.14","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Acetaminophen","4-acetaminophenol","","- C8 H9 N O2 -","- C8 H9 N O2 -","- C32 H36 N4 O8 -","4","1","AV0025","Boldyreva, Elena V.; Shakhtshneider, Tatiana P.; Vasilchenko, Marina A.; Ahsbahs, Hans; Uchtmann, H.","Anisotropic crystal structure distortion of the monoclinic polymorph of acetaminophen at high hydrostatic pressures","Acta Crystallographica Section B","2000","56","2","299","309","10.1107/S0108768199013634","","","0.71073","MoKα","","0.0815","0.0308","","","","0.0481","","","","","","0.803","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102016","6.625","0.001","7.985","0.002","11.916","0.002","90","","99.41","0.03","90","","621.9","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Acetaminophen","4-acetaminophenol","","- C8 H9 N O2 -","- C8 H9 N O2 -","- C32 H36 N4 O8 -","4","1","AV0025","Boldyreva, Elena V.; Shakhtshneider, Tatiana P.; Vasilchenko, Marina A.; Ahsbahs, Hans; Uchtmann, H.","Anisotropic crystal structure distortion of the monoclinic polymorph of acetaminophen at high hydrostatic pressures","Acta Crystallographica Section B","2000","56","2","299","309","10.1107/S0108768199013634","","","0.71073","MoKα","","0.081","0.0312","","","","0.0632","","","","","","0.893","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102017","5.5267","0.0003","7.8824","0.0002","5.5245","0.0003","90","","90.294","0.001","90","","240.664","0.019","298","","298","","","","","","","","","3","P 1 2/m 1","-P 2y","10","","cerium niobium oxide","","- Ce0.33333 Nb O3 -","- Ce0.333335 Nb O3 -","- Ce1.33334 Nb4 O12 -","4","1","BR0090","Bridges, C.; Greedan, J. E.; Barbier, J.","Structure of the defect perovskite Ce~1/3~NbO~3~: a redetermination by electron and neutron powder diffraction","Acta Crystallographica Section B","2000","56","2","183","188","10.1107/S0108768199012951","","neutron","","neutron","","","","","","","","","","1.6","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102018","14.6241","0.0003","14.7393","0.0003","22.072","0.0004","72.2117","0.0007","73.3659","0.0008","70.2953","0.0007","4174.81","0.14","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C39.5 H64 Cs2 P2 -","- C39.5 H64 Cs2 P2 -","- C158 H256 Cs8 P8 -","4","2","BS0009","Rheingold, A. L.; Concolino, T. E.; Lam, K.-C.; Guzei, I. A.; Rabe, G. W.; Heise, H.","Two phases of {[CsPH(η^6^-2,4,6-<i>^t^</i>Bu~3~C~6~H~2~)]~2~(η^3^-toluene)~0.5~}~<i>x~</i>: their structures and interconversions","Acta Crystallographica Section B","2000","56","2","210","214","10.1107/S0108768199012677","","","0.71073","MoKα","","0.0517","0.0405","","","","0.1486","","","","","","1.173","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102019","14.2354","0.001","15.296","0.0014","18.747","0.0014","71.764","0.006","88.862","0.006","62.544","0.007","3402.7","0.6","294","1","294","1","","","","","","","","5","P -1","-P 1","2","","1,1,3,3,5,5-Hexaphenyltrisiloxane-1,5-diol‒pyrazine (4/1)","","- C148 H132 N2 O16 Si12 -","- C148 H132 N2 O16 Si12 -","- C148 H132 N2 O16 Si12 -","1","0.5","CF0008","O'Leary, Brian; Spalding, Trevor R.; Ferguson, George; Glidewell, Christopher","Oligosiloxanediols as building blocks for supramolecular chemistry: hydrogen-bonded adducts with amines form supramolecular structures in zero, one and two dimensions","Acta Crystallographica Section B","2000","56","2","273","286","10.1107/S0108768199013051","","","0.71073","MoKα","","0.0675","0.0401","","","","0.1203","","","","","","1.077","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2102020","10.7764","0.001","12.8122","0.0012","15.1733","0.0013","91.999","0.011","94.851","0.013","109.063","0.007","1968.6","0.3","294","1","294","1","","","","","","","","5","P -1","-P 1","2","","1,1,3,3,5,5-Hexaphenyltrisiloxane-1,5-diol‒pyridine (2/3)","","- C87 H79 N3 O8 Si6 -","- C87 H79 N3 O8 Si6 -","- C87 H79 N3 O8 Si6 -","1","0.5","CF0008","O'Leary, Brian; Spalding, Trevor R.; Ferguson, George; Glidewell, Christopher","Oligosiloxanediols as building blocks for supramolecular chemistry: hydrogen-bonded adducts with amines form supramolecular structures in zero, one and two dimensions","Acta Crystallographica Section B","2000","56","2","273","286","10.1107/S0108768199013051","","","0.71073","MoKα","","0.0821","0.0434","","","","0.1178","","","","","","1.055","","","","has coordinates,has disorder,has Fobs","176768","2020-10-21","18:00:00",""
"2102021","16.1555","0.0009","8.4622","0.001","21.8427","0.0016","90","","97.386","0.005","90","","2961.4","0.4","294","1","294","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,1,3,3-Tetraphenyldisiloxane-1,3-diol‒hexamethylenetetramine (1/1)","","- C30 H34 N4 O3 Si2 -","- C30 H34 N4 O3 Si2 -","- C120 H136 N16 O12 Si8 -","4","1","CF0008","O'Leary, Brian; Spalding, Trevor R.; Ferguson, George; Glidewell, Christopher","Oligosiloxanediols as building blocks for supramolecular chemistry: hydrogen-bonded adducts with amines form supramolecular structures in zero, one and two dimensions","Acta Crystallographica Section B","2000","56","2","273","286","10.1107/S0108768199013051","","","0.71073","MoKα","","0.1075","0.0443","","","","0.1156","","","","","","0.946","","","","has coordinates,has disorder,has Fobs","176768","2020-10-21","18:00:00",""
"2102022","8.9245","0.0008","10.19","0.0017","17.366","0.0019","99.57","0.02","100.519","0.013","93.8","0.03","1523.5","0.4","294","1","294","1","","","","","","","","5","P -1","-P 1","2","","1,1,3,3-Tetraphenyldisiloxane-1,3-diol‒2,2'-bipyridyl (1/1)","","- C34 H30 N2 O3 Si2 -","- C34 H30 N2 O3 Si2 -","- C68 H60 N4 O6 Si4 -","2","1","CF0008","O'Leary, Brian; Spalding, Trevor R.; Ferguson, George; Glidewell, Christopher","Oligosiloxanediols as building blocks for supramolecular chemistry: hydrogen-bonded adducts with amines form supramolecular structures in zero, one and two dimensions","Acta Crystallographica Section B","2000","56","2","273","286","10.1107/S0108768199013051","","","0.71073","MoKα","","0.0516","0.0365","","","","0.1166","","","","","","1.104","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2102023","8.8365","0.0008","10.8028","0.001","13.3231","0.0016","108.74","0.011","89.774","0.014","94.792","0.01","1199.8","0.2","294","1","294","1","","","","","","","","5","P -1","-P 1","2","","1,1,3,3-Tetraphenyldisiloxane-1,3-diol‒pyrazine (2/1)","","- C52 H48 N2 O6 Si4 -","- C52 H48 N2 O6 Si4 -","- C52 H48 N2 O6 Si4 -","1","0.5","CF0008","O'Leary, Brian; Spalding, Trevor R.; Ferguson, George; Glidewell, Christopher","Oligosiloxanediols as building blocks for supramolecular chemistry: hydrogen-bonded adducts with amines form supramolecular structures in zero, one and two dimensions","Acta Crystallographica Section B","2000","56","2","273","286","10.1107/S0108768199013051","","","0.71073","MoKα","","0.0806","0.0411","","","","0.1117","","","","","","1.038","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2102024","6.4469","0.0015","10.2837","0.0015","10.6088","0.0015","74.645","0.011","81.968","0.013","85.511","0.011","671","0.2","294","1","294","1","","","","","","","","5","P -1","-P 1","2","","1,1,3,3-Tetraphenyldisiloxane-1,3-diol‒pyridine (1/1)","","- C29 H27 N O3 Si2 -","- C29 H27 N O3 Si2 -","- C29 H27 N O3 Si2 -","1","0.5","CF0008","O'Leary, Brian; Spalding, Trevor R.; Ferguson, George; Glidewell, Christopher","Oligosiloxanediols as building blocks for supramolecular chemistry: hydrogen-bonded adducts with amines form supramolecular structures in zero, one and two dimensions","Acta Crystallographica Section B","2000","56","2","273","286","10.1107/S0108768199013051","","","0.71073","MoKα","","0.0489","0.0403","","","","0.1094","","","","","","1.069","","","","has coordinates,has disorder,has Fobs","176768","2020-10-21","18:00:00",""
"2102025","6.4358","0.0005","10.2497","0.0012","10.4056","0.001","76","0.007","84.438","0.009","86.372","0.012","662.32","0.11","294","1","294","1","","","","","","","","5","P -1","-P 1","2","","1,1,3,3-Tetraphenyldisiloxane-1,3-diol‒pyrimidine (1/1)","","- C28 H26 N2 O3 Si2 -","- C28 H26 N2 O3 Si2 -","- C28 H26 N2 O3 Si2 -","1","0.5","CF0008","O'Leary, Brian; Spalding, Trevor R.; Ferguson, George; Glidewell, Christopher","Oligosiloxanediols as building blocks for supramolecular chemistry: hydrogen-bonded adducts with amines form supramolecular structures in zero, one and two dimensions","Acta Crystallographica Section B","2000","56","2","273","286","10.1107/S0108768199013051","","","0.71073","MoKα","","0.0521","0.0423","","","","0.1311","","","","","","1.051","","","","has coordinates,has disorder,has Fobs","176768","2020-10-21","18:00:00",""
"2102026","7.3974","0.0003","9.6352","0.0004","10.1688","0.0003","64.872","0.002","72.375","0.002","76.612","0.002","620.92","0.04","100","1","100","1","","","","","","","","4","P -1","-P 1","2","","Benzene-1,2,4,5-tetracarboxylic acid‒4,4'-bipyridyl (1/2)","","- C30 H22 N4 O8 -","- C30 H22 N4 O8 -","- C30 H22 N4 O8 -","1","0.5","FR0006","Lough, Alan J.; Wheatley, Paul S.; Ferguson, George; Glidewell, Christopher","Hydrogen-bonding behaviour of benzene-1,2,4,5-tetracarboxylic acid: supramolecular structures of different dimensionality in the 2:1 adducts formed with 4,4'-bipyridyl and hexamethylenetetramine","Acta Crystallographica Section B","2000","56","2","261","272","10.1107/S0108768199012860","","","0.71073","MoKα","","0.0495","0.0378","","","","0.1076","","","","","","1.082","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102027","9.7029","0.0006","10.9369","0.0007","16.7647","0.0011","84.271","0.003","79.399","0.003","75.264","0.003","1688.55","0.19","100","1","100","1","","","","","","","","4","P -1","-P 1","2","","Benzeme-1,2,4,5-tetracarboxylic acid‒hexamethylenetetramine (1/2)","","- C22 H30 N8 O8 -","- C22 H30 N8 O8 -","- C66 H90 N24 O24 -","3","1.5","FR0006","Lough, Alan J.; Wheatley, Paul S.; Ferguson, George; Glidewell, Christopher","Hydrogen-bonding behaviour of benzene-1,2,4,5-tetracarboxylic acid: supramolecular structures of different dimensionality in the 2:1 adducts formed with 4,4'-bipyridyl and hexamethylenetetramine","Acta Crystallographica Section B","2000","56","2","261","272","10.1107/S0108768199012860","","","0.71073","MoKα","","0.1262","0.0482","","","","0.1142","","","","","","0.839","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102028","11.665","0.0012","44.933","0.005","5.432","0.006","87.034","0.01","100.17","0.09","89.09","0.09","2798","3","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C57 H104 O6 -","- C57 H104 O6 -","- C114 H208 O12 -","2","1","GS0001","Culot, Christine; Norberg, Bernadette; Evrard, Guy; Durant, Francois","Molecular analysis of the β-polymorphic form of trielaidin: crystal structure at low temperature","Acta Crystallographica Section B","2000","56","2","317","321","10.1107/S0108768199014020","","","1.54178","CuKα","","0.1417","0.1116","","0.2242","","0.2009","","","","","","1.197","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102029","11.1208","0.0008","11.1208","0.0008","8.0033","0.0007","90","","90","","90","","989.79","0.13","20","","20","","","","","","","","","4","I -4 2 m","I -4 2","121","ammonium tetraphenylborate","ammonium tetraphenylborate","","- C24 H24 B N -","- C24 H24 B N -","- C48 H48 B2 N2 -","2","0.125","KA0046","Steiner, Thomas; Mason, Sax A.","Short N^+^—H···Ph hydrogen bonds in ammonium tetraphenylborate characterized by neutron diffraction","Acta Crystallographica Section B","2000","56","2","254","260","10.1107/S0108768199012318","","neutron","0.8469","neutron","","0.0516","0.0382","","","","0.0659","","","","","","1.098","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2102030","11.2255","0.0015","11.2255","0.0015","8.0745","0.0013","90","","90","","90","","1017.5","0.3","293","","293","2","","","","","","","","4","I -4 2 m","I -4 2","121","ammonium tetraphenylborate","ammonium tetraphenylborate","","- C24 H24 B N -","- C24 H24 B N -","- C48 H48 B2 N2 -","2","0.125","KA0046","Steiner, Thomas; Mason, Sax A.","Short N^+^—H···Ph hydrogen bonds in ammonium tetraphenylborate characterized by neutron diffraction","Acta Crystallographica Section B","2000","56","2","254","260","10.1107/S0108768199012318","","neutron","0.8469","neutron","","0.0842","0.0694","","","","0.1155","","","","","","1.225","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2102031","9.126","0.005","9.126","0.005","6.718","0.002","90","0.009","90","0.009","120","0.01","484.5","0.4","293","","293","","","","","","","","","5","P 63/m","-P 6c","176","","","","- C4 H12 Cd Cl3 N -","- C12 Cd Cl3 N -","- C24 Cd2 Cl6 N2 -","2","0.166667","NA0098","Peral, I.; Madariaga, G.; Perez-Etxebarria, A.; Breczewski, T.","X-ray diffraction study of the phase transitions of (CH~3~)~4~NCdCl~3~ between 293 and 80K: a quantitative analysis of the ferroelastic domains distribution below 118K","Acta Crystallographica Section B","2000","56","2","215","225","10.1107/S0108768199013622","","","0.71073","MoKα","","0.107","0.045","","0.032","0.031","","","","0.665","0.87","0.87","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2102032","18.0527","0.0005","13.1074","0.0002","20.5723","0.0005","90","","108.252","0.0011","90","","4622.98","0.19","100","1","100","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3,6,9,16,19,22-Hexa-azatricyclo[22.2.2.211,14]triconta-1(26),11(29), 12,14(30),24,27-hexaene ‒ 4,4'-Sulfonyldiphenol (1/2)","","- C48 H58 N6 O8 S2 -","- C48 H58 N6 O8 S2 -","- C192 H232 N24 O32 S8 -","4","1","NA0100","Glidewell, Christopher; Ferguson, George; Lough, Alan J.; Gregson, Richard M.","3,6,9,16,19,22-Hexaazatricyclo[22.2.2.2^11,14^]triconta-1(26),11(29),12,14(30),24,27-hexaene, C~24~H~38~N~6~, as a building block in supramolecular chemistry: structures in two and three dimensions","Acta Crystallographica Section B","2000","56","2","287","298","10.1107/S0108768199014032","","","0.71073","MoKα","","0.0812","0.0495","","","","0.1337","","","","","","1.038","","","","has coordinates,has disorder","176768","2020-10-21","18:00:00",""
"2102033","12.3442","0.0004","7.6496","0.0003","29.1745","0.0009","90","","110.686","0.002","90","","2577.29","0.16","100","1","100","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3,6,9,16,19,22-Hexa-azatricyclo[22.2.2.211,14]triconta-1(26),11(29), 12,14(30),24,27-hexaene ‒ 4,4'-Biphenol ‒Water (1/3/2)","","- C60 H72 N6 O8 -","- C60 H71.9996 N6 O8 -","- C120 H143.999 N12 O16 -","2","0.5","NA0100","Glidewell, Christopher; Ferguson, George; Lough, Alan J.; Gregson, Richard M.","3,6,9,16,19,22-Hexaazatricyclo[22.2.2.2^11,14^]triconta-1(26),11(29),12,14(30),24,27-hexaene, C~24~H~38~N~6~, as a building block in supramolecular chemistry: structures in two and three dimensions","Acta Crystallographica Section B","2000","56","2","287","298","10.1107/S0108768199014032","","","0.71073","MoKα","","0.1037","0.0443","","","","0.1048","","","","","","0.844","","","","has coordinates,has disorder","176768","2020-10-21","18:00:00",""
"2102034","12.135","0.0005","12.135","0.0005","12.135","0.0005","90","","90","","90","","1786.98","0.13","173","2","173","2","","","","","","","Synthetic","5","P a -3","-P 2ac 2ab 3","205","aluminium potassium alum","","Alum-(K)","- Al H24 K O20 S2 -","- Al H24 K O20 S2 -","- Al4 H96 K4 O80 S8 -","4","0.166667","NA0101","Nyburg, Stanley C.; Steed, Jon W.; Aleksovska, Slobotka; Petrusevski, Vladimir M.","Structure of the alums. I. On the sulfate group disorder in the α-alums","Acta Crystallographica Section B","2000","56","2","204","209","10.1107/S0108768199014846","","","0.7107","MoKα","","0.0229","0.0222","","","","0.0631","","","","","","0.904","","","","has coordinates,has disorder","282536","2023-04-10","16:01:26",""
"2102035","12.164","0.0005","12.164","0.0005","12.164","0.0005","90","","90","","90","","1799.82","0.13","296","2","296","2","","","","","","","Synthetic","5","P a -3","-P 2ac 2ab 3","205","aluminium potassium alum","","Alum-(K)","- Al H24 K O20 S2 -","- Al H24 K O20 S2 -","- Al4 H96 K4 O80 S8 -","4","0.166667","NA0101","Nyburg, Stanley C.; Steed, Jon W.; Aleksovska, Slobotka; Petrusevski, Vladimir M.","Structure of the alums. I. On the sulfate group disorder in the α-alums","Acta Crystallographica Section B","2000","56","2","204","209","10.1107/S0108768199014846","","","0.7107","MoKα","","0.0278","0.0264","","","","0.0728","","","","","","0.92","","","","has coordinates,has disorder","282536","2023-04-10","16:01:26",""
"2102036","12.207","0.0005","12.207","0.0005","12.207","0.0005","90","","90","","90","","1818.98","0.13","173","2","173","2","","","","","","","Synthetic","5","P a -3","-P 2ac 2ab 3","205","Aluminium thallium alum","","Lanmuchangite","- Al H24 O20 S2 Tl -","- Al H24 O20 S2 Tl -","- Al4 H96 O80 S8 Tl4 -","4","0.166667","NA0101","Nyburg, Stanley C.; Steed, Jon W.; Aleksovska, Slobotka; Petrusevski, Vladimir M.","Structure of the alums. I. On the sulfate group disorder in the α-alums","Acta Crystallographica Section B","2000","56","2","204","209","10.1107/S0108768199014846","","","0.7107","MoKα","","0.0249","0.0231","","","","0.06","","","","","","1.301","","","","has coordinates,has disorder","282536","2023-04-10","16:01:26",""
"2102037","12.2305","0.0005","12.2305","0.0005","12.2305","0.0005","90","","90","","90","","1829.5","0.13","296","2","296","2","","","","","","","","5","P a -3","-P 2ac 2ab 3","205","aluminium thallium alum","","","- Al H24 O20 S2 Tl -","- Al H24 O20 S2 Tl -","- Al4 H96 O80 S8 Tl4 -","4","0.166667","NA0101","Nyburg, Stanley C.; Steed, Jon W.; Aleksovska, Slobotka; Petrusevski, Vladimir M.","Structure of the alums. I. On the sulfate group disorder in the α-alums","Acta Crystallographica Section B","2000","56","2","204","209","10.1107/S0108768199014846","","","0.7107","MoKα","","0.0296","0.0244","","","","0.0692","","","","","","1.066","","","","has coordinates,has disorder","282535","2023-04-10","15:58:54",""
"2102038","12.2133","0.0005","12.2133","0.0005","12.2133","0.0005","90","","90","","90","","1821.79","0.13","173","2","173","2","","","","","","","","5","P a -3","-P 2ac 2ab 3","205","chromium potassium alum","","","- Cr H24 K O20 S2 -","- Cr H24 K O20 S2 -","- Cr4 H96 K4 O80 S8 -","4","0.166667","NA0101","Nyburg, Stanley C.; Steed, Jon W.; Aleksovska, Slobotka; Petrusevski, Vladimir M.","Structure of the alums. I. On the sulfate group disorder in the α-alums","Acta Crystallographica Section B","2000","56","2","204","209","10.1107/S0108768199014846","","","0.7107","MoKα","","0.0445","0.0443","","","","0.1327","","","","","","1.13","","","","has coordinates,has disorder","282536","2023-04-10","16:01:26",""
"2102039","12.2305","0.0005","12.2305","0.0005","12.2305","0.0005","90","","90","","90","","1829.5","0.13","296","2","296","2","","","","","","","","5","P a -3","-P 2ac 2ab 3","205","chromium potassium alum","","","- Cr H24 K O20 S2 -","- Cr H24 K O20 S2 -","- Cr4 H96 K4 O80 S8 -","4","0.166667","NA0101","Nyburg, Stanley C.; Steed, Jon W.; Aleksovska, Slobotka; Petrusevski, Vladimir M.","Structure of the alums. I. On the sulfate group disorder in the α-alums","Acta Crystallographica Section B","2000","56","2","204","209","10.1107/S0108768199014846","","","0.7107","MoKα","","0.0465","0.0455","","","","0.1353","","","","","","1.11","","","","has coordinates,has disorder","282536","2023-04-10","16:01:26",""
"2102040","12.2679","0.0005","12.2679","0.0005","12.2679","0.0005","90","","90","","90","","1846.34","0.13","296","2","296","2","","","","","","","","5","P a -3","-P 2ac 2ab 3","205","gallium rubidium alum","","","- Ga H24 O20 Rb S2 -","- Ga H24 O20 Rb S2 -","- Ga4 H96 O80 Rb4 S8 -","4","0.166667","NA0101","Nyburg, Stanley C.; Steed, Jon W.; Aleksovska, Slobotka; Petrusevski, Vladimir M.","Structure of the alums. I. On the sulfate group disorder in the α-alums","Acta Crystallographica Section B","2000","56","2","204","209","10.1107/S0108768199014846","","","0.7107","MoKα","","0.0495","0.0423","","","","0.1016","","","","","","1.101","","","","has coordinates,has disorder","282536","2023-04-10","16:01:26",""
"2102041","12.2368","0.0005","12.2368","0.0005","12.2368","0.0005","90","","90","","90","","1832.33","0.13","296","2","296","2","","","","","","","","5","P a -3","-P 2ac 2ab 3","205","gallium thallium alum","","","- Ga H24 O20 S2 Tl -","- Ga H24 O20 S2 Tl -","- Ga4 H96 O80 S8 Tl4 -","4","0.166667","NA0101","Nyburg, Stanley C.; Steed, Jon W.; Aleksovska, Slobotka; Petrusevski, Vladimir M.","Structure of the alums. I. On the sulfate group disorder in the α-alums","Acta Crystallographica Section B","2000","56","2","204","209","10.1107/S0108768199014846","","","0.7107","MoKα","","0.0287","0.0226","","","","0.0639","","","","","","1.058","","","","has coordinates,has disorder","282536","2023-04-10","16:01:26",""
"2102042","18.153","0.007","15.456","0.008","15.251","0.004","102.81","0.02","113.13","0.019","99.9","0.03","3674","3","100","2","100","2","","","","","","","","3","P 1","P 1","1","b-cyclodextrin + 1,12-dodecanedioic acid complex","cyclomaltoheptaose + 1,12-dodecanedioic acid inclusion complex","","- C98.32 H223.88 O102.63 -","- C98.32 H176.43 O102.65 -","- C98.32 H176.43 O102.65 -","1","1","NS0001","Makedonopoulou, Stella; Mavridis, Irene M.","Structure of the inclusion complex of β-cyclodextrin with 1,12-dodecanedioic acid using synchrotron radiation data; a detailed dimeric β-cyclodextrin structure","Acta Crystallographica Section B","2000","56","2","322","331","10.1107/S0108768199014494","","","0.65","synchrotron","","0.0484","0.0474","","","","0.1376","","","","","","1.043","","","","has coordinates,has disorder","176768","2020-10-21","18:00:00",""
"2102043","18.22","0.003","15.488","0.003","15.409","0.003","102.903","0.006","113.122","0.005","99.708","0.005","3735.3","1.2","293","2","293","2","","","","","","","","3","P 1","P 1","1","b-cyclodextrin + 1,12-dodecanedioic acid complex","cyclomaltoheptaose + 1,12-dodecanedioic acid inclusion complex","","- C97.03 H209.44 O96.69 -","- C97.02 H157.07 O96.7 -","- C97.02 H157.07 O96.7 -","1","1","NS0001","Makedonopoulou, Stella; Mavridis, Irene M.","Structure of the inclusion complex of β-cyclodextrin with 1,12-dodecanedioic acid using synchrotron radiation data; a detailed dimeric β-cyclodextrin structure","Acta Crystallographica Section B","2000","56","2","322","331","10.1107/S0108768199014494","","","1.5418","CuKα","","0.097","0.0828","","","","0.2478","","","","","","1.041","","","","has coordinates,has disorder,has Fobs","176768","2020-10-21","18:00:00",""
"2102044","9.2706","0.0019","19.726","0.004","9.83","0.002","90","","111.83","0.03","90","","1668.7","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","trans-dichlorobistriphenylarsineplatinum(II)","","","- C36 H30 As2 Cl2 Pt -","- C36 H30 As2 Cl2 Pt -","- C72 H60 As4 Cl4 Pt2 -","2","0.5","NS0002","Johansson, Maria H.; Otto, Stefanus; Roodt, Andreas; Oskarsson, Åke","Packing effects on the geometry of neutral platinum(II) complexes due to solvate molecules: the structure of <i>trans</i>-dichlorobis(triphenylarsine)platinum(II)","Acta Crystallographica Section B","2000","56","2","226","233","10.1107/S0108768199014500","","","0.71073","MoKα","","0.0376","0.0262","","","","0.0608","","","","","","1.048","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102045","20.582","0.004","8.146","0.0016","23.491","0.005","90","","90","","90","","3938.5","1.4","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","trans-dichlorobistriphenylarsineplatinum(II)","","","- C38 H34 As2 Cl6 Pt -","- C38 H34 As2 Cl6 Pt -","- C152 H136 As8 Cl24 Pt4 -","4","0.5","NS0002","Johansson, Maria H.; Otto, Stefanus; Roodt, Andreas; Oskarsson, Åke","Packing effects on the geometry of neutral platinum(II) complexes due to solvate molecules: the structure of <i>trans</i>-dichlorobis(triphenylarsine)platinum(II)","Acta Crystallographica Section B","2000","56","2","226","233","10.1107/S0108768199014500","","","0.71073","MoKα","","0.0569","0.0316","","","","0.067","","","","","","1.201","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102046","9.3899","0.0019","9.5481","0.0019","11.931","0.002","109.7","0.03","108.26","0.03","98.77","0.03","915.6","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","trans-dichlorobistriphenylarsineplatinum(II)","","","- C38 H34 As2 Cl4 Pt -","- C38 H34 As2 Cl4 Pt -","- C38 H34 As2 Cl4 Pt -","1","0.5","NS0002","Johansson, Maria H.; Otto, Stefanus; Roodt, Andreas; Oskarsson, Åke","Packing effects on the geometry of neutral platinum(II) complexes due to solvate molecules: the structure of <i>trans</i>-dichlorobis(triphenylarsine)platinum(II)","Acta Crystallographica Section B","2000","56","2","226","233","10.1107/S0108768199014500","","","0.71073","MoKα","","0.052","0.039","","","","0.0976","","","","","","0.916","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102047","11.778","0.002","18.712","0.004","16.647","0.003","90","","104.78","0.03","90","","3547.4","1.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","trans-dichlorobistriphenylarsineplatinum(II)","","","- C39 H33 As2 Cl2 Pt -","- C39 H33 As2 Cl2 Pt -","- C156 H132 As8 Cl8 Pt4 -","4","1","NS0002","Johansson, Maria H.; Otto, Stefanus; Roodt, Andreas; Oskarsson, Åke","Packing effects on the geometry of neutral platinum(II) complexes due to solvate molecules: the structure of <i>trans</i>-dichlorobis(triphenylarsine)platinum(II)","Acta Crystallographica Section B","2000","56","2","226","233","10.1107/S0108768199014500","","","0.71073","MoKα","","0.0478","0.0303","","","","0.0652","","","","","","1.061","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2102048","9.0603","0.0011","10.6109","0.0013","9.4613","0.0014","90","","101.893","0.006","90","","890.1","0.2","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H16 N2 O4 S2 -","- C18 H16 N2 O4 S2 -","- C36 H32 N4 O8 S4 -","2","0.5","SE0270","Nagel, Norbert; Bock, Hans; Eller, Peter","Dimorphism and inclusion compounds of <i>N</i>,<i>N</i>'-di(benzenesulfonyl)-<i>p</i>-phenylenediamine","Acta Crystallographica Section B","2000","56","2","234","244","10.1107/S0108768199005790","","","0.71073","MoKα","","0.0451","0.0377","","0.1065","0.101","","","","1.053","1.08","1.08","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102049","10.6449","0.0006","6.451","0.0004","13.1061","0.0007","90","","96.195","0.004","90","","894.74","0.09","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H16 N2 O4 S2 -","- C18 H16 N2 O4 S2 -","- C36 H32 N4 O8 S4 -","2","0.5","SE0270","Nagel, Norbert; Bock, Hans; Eller, Peter","Dimorphism and inclusion compounds of <i>N</i>,<i>N</i>'-di(benzenesulfonyl)-<i>p</i>-phenylenediamine","Acta Crystallographica Section B","2000","56","2","234","244","10.1107/S0108768199005790","","","0.71073","MoKα","","0.0373","0.0327","","0.0886","0.085","","","","1.027","1.037","1.037","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102050","17.503","0.002","7.731","0.0009","15.188","0.002","90","","90","","90","","2055.2","0.4","150","2","150","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C21 H22 N2 O5 S2 -","- C21 H22 N2 O5 S2 -","- C84 H88 N8 O20 S8 -","4","0.5","SE0270","Nagel, Norbert; Bock, Hans; Eller, Peter","Dimorphism and inclusion compounds of <i>N</i>,<i>N</i>'-di(benzenesulfonyl)-<i>p</i>-phenylenediamine","Acta Crystallographica Section B","2000","56","2","234","244","10.1107/S0108768199005790","","","0.71073","MoKα","","0.0595","0.0422","","0.1136","0.1007","","","","1.04","1.073","1.073","","","","","has coordinates,has disorder","176768","2020-10-21","18:00:00",""
"2102051","8.4277","0.0015","13.0779","0.0014","13.401","0.002","116.532","0.006","97.1","0.02","90.425","0.015","1308.1","0.4","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H28 N2 O6 S4 -","- C22 H28 N2 O6 S4 -","- C44 H56 N4 O12 S8 -","2","1","SE0270","Nagel, Norbert; Bock, Hans; Eller, Peter","Dimorphism and inclusion compounds of <i>N</i>,<i>N</i>'-di(benzenesulfonyl)-<i>p</i>-phenylenediamine","Acta Crystallographica Section B","2000","56","2","234","244","10.1107/S0108768199005790","","","0.71073","MoKα","","0.0585","0.0507","","","","0.1459","","","","","","1.026","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102052","9.6772","0.0001","13.8988","0.0002","8.9432","0.0001","90","","96.322","0.001","90","","1195.56","0.03","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","(3-cyanopropyl)[(R)-1-phenylethylamine]cobaloxime","","- C20 H4 Co D27 N6 O4 -","- C20 H31 Co N6 O4 -","- C40 H62 Co2 N12 O8 -","2","1","SE0292","Ohhara, Takashi; Harada, Jun; Ohashi, Yuji; Tanaka, Ichiro; Kumazawa, Shintaro; Niimura, Nobuo","Direct observation of deuterium migration in crystalline-state reaction by single-crystal neutron diffraction. II. 3‒1 Photoisomerization of a cobaloxime complex","Acta Crystallographica Section B","2000","56","2","245","253","10.1107/S0108768199012008","","","0.71073","MoKα","","0.0292","0.0262","","","","0.0701","","","","","","1.007","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2102053","9.1579","0.0001","13.9694","0.0002","9.2757","0.0001","90","0.005","99.954","0.001","90","0.005","1168.78","0.02","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","(3-cyanopropyl)[(R)-1-phenylethylamine]cobaloxime","","- C20 H4 Co D27 N6 O4 -","- C19.9988 H30.9982 Co N5.9997 O4 -","- C39.9976 H61.9964 Co2 N11.9994 O8 -","2","1","SE0292","Ohhara, Takashi; Harada, Jun; Ohashi, Yuji; Tanaka, Ichiro; Kumazawa, Shintaro; Niimura, Nobuo","Direct Observation of Deuterium Migration in Crystalline-State Reaction by Single Crystal Neutron Diffraction II. 3-1 Photoisomerization of a Cobaloxime Complex","Acta Crystallographica, Section B","2000","56","2","245","253","10.1107/S0108768199012008","","","0.71073","MoKa","","0.0566","0.0471","","","","0.1177","","","0.976","1.072","1.072","","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2102054","9.1579","0.0001","13.9694","0.0002","9.2757","0.0001","90","0.005","99.954","0.001","90","0.005","1168.78","0.02","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","(3-cyanopropyl)[(R)-1-phenylethylamine]cobaloxime","","- C20 H4 Co D27 N6 O4 -","- C20 H3.7196 Co D24.9376 N6 O4 -","- C40 H7.4392 Co2 D49.8752 N12 O8 -","2","1","SE0292","Ohhara, Takashi; Harada, Jun; Ohashi, Yuji; Tanaka, Ichiro; Kumazawa, Shintaro; Niimura, Nobuo","Direct Observation of Deuterium Migration in Crystalline-State Reaction by Single Crystal Neutron Diffraction II. 3-1 Photoisomerization of a Cobaloxime Complex","Acta Crystallographica, Section B","2000","56","2","245","253","10.1107/S0108768199012008","","neutron","1.06","Neutron","","0.1076","0.1065","","","","0.2853","","","1.108","1.107","1.107","","","","","has coordinates,has disorder","176768","2020-10-21","18:00:00",""
"2102055","16.2219","0.0011","8.1468","0.0003","16.334","0.0007","90","","112.911","0.005","90","","1988.35","0.19","295","2","295","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C13 H10 O -","- C13 H10 O -","- C104 H80 O8 -","8","1","AN0561","Kutzke, Hartmut; Klapper, Helmut; Hammond, Robert B.; Roberts, Kevin J.","Metastable β-phase of benzophenone: independent structure determinations via X-ray powder diffraction and single crystal studies","Acta Crystallographica, Section B: Structural Science","2000","56","3","486","496","10.1107/S0108768100000355","","","1.54178","CuKα","","","","","","","","","","2.94","","","","","","","has coordinates","199441","2020-10-21","18:00:00",""
"2102056","16.2","0.004","8.104","0.001","16.248","0.004","90","","112.82","0.02","90","","1966.2","0.7","223","","223","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C13 H10 O -","- C13 H10 O -","- C104 H80 O8 -","8","1","AN0561","Kutzke, Hartmut; Klapper, Helmut; Hammond, Robert B.; Roberts, Kevin J.","Metastable β-phase of benzophenone: independent structure determinations via X-ray powder diffraction and single crystal studies","Acta Crystallographica, Section B: Structural Science","2000","56","3","486","496","10.1107/S0108768100000355","","","1.54178","CuKα","","","","","","","","","","","","","","","","","has coordinates","199439","2020-10-21","18:00:00",""
"2102057","13.3202","0.0007","12.7223","0.0006","7.05854","0.00003","90","","90","","90","","1196.17","0.08","293","","293","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","cis-diammine dibromide palladium(II)","","- Br2 H6 N2 Pd -","- Br2 H6 N2 Pd -","- Br16 H48 N16 Pd8 -","8","1","AV0024","Kirik, S. D.; Solovyov, L. A.; Blokhin, A. I.; Yakimov, I. S.","Structures of [Pd(NH~3~)~2~<i>X</i>~2~] and its chemical transformation in the solid state","Acta Crystallographica, Section B: Structural Science","2000","56","3","419","425","10.1107/S0108768100000252","","","1.5418","CuKα","","","","","","","","","","1.6","","","","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2102058","6.7854","0.0003","7.1057","0.0003","6.6241","0.0002","103.221","0.003","102.514","0.002","100.386","0.003","294.52","0.02","293","","293","","","","","","","","","4","P -1","-P 1","2","","trans-diammine dibromide palladium(II)","","- Br2 H6 N2 Pd -","- Br2 H6 N2 Pd -","- Br4 H12 N4 Pd2 -","2","1","AV0024","Kirik, S. D.; Solovyov, L. A.; Blokhin, A. I.; Yakimov, I. S.","Structures of [Pd(NH~3~)~2~<i>X</i>~2~] and its chemical transformation in the solid state","Acta Crystallographica, Section B: Structural Science","2000","56","3","419","425","10.1107/S0108768100000252","","","1.5418","CuKα","","","","","","","","","","1.96","","","","","","","has coordinates","209628","2020-10-21","18:00:00",""
"2102059","8.4315","0.0003","8.4206","0.0003","8.0916","0.0002","90","","90","","90","","574.49","0.04","293","","293","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","beta-trans-diammine dibromide palladium(II)","","- Br2 H6 N2 Pd -","- Br2 H6 N2 Pd -","- Br8 H24 N8 Pd4 -","4","0.5","AV0024","Kirik, S. D.; Solovyov, L. A.; Blokhin, A. I.; Yakimov, I. S.","Structures of [Pd(NH~3~)~2~<i>X</i>~2~] and its chemical transformation in the solid state","Acta Crystallographica, Section B: Structural Science","2000","56","3","419","425","10.1107/S0108768100000252","","","1.5418","CuKα","","","","","","","","","","1.89","","","","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2102060","13.906","0.0008","13.5035","0.0008","7.505","0.0004","90","","90","","90","","1409.29","0.09","293","","293","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","cis-diammine diiodide palladium(II)","","- H6 I2 N2 Pd -","- H6 I2 N2 Pd -","- H48 I16 N16 Pd8 -","8","1","AV0024","Kirik, S. D.; Solovyov, L. A.; Blokhin, A. I.; Yakimov, I. S.","Structures of [Pd(NH~3~)~2~<i>X</i>~2~] and its chemical transformation in the solid state","Acta Crystallographica, Section B: Structural Science","2000","56","3","419","425","10.1107/S0108768100000252","","","1.5418","CuKα","","","","","","","","","","1.81","","","","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2102061","8.8347","0.0005","8.841","0.0005","8.6081","0.0002","90","","90","","90","","672.36","0.05","293","","293","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","beta-trans-diammine diiodide palladium(II)","","- H6 I2 N2 Pd -","- H6 I2 N2 Pd -","- H24 I8 N8 Pd4 -","4","0.5","AV0024","Kirik, S. D.; Solovyov, L. A.; Blokhin, A. I.; Yakimov, I. S.","Structures of [Pd(NH~3~)~2~<i>X</i>~2~] and its chemical transformation in the solid state","Acta Crystallographica, Section B: Structural Science","2000","56","3","419","425","10.1107/S0108768100000252","","","1.5418","CuKα","","","","","","","","","","1.82","","","","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2102062","3.54807","0.00005","10.81599","0.00016","18.9943","0.0002","90","","90","","90","","728.92","","","","","","","","","","","","","4","P b c 21","P 2c -2b","29","","","","- C8 H4 Na2 O4 -","- C8 H4 Na2 O4 -","- C32 H16 Na8 O16 -","4","1","BK0069","Kaduk, James A.","Terephthalate salts: salts of monopositive cations","Acta Crystallographica Section B","2000","56","3","474","485","10.1107/S0108768199014718","","","1.14968","","","","","","","","","","","2.6","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102063","4.0053","0.0005","11.814","0.002","20.186","0.002","90","","90","","90","","955.17","","","","","","","","","","","","","4","P b c 21","P 2c -2b","29","","","","- C8 H16 N2 O4 -","- C8 H12 N2 O4 -","- C32 H48 N8 O16 -","4","1","BK0069","Kaduk, James A.","Terephthalate salts: salts of monopositive cations","Acta Crystallographica Section B","2000","56","3","474","485","10.1107/S0108768199014718","","","1.54063","","","","","","","","","","","2.71","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102064","10.561","0.004","3.944","0.0012","11.535","0.005","90","","113.08","0.03","90","","442","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","dipotassium terephthalate","","","- C8 H4 K2 O4 -","- C8 H4 K2 O4 -","- C16 H8 K4 O8 -","2","0.5","BK0069","Kaduk, James A.","Terephthalate salts: salts of monopositive cations","Acta Crystallographica Section B","2000","56","3","474","485","10.1107/S0108768199014718","","","0.71073","MoKα","","0.0336","0.0248","","","","0.0607","","","","","","1.074","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102065","18.825","0.004","3.77","0.0008","11.179","0.002","90","","94.56","0.03","90","","790.9","0.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C8 H5 K O4 -","- C8 H5 K O4 -","- C32 H20 K4 O16 -","4","0.5","BK0069","Kaduk, James A.","Terephthalate salts: salts of monopositive cations","Acta Crystallographica Section B","2000","56","3","474","485","10.1107/S0108768199014718","","","0.71073","MoKα","","0.0455","0.0302","","","","0.0715","","","","","","1.018","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102066","18.924","0.004","3.7967","0.0008","11.481","0.002","90","","98.04","0.03","90","","816.8","0.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C8 H9 N O4 -","- C8 H9 N O4 -","- C32 H36 N4 O16 -","4","0.5","BK0069","Kaduk, James A.","Terephthalate salts: salts of monopositive cations","Acta Crystallographica Section B","2000","56","3","474","485","10.1107/S0108768199014718","","","0.71073","MoKα","","0.0405","0.0293","","","","0.0755","","","","","","0.995","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102067","8.35918","0.00005","5.13212","0.00003","8.48489","0.00005","90","","93.1555","0.0004","90","","363.45","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H4 Li2 O4 -","- C2.5 H1.5 Li O2 -","- C10 H6 Li4 O8 -","4","1","BK0069","Kaduk, James A.","Terephthalate salts: salts of monopositive cations","Acta Crystallographica Section B","2000","56","3","474","485","10.1107/S0108768199014718","","","1.14968","","","","","","","","","","","1.42","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102068","5.5191","0.0001","5.5191","0.0001","3.9085","0.0005","90","","90","","90","","119.055","0.005","","","698","","","","","","","","","4","P 4 b m","P 4 -2ab","100","","sodium bismuth titanate","","- Bi0.5 Na0.5 O3 Ti -","- Bi0.5 Na0.5 O3 Ti -","- Bi Na O6 Ti2 -","2","0.25","BM0024","Jones, G. O.; Thomas, P. A.","The tetragonal phase of Na~0.5~Bi~0.5~TiO~3~ – a new variant of the perovskite structure","Acta Crystallographica Section B","2000","56","3","426","430","10.1107/S0108768100001166","","","1.595","","","","","","","","","","","0.069","","","","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2102069","16.008","0.002","15.004","0.002","7.2794","0.0007","90","","90","","90","","1748.4","0.4","293","2","293","2","","","","","","","","5","P b a m","-P 2 2ab","","","","","- H4 K3 Nd O17 Si6 -","- K3 Nd O20 Si6 -","- K12 Nd4 O80 Si24 -","4","0.5","BS0005","Haile, S. M.; Wuensch, B. J.","Structure, phase transitions and ionic conductivity of K~3~NdSi~6~O~15~·<i>x</i>H~2~O. I. α-K~3~NdSi~6~O~15~·2H~2~O and its polymorphs","Acta Crystallographica Section B","2000","56","3","335","348","10.1107/S0108768199015785","","","0.71073","MoKα","","0.0578","0.0528","","0.1571","","0.1562","","","1.016","","","1.016","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2102070","14.37","0.002","15.518","0.002","14.265","0.002","90","","90","","90","","3181","0.8","293","2","293","2","","","","","","","","4","B b 21 m","B -2 -2b","36","","","","- K3 Nd O15 Si6 -","- K3.5 Nd O15 Si6 -","- K28 Nd8 O120 Si48 -","8","1","BS0008","Haile, S. M.; Wuensch, B. J.","Structure, phase transitions and ionic conductivity of K~3~NdSi~6~O~15~·<i>x</i>H~2~O. II. Structure of β-K~3~NdSi~6~O~15~","Acta Crystallographica Section B","2000","56","3","349","362","10.1107/S0108768199015797","","","0.71073","MoKα","","0.0419","0.0416","","0.1178","","0.1174","","","1.129","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2102071","18.8492","0.001","18.8492","0.001","18.8492","0.001","90","","90","","90","","6697","0.6","100","2","100","2","","","","","","","","3","I 2 3","I 2 2 3","197","(C60)4(twin-TDAS)3","","","- C252 N12 S18 -","- C252 N12 S18 -","- C504 N24 S36 -","2","0.0833333","CF0010","Penicaud, Alain; Boubekeur, Kamal; Kotov, Alexander I.; Yagubskii, Eduard B.","Novel infinite three-dimensional network of neutral fullerene molecules in (C~60~)~8~(twin-TDAS)~6~","Acta Crystallographica Section B","2000","56","3","497","500","10.1107/S0108768199016560","","","0.71073","MoKα","","0.0637","0.0456","","0.1162","0.1045","","","","0.56","0.613","0.613","","","","","has coordinates,has Fobs","282213","2023-04-03","16:30:55",""
"2102072","10.033","0.002","7.9745","0.0016","29.552","0.006","90","","88.742","0.004","90","","2363.8","0.8","293","2","293","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","Arppe compound","","","- Bi24 Cl10 O31 -","- Bi24 Cl10 O31 -","- Bi48 Cl20 O62 -","2","0.5","JZ0008","Eggenweiler, U.; Keller, E.; Krämer, V.","Redetermination of the crystal structures of the `Arppe compound' Bi~24~O~31~Cl~10~ and the isomorphous Bi~24~O~31~Br~10~","Acta Crystallographica Section B","2000","56","3","431","437","10.1107/S0108768100000550","","","0.71073","MoKα","","0.1089","0.063","","","","0.1463","","","","","","0.9","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2102073","10.141","0.007","4.005","0.003","29.977","0.019","90","","90.197","0.012","90","","1217.5","1.5","293","2","293","2","","","","","","","","3","A 1 2/m 1","-A 2y","12","","","","- Bi24 Br10 O31 -","- Bi24 Br10 O31 -","- Bi24 Br10 O31 -","1","0.125","JZ0008","Eggenweiler, U.; Keller, E.; Krämer, V.","Redetermination of the crystal structures of the `Arppe compound' Bi~24~O~31~Cl~10~ and the isomorphous Bi~24~O~31~Br~10~","Acta Crystallographica Section B","2000","56","3","431","437","10.1107/S0108768100000550","","","0.71073","MoKα","","0.1074","0.064","","","","0.1862","","","","","","0.913","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102074","6.2321","0.0003","9.9264","0.0006","12.812","0.0008","90","","97.079","0.005","90","","786.54","0.08","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","2-Oxa-4-androsten-3,17-dione","2-Oxa-4-androsten-3,17-dione","","- C18 H24 O3 -","- C18 H24 O3 -","- C36 H48 O6 -","2","1","KA0049","Anthony, Addlagatta; Jaskólski, Mariusz; Nangia, Ashwini","Crystal chemistry of some synthetic 2-oxa-steroids: conformation, packing motifs and isostructurality","Acta Crystallographica Section B","2000","56","3","512","525","10.1107/S0108768199015542","","","1.54178","CuKα","","0.0412","0.0342","","","","0.0919","","","","","","1.056","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102075","6.318","0.0004","6.4489","0.0005","38.841","0.003","90","","90","","90","","1582.5","0.2","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","2-Oxa-5-alpha-androstane-3,17-dione","2-Oxa-5-alpha-androstane-3,17-dione","","- C18 H26 O3 -","- C18 H26 O3 -","- C72 H104 O12 -","4","1","KA0049","Anthony, Addlagatta; Jaskólski, Mariusz; Nangia, Ashwini","Crystal chemistry of some synthetic 2-oxa-steroids: conformation, packing motifs and isostructurality","Acta Crystallographica Section B","2000","56","3","512","525","10.1107/S0108768199015542","","","1.54178","CuKα","","0.037","0.0307","","","","0.0886","","","","","","1.045","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102076","14.241","0.002","9.4401","0.0009","11.648","0.002","90","","90","","90","","1565.9","0.4","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","17-Hydroxy-2-oxaandrost-4-ene-3-one","17-Hydroxy-2-oxaandrost-4-ene-3-one","","- C18 H26 O3 -","- C18 H26 O3 -","- C72 H104 O12 -","4","1","KA0049","Anthony, Addlagatta; Jaskólski, Mariusz; Nangia, Ashwini","Crystal chemistry of some synthetic 2-oxa-steroids: conformation, packing motifs and isostructurality","Acta Crystallographica Section B","2000","56","3","512","525","10.1107/S0108768199015542","","","1.54178","CuKα","","0.034","0.0305","","","","0.0959","","","","","","1.068","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102077","6.2214","0.0007","12.05","0.001","10.888","0.001","90","","103.07","0.01","90","","795.1","0.14","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","6alpha-hydroxy-2-oxaandrost-4-ene-3,17-dione","6alpha-hydroxy-2-oxaandrost-4-ene-3,17-dione","","- C18 H24 O4 -","- C18 H24 O4 -","- C36 H48 O8 -","2","1","KA0049","Anthony, Addlagatta; Jaskólski, Mariusz; Nangia, Ashwini","Crystal chemistry of some synthetic 2-oxa-steroids: conformation, packing motifs and isostructurality","Acta Crystallographica Section B","2000","56","3","512","525","10.1107/S0108768199015542","","","1.54178","CuKα","","0.0377","0.0359","","0.1052","0.1013","","","","1.073","1.075","1.075","","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102078","6.335","0.001","9.482","0.001","27.245","0.006","90","","90","","90","","1636.6","0.5","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","6-hydroxy-2-oxa-5beta-androstane-3,17-dione","6-hydroxy-2-oxa-5beta-androstane-3,17-dione","","- C18 H26 O4 -","- C18 H26 O4 -","- C72 H104 O16 -","4","1","KA0049","Anthony, Addlagatta; Jaskólski, Mariusz; Nangia, Ashwini","Crystal chemistry of some synthetic 2-oxa-steroids: conformation, packing motifs and isostructurality","Acta Crystallographica Section B","2000","56","3","512","525","10.1107/S0108768199015542","","","1.54178","CuKα","","0.115","0.0344","","","","0.1042","","","","","","0.982","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102079","9.3361","0.0007","9.6261","0.0007","17.764","0.002","90","","90","","90","","1596.5","0.2","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","6,17-dihydroxy-2-oxaandrost-4-ene-3-one","6,17-dihydroxy-2-oxaandrost-4-ene-3-one","","- C18 H26 O4 -","- C18 H26 O4 -","- C72 H104 O16 -","4","1","KA0049","Anthony, Addlagatta; Jaskólski, Mariusz; Nangia, Ashwini","Crystal chemistry of some synthetic 2-oxa-steroids: conformation, packing motifs and isostructurality","Acta Crystallographica Section B","2000","56","3","512","525","10.1107/S0108768199015542","","","1.54178","CuKα","","0.0351","0.0305","","0.1024","0.0859","","","","1.058","1.059","1.059","","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102080","6.2246","0.0007","12.014","0.001","10.915","0.001","90","","103.09","0.01","90","","795.04","0.14","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","2-Oxa-4-androsten-3,17-dione and 2-Oxa-6beta-hydroxy-4-androsten-3,17-dione","2-Oxa-4-androsten-3,17-dione and 2-Oxa-6beta-hydroxy-4-androsten-3,17-dione","","- C18 H24 O4 -","- C18 H23.721 O3.721 -","- C36 H47.442 O7.442 -","2","1","KA0049","Anthony, Addlagatta; Jaskólski, Mariusz; Nangia, Ashwini","Crystal chemistry of some synthetic 2-oxa-steroids: conformation, packing motifs and isostructurality","Acta Crystallographica Section B","2000","56","3","512","525","10.1107/S0108768199015542","","","1.54178","CuKα","","0.0334","0.0321","","","","0.088","","","","","","1.039","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2102081","5.2945","0.0009","6.542","0.002","32.744","0.005","90","0.02","90.2","0.02","89.78","0.02","1134.1","0.4","293","","","","","","","","","","","3","P -1","-P 1","2","","","","- O62 P4 W18 -","- O62 P4 W18 -","- O62 P4 W18 -","1","0.5","LC0016","Pascal Roussel; Philippe Labbe; Daniel Groult","Symmetry and twins in the monophosphate tungsten bronze series (PO~2~)~4~(WO~3~)~2<i>m~</i> (2 {łeq} <i>m</i> {łeq} 14)","Acta Crystallographica Section B","2000","56","3","377","391","10.1107/S0108768199016195","","","0.71073","MoKα","","0.0572","0.0572","","0.0468","","0.0468","","","2.79","2.79","2.79","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102082","10.108","0.0004","10.108","0.0004","10.108","0.0004","90","","90","","90","","1032.75","0.12","293","","293","","","","","","","","","3","P 21 3","P 2ac 2ab 3","198","","","","- Cu7 P Se6 -","- Cu7 P Se6 -","- Cu28 P4 Se24 -","4","0.333333","LC0017","Gaudin, E.; Boucher, F.; Petricek, V.; Taulelle, F.; Evain, M.","Structures and phase transitions of the <i>A</i>~7~PSe~6~ (<i>A</i>~=~Ag, Cu) argyrodite-type ionic conductors. II. β- and γ-Cu~7~PSe~6~","Acta Crystallographica Section B","2000","56","3","402","408","10.1107/S0108768199016614","","","0.5609","AgKα","","0.0297","0.0297","","0.0317","","0.0317","","","0.8","","","0.8","","","","has coordinates,has disorder","282068","2023-03-26","10:12:31",""
"2102083","10.113","0.001","10.113","0.001","10.113","0.001","90","","90","","90","","1034.28","0.18","353","","353","","","","","","","","","3","F -4 3 m","F -4 2 3","216","","","","- Cu7 P Se6 -","- Cu6.996 P Se6 -","- Cu27.984 P4 Se24 -","4","0.0416667","LC0017","Gaudin, E.; Boucher, F.; Petricek, V.; Taulelle, F.; Evain, M.","Structures and phase transitions of the <i>A</i>~7~PSe~6~ (<i>A</i>~=~Ag, Cu) argyrodite-type ionic conductors. II. β- and γ-Cu~7~PSe~6~","Acta Crystallographica Section B","2000","56","3","402","408","10.1107/S0108768199016614","","","0.71073","MoKα","","0.0201","0.0201","","0.0245","","0.0245","","","1.09","","","1.09","","","","has coordinates","282068","2023-03-26","10:12:31",""
"2102084","9.0964","0.0009","12.2225","0.0011","6.3447","0.0007","90","","106.295","0.007","90","","677.07","0.12","9.5","0.2","9.5","0.2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","Ammonium copper Tutton salt","","","- Cu H20 N2 O14 S2 -","- Cu H20 N2 O14 S2 -","- Cu2 H40 N4 O28 S4 -","2","0.5","TA0006","Figgis, Brian N.; Sobolev, Alexandre N.; Simmons, Charles J.; Hitchman, Michael A.; Stratemeier, Horst; Riley, Mark J.","Bonding effects and the crystal structures of (NH~4~)~2~[Cu(H~2~O)~6~](SO~4~)~2~ and its H~2~^18^O substituted form at 9.5K","Acta Crystallographica Section B","2000","56","3","438","443","10.1107/S0108768100000963","","","0.71073","MoKα","","0.0226","0.0213","","","","0.0597","","","","","","1.122","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2102085","9.0921","0.0006","12.2195","0.0008","6.3442","0.0005","90","","106.277","0.005","90","","676.59","0.08","9.5","0.2","9.5","0.2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","Ammonium copper Tutton salt (18-O water)","","","- Cu H20 N2 O14 S2 -","- Cu H20 N2 O14 S2 -","- Cu2 H40 N4 O28 S4 -","2","0.5","TA0006","Figgis, Brian N.; Sobolev, Alexandre N.; Simmons, Charles J.; Hitchman, Michael A.; Stratemeier, Horst; Riley, Mark J.","Bonding effects and the crystal structures of (NH~4~)~2~[Cu(H~2~O)~6~](SO~4~)~2~ and its H~2~^18^O substituted form at 9.5K","Acta Crystallographica Section B","2000","56","3","438","443","10.1107/S0108768100000963","","","0.71073","MoKα","","0.0208","0.0199","","","","0.054","","","","","","1.184","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2102086","40.68","0.07","40.68","0.07","12.546","0.001","90","","90","","120","","17980","4","293","2","293","2","","","","","","","","3","P 63/m","-P 6c","176","","","","- Al477.44 Cr63.42 Fe51.42 -","- Al477.44 Cr63.42 Fe51.42 -","- Al954.88 Cr126.84 Fe102.84 -","2","0.166667","ZH0020","Mo, Z.M.; Zhou, H.Y.; Kuo, K.H.","Structure of ν-Al~80.61~Cr~10.71~Fe~8.68~, a giant hexagonal approximant of a quasicrystal determined by a combination of electron microscopy and X-ray diffraction","Acta Crystallographica Section B","2000","56","3","392","401","10.1107/S0108768199015761","","","0.71069","MoKα","","0.125","0.0747","","","","0.2068","","","","","","1.085","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102087","3.9883","0.0002","3.9883","0.0002","3.9883","0.0002","90","","90","","90","","63.44","0.006","298","","","","","","","","","","","3","P m -3 m","-P 4 2 3","221","","","","- K O3 Ta -","- K O3 Ta -","- K O3 Ta -","1","0.0208333","BR0094","Zhurova, Elizabeth A.; Ivanov, Yury; Zavodnik, Valery; Tsirelson, Vladimir","Electron density and atomic displacements in KTaO~3~","Acta Crystallographica Section B","2000","56","4","594","600","10.1107/S0108768100003906","","","0.71069","MoKα","","","0.0043","","","","0.0053","","","","","","1.05","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102088","7.984","0.002","9.535","0.003","18.352","0.005","90","","90","","90","","1397.1","0.7","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C13 H19 N3 O6 -","- C13 H19 N3 O6 -","- C52 H76 N12 O24 -","4","1","BS0010","Pichon-Pesme, Virginie; Lachekar, Hassane; Souhassou, Mohamed; Lecomte, Claude","Electron density and electrostatic properties of two peptide molecules: tyrosyl-glycyl-glycine monohydrate and glycyl-aspartic acid dihydrate","Acta Crystallographica Section B","2000","56","4","728","737","10.1107/S0108768100004390","","","0.7107","MoKα","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102089","9.659","0.001","9.672","0.001","10.739","0.001","90","","90","","90","","1003.26","0.17","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C6 H14 N2 O7 -","- C6 H14 N2 O7 -","- C24 H56 N8 O28 -","4","1","BS0010","Pichon-Pesme, Virginie; Lachekar, Hassane; Souhassou, Mohamed; Lecomte, Claude","Electron density and electrostatic properties of two peptide molecules: tyrosyl-glycyl-glycine monohydrate and glycyl-aspartic acid dihydrate","Acta Crystallographica Section B","2000","56","4","728","737","10.1107/S0108768100004390","","","0.7107","MoKα","","","","","","","","","","","","","","","","","has coordinates","191100","2020-10-21","18:00:00",""
"2102090","5.202","0.001","5.202","0.001","8.647","0.002","90","0.03","90","0.03","120","0.03","202.65","0.09","573","","","","","","","","","","","4","P 63","P 6c","173","","","","- K Li O4 S -","- K0.999999 Li0.999999 O4 S0.999999 -","- K2 Li2 O8 S2 -","2","0.333333","CA0003","Pinheiro, Carlos Basílio; Pimenta, Marcos Assunção; Chapuis, Gervais; Speziali, Nivaldo Lúcio","Analysis of LiKSO~4~ crystals in the temperature range from 573 to 943K","Acta Crystallographica Section B","2000","56","4","607","617","10.1107/S0108768100003219","","","0.71073","MoKα","","0.0223","0.0202","","0.0264","0.0263","","","","2.24","2.35","2.35","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2102091","5.264","0.004","9.148","0.003","8.666","0.004","90","0.04","90","0.05","90","0.04","417.3","0.4","723","","","","","","","","","","","4","P m c n","-P 2n 2a","62","","","","- K Li O4 S -","- K Li O4 S -","- K4 Li4 O16 S4 -","4","0.5","CA0003","Pinheiro, Carlos Basílio; Pimenta, Marcos Assunção; Chapuis, Gervais; Speziali, Nivaldo Lúcio","Analysis of LiKSO~4~ crystals in the temperature range from 573 to 943K","Acta Crystallographica Section B","2000","56","4","607","617","10.1107/S0108768100003219","","","0.71073","MoKα","","0.0685","0.0554","","0.063","0.0626","","","","3.55","4.06","4.06","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2102092","5.27","0.002","9.193","0.002","8.751","0.002","90","","90","","90","","424","0.2","803","","","","","","","","","","","4","P m c n","-P 2n 2a","62","","","","- K Li O4 S -","- K Li O4 S -","- K4 Li4 O16 S4 -","4","0.5","CA0003","Pinheiro, Carlos Basílio; Pimenta, Marcos Assunção; Chapuis, Gervais; Speziali, Nivaldo Lúcio","Analysis of LiKSO~4~ crystals in the temperature range from 573 to 943K","Acta Crystallographica Section B","2000","56","4","607","617","10.1107/S0108768100003219","","","0.71073","MoKα","","0.0856","0.0593","","0.0647","0.0639","","","","2.95","3.63","3.63","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2102093","10.231","0.003","12.878","0.004","16.804","0.002","92.39","0.02","104.31","0.02","106.17","0.03","2045.9","1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Tetrakis-μ-decylcarboxylato-bis(dodecylnicotinato)-dicopper (II)","","- C76 H134 Cu2 N2 O12 -","- C76 H134 Cu2 N2 O12 -","- C76 H134 Cu2 N2 O12 -","1","0.5","CA0004","Rusjan, Marcia; Chaia, Zulema D.; Piro, Oscar E.; Guillon, Daniel; Cukiernik, Fabio D.","Synthesis, structure and magnetic properties of tetrakis-μ-carboxylato-bis(dodecylnicotinato)dicopper(II) complexes; crystal and molecular structure of the decyl carboxylate derivative","Acta Crystallographica Section B","2000","56","4","666","672","10.1107/S0108768100002056","","","0.71073","MoKα","","0.0799","0.0504","","0.1504","","0.1295","","","1.053","","","1.086","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102094","13.799","0.002","13.799","0.002","10.876","0.002","90","","90","","90","","2070.9","0.6","168","2","168","2","","","","","","","","3","I -4","I -4","82","2-Methylpyrazine","pyrazine, 2-methyl","","- C5 H6 N2 -","- C5 H6 N2 -","- C80 H96 N32 -","16","2","CF0007","Boese, Roland; Gehrke, Annette; Kapon, Moshe; Herbstein, Frank H.","Determining the crystal structure of twinned 2-methylpyrazine","Acta Crystallographica Section B","2000","56","4","677","681","10.1107/S0108768199016547","","","0.71073","MoKα","","0.0226","0.0213","","","","0.0501","","","","","","1.057","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102095","13.725","0.002","13.725","0.002","10.859","0.002","90","","90","","90","","2045.6","0.6","123","2","123","2","","","","","","","","3","I -4","I -4","82","2-Methylpyrazine","pyrazine, 2-methyl","","- C5 H6 N2 -","- C5 H6 N2 -","- C80 H96 N32 -","16","2","CF0007","Boese, Roland; Gehrke, Annette; Kapon, Moshe; Herbstein, Frank H.","Determining the crystal structure of twinned 2-methylpyrazine","Acta Crystallographica Section B","2000","56","4","677","681","10.1107/S0108768199016547","","","0.71073","MoKα","","0.027","0.0257","","","","0.0679","","","","","","1.082","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102096","14.6861","0.0004","13.9799","0.0003","16.7063","0.0005","90","","90","","90","","3429.97","0.16","298","2","298","2","","","","","","","","3","P b c n","-P 2n 2ab","60","meta-schoepite","","","- H16 O20 U4 -","- O20 U4 -","- O160 U32 -","8","1","CF0009","Weller, Mark T.; Light, Mark E.; Gelbrich, Thomas","Structure of uranium(VI) oxide dihydrate, UO~3~·2H~2~O; synthetic <i>meta</i>-schoepite (UO~2~)~4~O(OH)~6~·5H~2~O","Acta Crystallographica Section B","2000","56","4","577","583","10.1107/S0108768199016559","","","0.71073","MoKα","","0.0906","0.0482","","","","0.1035","","","","","","0.951","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2102097","5.3893","0.0012","9.3851","0.0013","12.3681","0.0009","107.054","0.009","98.569","0.012","97.303","0.014","581.65","0.17","293","2","293","2","","","","","","","","4","P 1","P 1","1","L-histidine complexed with maleic acid","","","- C10 H13 N3 O6 -","- C10 H13 N3 O6 -","- C20 H26 N6 O12 -","2","2","HA0195","J.V. Pratap; R. Ravishankar; M.Vijayan","X-ray studies on crystalline complexes involving amino acids and peptides. XXXV. Invariance and variability in amino acid aggregation in the complexes of maleic acid with <small>L</small>-histidine and <small>L</small>-lysine","Acta Crystallographica Section B","2000","56","4","690","696","10.1107/S0108768100002202","","","1.5418","CuKα","","0.0527","0.0512","","0.1686","","0.1473","","","1.069","","","1.047","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102098","9.854","0.004","7.136","0.002","9.7388","0.0001","90","","115.887","0.012","90","","616.1","0.3","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","L-lysine complexed with maleic acid","","","- C10 H18 N2 O6 -","- C10 H18 N2 O6 -","- C20 H36 N4 O12 -","2","1","HA0195","J.V. Pratap; R. Ravishankar; M.Vijayan","X-ray studies on crystalline complexes involving amino acids and peptides. XXXV. Invariance and variability in amino acid aggregation in the complexes of maleic acid with <small>L</small>-histidine and <small>L</small>-lysine","Acta Crystallographica Section B","2000","56","4","690","696","10.1107/S0108768100002202","","","0.7093","MoKα","","0.1163","0.0573","","0.1689","0.1351","","","","1.064","1.053","1.053","","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102099","10.0507","0.0005","14.2016","0.0008","8.7281","0.0008","90","","125.123","0.005","90","","1018.97","0.14","","","","","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- Al1.5 H9.4 N1.19 Na0.13 O10.32 Si2.5 -","- H3.808 N0.952 Na0.104 O8.256 Si3.2 -","- H19.04 N4.76 Na0.52 O41.28 Si16 -","5","1.25","NA0099","Gualtieri, A. F.","Study of NH~4~^+^ in the zeolite phillipsite by combined synchrotron powder diffraction and IR spectroscopy","Acta Crystallographica Section B","2000","56","4","584","593","10.1107/S0108768100002032","","","1.00473","x-raysynchrotron","","","","","","","","","","6.14","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2102100","10.0122","0.0008","14.1943","0.0012","8.7284","0.0017","90","","125.024","0.011","90","","1015.8","0.3","","","","","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- Al1.2 H8.8 N Na0.1 O10.4 Si3 -","- H4.04 N1.01 Na0.1 O10.37 Si4 -","- H16.16 N4.04 Na0.4 O41.48 Si16 -","4","1","NA0099","Gualtieri, A. F.","Study of NH~4~^+^ in the zeolite phillipsite by combined synchrotron powder diffraction and IR spectroscopy","Acta Crystallographica Section B","2000","56","4","584","593","10.1107/S0108768100002032","","","1.00473","x-raysynchrotron","","","","","","","","","","11.34","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2102101","9.9596","0.0003","14.2015","0.0004","8.7051","0.0005","90","","124.99","0.003","90","","1008.71","0.08","","","","","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- Al0.96 H8 N0.85 Na0.1 O10.3 Si3 -","- H4.53333 N1.13333 Na0.133333 O14.12 Si5.33333 -","- H13.6 N3.4 Na0.4 O42.36 Si16 -","3","0.75","NA0099","Gualtieri, A. F.","Study of NH~4~^+^ in the zeolite phillipsite by combined synchrotron powder diffraction and IR spectroscopy","Acta Crystallographica Section B","2000","56","4","584","593","10.1107/S0108768100002032","","","1.00473","x-raysynchrotron","","","","","","","","","","2.68","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2102102","7.537","0.001","10.183","0.001","20.843","0.001","90","","94.93","0.01","90","","1593.8","0.3","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C29 H44 O10 Si -","- C29 H44 O10 Si -","- C58 H88 O20 Si2 -","2","1","NS0003","Dillen, Jan L.M.; Bredenkamp, Martin W.; Prinsloo, Mare-Loe","Single crystal structure and molecular dynamics analysis of a <i>myo</i>-inositol derivative","Acta Crystallographica Section B","2000","56","4","738","743","10.1107/S0108768100005309","","","0.7107","MoKα","","0.0742","0.0513","","","","0.1281","","","","","","1.027","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102103","7.5722","0.0004","10.2402","0.0005","21.1352","0.0009","90","","96.188","0.002","90","","1629.29","0.14","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C29 H44 O10 Si -","- C29 H44 O10 Si -","- C58 H88 O20 Si2 -","2","1","NS0003","Dillen, Jan L.M.; Bredenkamp, Martin W.; Prinsloo, Mare-Loe","Single crystal structure and molecular dynamics analysis of a <i>myo</i>-inositol derivative","Acta Crystallographica Section B","2000","56","4","738","743","10.1107/S0108768100005309","","","0.7107","MoKα","","0.0839","0.0726","","","","0.198","","","","","","1.111","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102104","23.599","0.003","9.148","0.003","8.208","0.003","90","","87.69","0.02","90","","1770.5","0.9","298","1","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C10 H11 N O -","- C10 H11 N O -","- C80 H88 N8 O8 -","8","1","OA0024","Hosomi, Hiroyuki; Ito, Yoshikatsu; Ohba, Shigeru","Crystal-to-crystal photodimerization of <i>trans</i>-cinnamamides","Acta Crystallographica Section B","2000","56","4","682","689","10.1107/S0108768100002329","","","0.71073","MoKα","","","0.038","","","","0.116","","","","","","1.03","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2102105","22.444","0.001","9.557","0.002","8.632","0.001","90","","94.5","0.01","90","","1845.8","0.4","298","1","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C10 H11 N O -","- C10 H11 N O -","- C80 H88 N8 O8 -","8","1","OA0024","Hosomi, Hiroyuki; Ito, Yoshikatsu; Ohba, Shigeru","Crystal-to-crystal photodimerization of <i>trans</i>-cinnamamides","Acta Crystallographica Section B","2000","56","4","682","689","10.1107/S0108768100002329","","","0.71073","MoKα","","","0.062","","","","0.212","","","","","","1.19","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2102106","11.037","0.001","9.075","0.002","9.042","0.002","90","","108.42","0.01","90","","859.3","0.3","298","1","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H8 Cl N O -","- C9 H8 Cl N O -","- C36 H32 Cl4 N4 O4 -","4","1","OA0024","Hosomi, Hiroyuki; Ito, Yoshikatsu; Ohba, Shigeru","Crystal-to-crystal photodimerization of <i>trans</i>-cinnamamides","Acta Crystallographica Section B","2000","56","4","682","689","10.1107/S0108768100002329","","","0.71073","MoKα","","","0.038","","","","0.115","","","","","","1.02","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102107","11.398","0.003","9.33","0.004","8.698","0.003","90","","108.95","0.02","90","","874.8","0.5","298","1","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H8 Cl N O -","- C9 H8 Cl N O -","- C36 H32 Cl4 N4 O4 -","4","1","OA0024","Hosomi, Hiroyuki; Ito, Yoshikatsu; Ohba, Shigeru","Crystal-to-crystal photodimerization of <i>trans</i>-cinnamamides","Acta Crystallographica Section B","2000","56","4","682","689","10.1107/S0108768100002329","","","0.71073","MoKα","","","0.049","","","","0.145","","","","","","1.11","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2102108","20.243","0.003","9.087","0.002","8.137","0.002","90","","90","","90","","1496.8","0.5","298","1","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C7 H7 N O S -","- C7 H7 N O S -","- C56 H56 N8 O8 S8 -","8","1","OA0024","Hosomi, Hiroyuki; Ito, Yoshikatsu; Ohba, Shigeru","Crystal-to-crystal photodimerization of <i>trans</i>-cinnamamides","Acta Crystallographica Section B","2000","56","4","682","689","10.1107/S0108768100002329","","","0.71073","MoKα","","","0.049","","","","0.142","","","","","","0.99","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2102109","16.047","0.002","5.084","0.002","9.584","0.002","90","","94.06","0.01","90","","779.9","0.4","298","1","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C9 H9 N O -","- C9 H9 N O -","- C36 H36 N4 O4 -","4","1","OA0024","Hosomi, Hiroyuki; Ito, Yoshikatsu; Ohba, Shigeru","Crystal-to-crystal photodimerization of <i>trans</i>-cinnamamides","Acta Crystallographica Section B","2000","56","4","682","689","10.1107/S0108768100002329","","","0.71073","MoKα","","","0.04","","","","0.121","","","","","","1.02","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102110","16.191","0.002","5.079","0.002","9.509","0.002","90","","93.37","0.02","90","","780.6","0.4","298","1","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C9 H9 N O -","- C9 H9 N O -","- C36 H36 N4 O4 -","4","1","OA0024","Hosomi, Hiroyuki; Ito, Yoshikatsu; Ohba, Shigeru","Crystal-to-crystal photodimerization of <i>trans</i>-cinnamamides","Acta Crystallographica Section B","2000","56","4","682","689","10.1107/S0108768100002329","","","0.71073","MoKα","","","0.051","","","","0.16","","","","","","1.05","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2102111","8.733","0.003","18.578","0.009","5.21","0.003","91.86","0.04","93.04","0.04","93.21","0.03","842.2","0.7","298","1","","","","","","","","","","5","P -1","-P 1","2","","","","- C18 H16 Cl2 N2 O2 -","- C18 H16 Cl2 N2 O2 -","- C36 H32 Cl4 N4 O4 -","2","1","OA0024","Hosomi, Hiroyuki; Ito, Yoshikatsu; Ohba, Shigeru","Crystal-to-crystal photodimerization of <i>trans</i>-cinnamamides","Acta Crystallographica Section B","2000","56","4","682","689","10.1107/S0108768100002329","","","0.71073","MoKα","","","0.091","","","","0.221","","","","","","1.6","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2102112","5.20713","0.00005","5.20713","","7.40141","0.00012","90","","90","","90","","200.683","0.004","","","","","","","","","","","","2","I 41/a m d :2","-I 4bd 2","141","","","","?","- Hf4 V8 -","- Hf4 V8 -","","","OS0043","Zhao, Yusheng; Chu, Fuming; Von Dreele, Robert B.; Zhu, Qing","Structural phase transitions of HfV~2~ at low temperatures","Acta Crystallographica Section B","2000","56","4","601","606","10.1107/S0108768100003633","","","0.7508","","","","","","","","","","","3.69","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102113","5.19096","0.00008","5.21235","0.00009","7.41751","0.0001","90","","90","","90","","200.696","0.005","","","","","","","","","","","","2","I m m a","-I 2b 2","74","","","","?","- Hf4 V8 -","- Hf4 V8 -","","","OS0043","Zhao, Yusheng; Chu, Fuming; Von Dreele, Robert B.; Zhu, Qing","Structural phase transitions of HfV~2~ at low temperatures","Acta Crystallographica Section B","2000","56","4","601","606","10.1107/S0108768100003633","","","0.7508","","","","","","","","","","","4.24","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102114","5.17349","0.0001","5.22109","0.00012","7.43197","0.00015","90","","90","","90","","200.747","0.007","","","","","","","","","","","","2","I m m a","-I 2b 2","74","","","","?","- Hf4 V8 -","- Hf4 V8 -","","","OS0043","Zhao, Yusheng; Chu, Fuming; Von Dreele, Robert B.; Zhu, Qing","Structural phase transitions of HfV~2~ at low temperatures","Acta Crystallographica Section B","2000","56","4","601","606","10.1107/S0108768100003633","","","0.7508","","","","","","","","","","","4.06","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102115","7.37515","0.00003","7.375154","","7.375154","","90","","90","","90","","401.156","0.0016","","","","","","","","","","","","2","F d -3 m :2","-F 4vw 2vw 3","227","","","","?","- Hf8 V16 -","- Hf8 V16 -","","","OS0043","Zhao, Yusheng; Chu, Fuming; Von Dreele, Robert B.; Zhu, Qing","Structural phase transitions of HfV~2~ at low temperatures","Acta Crystallographica Section B","2000","56","4","601","606","10.1107/S0108768100003633","","","0.7508","","","","","","","","","","","3.66","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102116","9.8588","0.0005","4.8125","0.0003","25.0546","0.0013","90","","90","","90","","1188.73","0.11","150","2","150","2","","","","","","","","4","P c a 21","P 2c -2ac","29","DL-Allylglycine","DL-2-amino-4-pentenoic acid","","- C5 H9 N O2 -","- C5 H9 N O2 -","- C40 H72 N8 O16 -","8","2","OS0044","Dalhus, Bjørn; Görbitz, Carl Henrik","Non-centrosymmetric racemates: space-group frequencies and conformational similarities between crystallographically independent molecules","Acta Crystallographica Section B","2000","56","4","715","719","10.1107/S0108768100002172","","","0.71073","MoKα","","0.0533","0.044","","","","0.1107","","","","","","1.054","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102117","8.1935","0.0002","7.709","0.0002","5.408","0.0001","90","","90","","90","","341.59","0.02","598","","","","","","","","","","","4","P n n m","-P 2 2n","58","Zirconium Hydrogen Phosphate","Zirconium Bis(hydrogenortophosphate)","","- H2 O8 P2 Zr -","- O8 P2 Zr -","- O16 P4 Zr2 -","2","0.25","OS0045","Krogh Andersen, Anne Marie; Norby, Poul","<i>Ab initio</i> structure determination and Rietveld refinement of a high-temperature phase of zirconium hydrogen phosphate and a new polymorph of zirconium pyrophosphate from <i>in situ</i> temperature-resolved powder diffraction data","Acta Crystallographica Section B","2000","56","4","618","625","10.1107/S0108768100003645","","","0.9336","synchrotron","","","","","","","","","","2.34","","","","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2102118","8.3127","0.0004","6.6389","0.0004","5.3407","0.0003","90","","90","","90","","294.74","0.03","778","","","","","","","","","","","3","P n n m","-P 2 2n","58","Zirconium Pyrophosphate","Zirconium Pyrophosphate","","- O7 P2 Zr -","- O7 P2 Zr -","- O14 P4 Zr2 -","2","0.25","OS0045","Krogh Andersen, Anne Marie; Norby, Poul","<i>Ab initio</i> structure determination and Rietveld refinement of a high-temperature phase of zirconium hydrogen phosphate and a new polymorph of zirconium pyrophosphate from <i>in situ</i> temperature-resolved powder diffraction data","Acta Crystallographica Section B","2000","56","4","618","625","10.1107/S0108768100003645","","","0.9336","synchrotron","","","","","","","","","","2.02","","","","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2102119","5.2289","0.0001","5.4102","0.0001","13.1095","0.0003","96.332","0.001","90.622","0.001","109.493","0.001","347.02","0.012","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C6 H13 N O2 -","- C6 H13 N O2 -","- C12 H26 N2 O4 -","2","1","OS0046","Dalhus, Bjørn; Görbitz, Carl Henrik","Structural relationships in crystals accommodating different stereoisomers of 2-amino-3-methylpentanoic acid","Acta Crystallographica Section B","2000","56","4","720","727","10.1107/S0108768100002810","","","0.71073","MoKα","","0.0782","0.0576","","0.1698","0.1562","","","","1.056","1.11","1.11","","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102120","5.2438","0.0002","5.3978","0.0002","13.2562","0.0006","93.042","0.001","92.811","0.001","109.897","0.001","351.42","0.02","140","2","140","2","","","","","","","","4","P 1","P 1","1","","","","- C6 H13 N O2 -","- C6 H13 N O2 -","- C12 H26 N2 O4 -","2","2","OS0046","Dalhus, Bjørn; Görbitz, Carl Henrik","Structural relationships in crystals accommodating different stereoisomers of 2-amino-3-methylpentanoic acid","Acta Crystallographica Section B","2000","56","4","720","727","10.1107/S0108768100002810","","","0.71073","MoKα","","0.0359","0.0326","","0.0973","0.0934","","","","1.078","1.104","1.104","","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102121","5.2493","0.0001","5.4006","0.0001","13.2778","0.0002","92.9433","0.0006","92.8659","0.0005","109.857","0.0007","352.657","0.011","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C6 H13 N O2 -","- C6 H13 N O2 -","- C12 H26 N2 O4 -","2","1","OS0046","Dalhus, Bjørn; Görbitz, Carl Henrik","Structural relationships in crystals accommodating different stereoisomers of 2-amino-3-methylpentanoic acid","Acta Crystallographica Section B","2000","56","4","720","727","10.1107/S0108768100002810","","","0.71073","MoKα","","0.0656","0.0605","","0.194","0.1915","","","","1.248","1.303","1.303","","","","","has coordinates,has disorder","176768","2020-10-21","18:00:00",""
"2102122","9.6706","0.0001","5.2583","0.0001","14.1018","0.0002","90","","98.033","0.001","90","","710.053","0.018","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C6 H13 N O2 -","- C6 H13 N O2 -","- C24 H52 N4 O8 -","4","2","OS0046","Dalhus, Bjørn; Görbitz, Carl Henrik","Structural relationships in crystals accommodating different stereoisomers of 2-amino-3-methylpentanoic acid","Acta Crystallographica Section B","2000","56","4","720","727","10.1107/S0108768100002810","","","0.71073","MoKα","","0.0714","0.0483","","0.1237","0.108","","","","1.062","1.074","1.074","","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102123","12.7853","0.0004","4.8537","0.0001","5.5276","0.0002","90","","104.264","0.002","90","","332.446","0.018","293","","293","","","","","","","","","2","C 1 2/c 1","-C 2yc","15","B-Ta2O5","ditantalum penta oxide","","- O5 Ta2 -","- O5 Ta2 -","- O20 Ta8 -","4","0.5","OS0050","Zibrov, I. P.; Filonenko, V. P.; Sundberg, M.; Werner, P.-E.","Structures and phase transitions of <i>B</i>-Ta~2~O~5~ and <i>Z</i>-Ta~2~O~5~: two high-pressure forms of Ta~2~O~5~","Acta Crystallographica Section B","2000","56","4","659","665","10.1107/S0108768100005462","","","1.54056","CuKα~1~","","","","","","","","","","1.07","","","","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102124","5.2252","0.0001","4.6991","0.0001","5.8534","0.0001","90","","108.2","0.002","90","","136.533","0.005","293","","293","","","","","","","","","2","C 1 2 1","C 2y","5","Z-Ta2O5","ditantalum penta oxide","","- O5 Ta2 -","- O5 Ta2 -","- O10 Ta4 -","2","0.5","OS0050","Zibrov, I. P.; Filonenko, V. P.; Sundberg, M.; Werner, P.-E.","Structures and phase transitions of <i>B</i>-Ta~2~O~5~ and <i>Z</i>-Ta~2~O~5~: two high-pressure forms of Ta~2~O~5~","Acta Crystallographica Section B","2000","56","4","659","665","10.1107/S0108768100005462","","","1.54056","CuKα~1~","","","","","","","","","","1.07","","","","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102125","18.0525","0.0008","20.7374","0.001","3.8334","0.0002","90","","101.143","0.001","90","","1408.02","0.12","172","2","172","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","2,6-dichlorobenzonitrile","","- C7 H3 Cl2 N -","- C7 H3 Cl2 N -","- C56 H24 Cl16 N8 -","8","1","BK0072","Britton, Doyle; Noland, Wayland E.; Pinnow, Matthew J.","Isomorphism and pseudosymmetry in 2,6-dichloro- and 2,6-dibromobenzonitrile","Acta Crystallographica Section B","2000","56","5","822","827","10.1107/S0108768100003773","","","0.71073","MoKα","","0.037","0.03","","0.081","0.077","","","","1.02","1.05","1.05","","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2102126","18.2269","0.0015","21.349","0.002","3.9663","0.0003","90","","101.446","0.002","90","","1512.7","0.2","174","2","174","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","2,6-dibromobenzonitrile","","- C7 H3 Br2 N -","- C7 H3 Br2 N -","- C56 H24 Br16 N8 -","8","1","BK0072","Britton, Doyle; Noland, Wayland E.; Pinnow, Matthew J.","Isomorphism and pseudosymmetry in 2,6-dichloro- and 2,6-dibromobenzonitrile","Acta Crystallographica Section B","2000","56","5","822","827","10.1107/S0108768100003773","","","0.71073","MoKα","","0.045","0.036","","0.104","0.1","","","","1.13","1.19","1.19","","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2102127","24.47","","24.47","","24.47","","90","","90","","90","","14652","","293","","293","","","","","","","","","4","F m -3 c","-F 4a 2 3","226","Dehydrated Ca-A zeolite","","","- Al96 Ca48 O384 Si96 -","- Al96 Ca48 O384 Si96 -","- Al96 Ca48 O384 Si96 -","1","0.00520833","BR0095","Porcher, Florence; Souhassou, Mohamed; Graafsma, Heinz; Puig-Molina, Anna; Dusausoy, Yves; Lecomte, Claude","Refinement of framework disorder in dehydrated CaA zeolite from single-crystal synchrotron data","Acta Crystallographica Section B","2000","56","5","766","772","10.1107/S0108768100006893","","","0.248","synchrotron","","0.0765","0.0765","","0.0744","0.0744","","","","2.96","2.96","2.96","","","","","has coordinates","281110","2023-02-23","13:17:20",""
"2102128","24.47","","24.47","","24.47","","90","","90","","90","","14652","","293","","293","","","","","","","","","4","F m -3 c","-F 4a 2 3","226","Dehydrated Ca-A zeolite","","","- Al96 Ca48 O384 Si96 -","- Al96 Ca48 O384 Si96 -","- Al96 Ca48 O384 Si96 -","1","0.00520833","BR0095","Porcher, Florence; Souhassou, Mohamed; Graafsma, Heinz; Puig-Molina, Anna; Dusausoy, Yves; Lecomte, Claude","Refinement of framework disorder in dehydrated CaA zeolite from single-crystal synchrotron data","Acta Crystallographica Section B","2000","56","5","766","772","10.1107/S0108768100006893","","","0.248","synchrotron","","0.0699","0.0699","","0.0672","0.0672","","","","2.56","2.56","2.56","","","","","has coordinates","281110","2023-02-23","13:17:33",""
"2102129","24.47","","24.47","","24.47","","90","","90","","90","","14652","","293","","293","","","","","","","","","4","F m -3 c","-F 4a 2 3","226","Dehydrated Ca-A zeolite","","","- Al96 Ca48 O384 Si96 -","- Al96 Ca51.328 O384 Si96 -","- Al96 Ca51.328 O384 Si96 -","1","0.00520833","BR0095","Porcher, Florence; Souhassou, Mohamed; Graafsma, Heinz; Puig-Molina, Anna; Dusausoy, Yves; Lecomte, Claude","Refinement of framework disorder in dehydrated CaA zeolite from single-crystal synchrotron data","Acta Crystallographica Section B","2000","56","5","766","772","10.1107/S0108768100006893","","","0.248","synchrotron","","0.066","0.066","","0.0623","0.0623","","","","2.38","2.38","2.38","","","","","has coordinates","281110","2023-02-23","13:17:36",""
"2102130","24.47","","24.47","","24.47","","90","","90","","90","","14652","","293","","293","","","","","","","","","4","F -4 3 c","F -4c 2 3","","Dehydrated Ca-A zeolite","","","- Al96 Ca48 O384 Si96 -","- Al96 Ca25.088 O384 Si96 -","- Al96 Ca25.088 O384 Si96 -","1","0.0104167","BR0095","Porcher, Florence; Souhassou, Mohamed; Graafsma, Heinz; Puig-Molina, Anna; Dusausoy, Yves; Lecomte, Claude","Refinement of framework disorder in dehydrated CaA zeolite from single-crystal synchrotron data","Acta Crystallographica Section B","2000","56","5","766","772","10.1107/S0108768100006893","","","0.248","synchrotron","","0.07","0.07","","0.0667","0.0667","","","","2.45","2.45","2.45","","","","warnings","has coordinates","281832","2023-03-13","07:46:03",""
"2102131","16.131","0.002","16.131","0.002","7.175","0.002","90","","90","","120","","1616.9","0.5","293","2","293","2","","","","","","","","4","P -3","-P 3","147","","","","- K3 Nd O17 Si7 -","- K3 Nd O17 Si7 -","- K12 Nd4 O68 Si28 -","4","0.666667","BS0011","Haile, S. M.; Wuensch, B. J.","X-ray diffraction study of K~3~NdSi~7~O~17~: a new framework silicate with a linear Si—O—Si bond","Acta Crystallographica Section B","2000","56","5","773","779","10.1107/S0108768100006704","","","0.71073","MoKα","","0.0264","0.026","","0.071","0.0702","","","","1.265","1.277","1.277","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102132","5.9556","0.0005","8.0972","0.0005","11.896","0.0008","90","","90","","90","","573.67","0.07","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(R,R)-(+)-Tartaric acid monoamide","","- C4 H7 N O5 -","- C4 H7 N O5 -","- C16 H28 N4 O20 -","4","1","CF0011","Rychlewska, Urszula; Warżajtis, Beata","Packing modes of (<i>R</i>,<i>R</i>)-tartaric acid esters and amides","Acta Crystallographica Section B","2000","56","5","833","848","10.1107/S0108768100004274","","","0.71073","MoKα","","0.0357","0.0328","","0.0986","0.0845","","","","1.008","1.02","1.02","","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102133","10.594","0.001","10.594","0.001","13.771","0.003","90","","90","","90","","1545.6","0.4","293","2","293","2","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","","(R,R)-(+)-Tartaric acid N-methyldiamide","","- C5 H10 N2 O4 -","- C5 H8.8 N2 O4 -","- C40 H70.4 N16 O32 -","8","1","CF0011","Rychlewska, Urszula; Warżajtis, Beata","Packing modes of (<i>R</i>,<i>R</i>)-tartaric acid esters and amides","Acta Crystallographica Section B","2000","56","5","833","848","10.1107/S0108768100004274","","","0.71073","MoKα","","0.0596","0.0415","","0.1223","0.1121","","","","1.103","1.118","1.118","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102134","5.094","0.001","11.243","0.002","16.295","0.004","90","","90","","90","","933.2","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(R,R)-(+)-Tartaric acid N,N'-dimethyldiamide monohydrate","","- C6 H14 N2 O5 -","- C6 H14 N2 O5 -","- C24 H56 N8 O20 -","4","1","CF0011","Rychlewska, Urszula; Warżajtis, Beata","Packing modes of (<i>R</i>,<i>R</i>)-tartaric acid esters and amides","Acta Crystallographica Section B","2000","56","5","833","848","10.1107/S0108768100004274","","","0.71073","MoKα","","0.0815","0.0571","","0.1627","0.146","","","","1.042","1.041","1.041","","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102135","13.427","0.003","13.689","0.003","6.946","0.002","90","","90","","90","","1276.7","0.5","123","0.3","293","2","","","","","","","","3","P c c n","-P 2ab 2ac","56","2-methyl-1,3-cyclohexanedione","","","- C7 H10 O2 -","- C7 H10 O2 -","- C56 H80 O16 -","8","1","HR0044","Katrusiak, A.","Conformational transformation coupled with the order‒disorder phase transition in 2-methyl-1,3-cyclohexanedione crystals","Acta Crystallographica Section B","2000","56","5","872","881","10.1107/S0108768100005905","","","0.71073","MoKα","","0.0673","0.0531","","0.1565","0.1439","","","","1.104","1.127","1.127","","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102136","13.426","0.004","13.69","0.004","6.987","0.002","90","","90","","90","","1284.2","0.6","170","0.1","293","2","","","","","","","","3","P c c n","-P 2ab 2ac","56","2-methyl1,3-cyclohexanedione","","","- C7 H10 O2 -","- C7 H10 O2 -","- C56 H80 O16 -","8","1","HR0044","Katrusiak, A.","Conformational transformation coupled with the order‒disorder phase transition in 2-methyl-1,3-cyclohexanedione crystals","Acta Crystallographica Section B","2000","56","5","872","881","10.1107/S0108768100005905","","","0.71069","MoKα","","0.0471","0.04","","0.1181","0.1148","","","","1.04","1.087","1.087","","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102137","13.466","0.004","13.691","0.004","7.053","0.002","90","","90","","90","","1300.3","0.7","180","0.2","293","2","","","","","","","","3","P c c n","-P 2ab 2ac","56","2-methyl-1,3-cyclohexanedione","","","- C7 H10 O2 -","- C7 H10 O2 -","- C56 H80 O16 -","8","1","HR0044","Katrusiak, A.","Conformational transformation coupled with the order‒disorder phase transition in 2-methyl-1,3-cyclohexanedione crystals","Acta Crystallographica Section B","2000","56","5","872","881","10.1107/S0108768100005905","","","0.71073","MoKα","","0.1421","0.0923","","0.2777","0.2356","","","","1.148","1.22","1.22","","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102138","13.466","0.004","13.691","0.004","7.053","0.002","90","","90","","90","","1300.3","0.7","220","0.5","293","2","","","","","","","","3","P c c n","-P 2ab 2ac","56","2-methyl-1,3-cyclohexanedione","","","- C7 H10 O2 -","- C7 H10 O2 -","- C56 H80 O16 -","8","1","HR0044","Katrusiak, A.","Conformational transformation coupled with the order‒disorder phase transition in 2-methyl-1,3-cyclohexanedione crystals","Acta Crystallographica Section B","2000","56","5","872","881","10.1107/S0108768100005905","","","0.71073","MoKα","","0.055","0.044","","0.1353","0.1307","","","","1.044","1.109","1.109","","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102139","13.472","0.004","13.692","0.004","7.062","0.002","90","","90","","90","","1302.6","0.7","225","0.2","293","2","","","","","","","","3","P c c n","-P 2ab 2ac","56","2-methyl-1,3-cyclohexanedione","","","- C7 H10 O2 -","- C7 H10 O2 -","- C56 H80 O16 -","8","1","HR0044","Katrusiak, A.","Conformational transformation coupled with the order‒disorder phase transition in 2-methyl-1,3-cyclohexanedione crystals","Acta Crystallographica Section B","2000","56","5","872","881","10.1107/S0108768100005905","","","0.71073","MoKα","","0.1474","0.0912","","0.2724","0.2296","","","","1.171","1.248","1.248","","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102140","13.472","0.004","13.692","0.004","7.09","0.002","90","","90","","90","","1307.8","0.7","239","2","293","2","","","","","","","","3","P c c n","-P 2ab 2ac","56","2-methyl-1,3-cyclohexanedione","","","- C7 H10 O2 -","- C7 H10 O2 -","- C56 H80 O16 -","8","1","HR0044","Katrusiak, A.","Conformational transformation coupled with the order‒disorder phase transition in 2-methyl-1,3-cyclohexanedione crystals","Acta Crystallographica Section B","2000","56","5","872","881","10.1107/S0108768100005905","","","0.71073","MoKα","","0.1721","0.1069","","0.3291","0.2769","","","","1.258","1.346","1.346","","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102141","13.492","0.004","13.692","0.004","7.091","0.002","90","","90","","90","","1309.9","0.7","240","0.2","293","2","","","","","","","","3","P c c n","-P 2ab 2ac","56","2-methyl-1,3-cyclohexanedione","","","- C7 H10 O2 -","- C7 H10 O2 -","- C56 H80 O16 -","8","1","HR0044","Katrusiak, A.","Conformational transformation coupled with the order‒disorder phase transition in 2-methyl-1,3-cyclohexanedione crystals","Acta Crystallographica Section B","2000","56","5","872","881","10.1107/S0108768100005905","","","0.71073","MoKα","","0.2831","0.1962","","0.4904","0.4352","","","","1.314","1.545","1.545","","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102142","13.498","0.004","13.691","0.004","7.095","0.002","90","","90","","90","","1311.2","0.7","242","0.2","293","2","","","","","","","","3","P c c n","-P 2ab 2ac","56","2-methyl-1,3-cyclohexanedione","","","- C7 H10 O2 -","- C7 H10 O2 -","- C56 H80 O16 -","8","1","HR0044","Katrusiak, A.","Conformational transformation coupled with the order‒disorder phase transition in 2-methyl-1,3-cyclohexanedione crystals","Acta Crystallographica Section B","2000","56","5","872","881","10.1107/S0108768100005905","","","0.71073","MoKα","","0.2924","0.1859","","0.5103","0.4327","","","","1.288","1.48","1.48","","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102143","13.51","0.003","13.69","0.003","7.111","0.001","90","","90","","90","","1315.2","0.5","250","0.5","293","2","","","","","","","","3","I b a m","-I 2 2c","72","2-methyl-1,3-cyclohexanedione","","","- C7 H10 O2 -","- C7 H10 O2 -","- C56 H80 O16 -","8","0.5","HR0044","Katrusiak, A.","Conformational transformation coupled with the order‒disorder phase transition in 2-methyl-1,3-cyclohexanedione crystals","Acta Crystallographica Section B","2000","56","5","872","881","10.1107/S0108768100005905","","","0.71069","MoKα","","0.0666","0.0447","","0.1379","0.1307","","","","1.027","1.144","1.144","","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2102144","13.558","0.003","13.696","0.003","7.174","0.001","90","","90","","90","","1332.1","0.5","293","0.5","293","2","","","","","","","","3","I b a m","-I 2 2c","72","2-methyl-1,3-cyclohexanedione","","","- C7 H10 O2 -","- C7 H10 O2 -","- C56 H80 O16 -","8","0.5","HR0044","Katrusiak, A.","Conformational transformation coupled with the order‒disorder phase transition in 2-methyl-1,3-cyclohexanedione crystals","Acta Crystallographica Section B","2000","56","5","872","881","10.1107/S0108768100005905","","","0.71069","MoKα","","0.0466","0.0439","","0.1162","0.1119","","","","1.032","1.039","1.039","","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2102145","3.458","0.0001","3.458","0.0001","25.647","0.003","90","","90","","120","","265.59","0.03","293","2","293","2","","","","","","","","4","R -3 m :H","-R 3 2""","166","","","","- Fe Mn O3.945 Yb0.963 -","- Fe Mn O3.94 Yb0.963 -","- Fe3 Mn3 O11.82 Yb2.889 -","3","0.0833333","NA0104","Nespolo, Massimo; Isobe, Mitsumasa; Iida, Junji; Kimizuka, Noboru","Crystal structure and charge distribution of YbFeMnO~4~","Acta Crystallographica Section B","2000","56","5","805","810","10.1107/S0108768100005383","","","0.71073","MoKα","","0.0216","0.0175","","","","0.0437","","","","","","1.184","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102146","8.9136","0.0006","11.2501","0.0006","13.0585","0.0012","90","","90","","90","","1309.49","0.16","294","1","294","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N-(6-Amino-3,4-dihydro-3-methyl-5-nitroso-4-oxopyrimidin-2-yl) Valine","","- C10 H15 N5 O4 -","- C10 H15 N5 O4 -","- C40 H60 N20 O16 -","4","1","NA0105","Low, John N.; Ferguson, George; Glidewell, Christopher","<i>N</i>-(6-Amino-3,4-dihydro-3-methyl-5-nitroso-4-oxopyrimidin-2-yl) derivatives of glycine, valine, serine, threonine and methionine: interplay of molecular, molecular‒electronic and supramolecular structures","Acta Crystallographica Section B","2000","56","5","882","892","10.1107/S0108768100005437","","","0.7093","MoKα","","0.0567","0.044","","","","0.126","","","","","","1.036","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102147","6.5574","0.0007","7.686","0.002","22.222","0.003","90","","90","","90","","1120","0.3","294","1","294","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N-(6-Amino-3,4-dihydro-3-methyl-5-nitroso-4-oxopyrimidin-2-yl) Serine Monohydrate","","- C8 H13 N5 O6 -","- C8 H13 N5 O6 -","- C32 H52 N20 O24 -","4","1","NA0105","Low, John N.; Ferguson, George; Glidewell, Christopher","<i>N</i>-(6-Amino-3,4-dihydro-3-methyl-5-nitroso-4-oxopyrimidin-2-yl) derivatives of glycine, valine, serine, threonine and methionine: interplay of molecular, molecular‒electronic and supramolecular structures","Acta Crystallographica Section B","2000","56","5","882","892","10.1107/S0108768100005437","","","0.7107","MolybdenumKα","","0.0877","0.052","","","","0.1113","","","","","","0.977","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102148","8.3686","0.0003","6.7077","0.0003","11.123","0.0004","90","","111.265","0.002","90","","581.87","0.04","150","0.1","150","0.1","","","","","","","","4","P 1 21 1","P 2yb","4","","N-(6-Amino-3,4-dihydro-3-methyl-5-nitroso-4-oxopyrimidin-2-yl) Threonine","","- C9 H13 N5 O5 -","- C9 H13 N5 O5 -","- C18 H26 N10 O10 -","2","1","NA0105","Low, John N.; Ferguson, George; Glidewell, Christopher","<i>N</i>-(6-Amino-3,4-dihydro-3-methyl-5-nitroso-4-oxopyrimidin-2-yl) derivatives of glycine, valine, serine, threonine and methionine: interplay of molecular, molecular‒electronic and supramolecular structures","Acta Crystallographica Section B","2000","56","5","882","892","10.1107/S0108768100005437","","","0.71073","MoKα","","0.0498","0.0367","","","","0.0946","","","","","","1.029","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102149","9.149","0.002","27.081","0.003","7.29","0.001","90","","90.82","0.01","90","","1806","0.5","290","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C5 H16 N O4 P -","- C5 H16 N O4 P -","- C40 H128 N8 O32 P8 -","8","2","NA0106","Fábry, Jan; Petrícek, Václav; Kroupa, Jan; Císarová, Ivana","Ferroelastic structures of <i>n</i>-pentyl-, <i>n</i>- hexyl- and <i>n</i>-nonylammonium dihydrogenphosphate crystals","Acta Crystallographica Section B","2000","56","5","906","914","10.1107/S0108768100007941","","","0.71073","MoKα","","","0.0403","","","","0.0549","","","2.58","2.96","2.96","2.58","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102150","9.143","0.001","29.637","0.008","7.299","0.001","90","","90.86","0.01","90","","1977.6","0.6","290","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C6 H18 N O4 P -","- C6 H18 N O4 P -","- C48 H144 N8 O32 P8 -","8","2","NA0106","Fábry, Jan; Petrícek, Václav; Kroupa, Jan; Císarová, Ivana","Ferroelastic structures of <i>n</i>-pentyl-, <i>n</i>- hexyl- and <i>n</i>-nonylammonium dihydrogenphosphate crystals","Acta Crystallographica Section B","2000","56","5","906","914","10.1107/S0108768100007941","","","0.71073","MoKα","","","0.0499","","","","0.0556","","","1.71","1.99","1.99","1.71","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102151","9.138","0.003","36.984","0.009","7.383","0.002","90","","90.88","0.02","90","","2494.9","1.2","290","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H24 N O4 P -","- C9 H24 N O4 P -","- C72 H192 N8 O32 P8 -","8","2","NA0106","Fábry, Jan; Petrícek, Václav; Kroupa, Jan; Císarová, Ivana","Ferroelastic structures of <i>n</i>-pentyl-, <i>n</i>- hexyl- and <i>n</i>-nonylammonium dihydrogenphosphate crystals","Acta Crystallographica Section B","2000","56","5","906","914","10.1107/S0108768100007941","","","0.71073","MoKα","","","0.0534","","","","0.0576","","","1.91","2.31","2.31","1.91","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102152","6.6384","0.0002","24.4389","0.0007","7.9478","0.0003","90","","93.6346","0.001","90","","1286.82","0.07","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Nitro-4'-methyldiphenyl disulfide","","- C13 H11 N O2 S2 -","- C13 H11 N O2 S2 -","- C52 H44 N4 O8 S8 -","4","1","NA0107","Glidewell, Christopher; Low, John N; Wardell, James L","Conformational preferences and supramolecular aggregation in 2-nitrophenylthiolates: disulfides and thiosulfonates","Acta Crystallographica Section B","2000","56","5","893","905","10.1107/S0108768100007114","","","0.71073","MoKα","","0.1078","0.0459","","","","0.1465","","","","","","1.028","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2102153","7.0434","0.0005","7.8315","0.0005","11.3709","0.0008","82.576","0.004","80.69","0.003","83.189","0.003","610.71","0.07","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","2-Nitro-4'-chlorodiphenyl disulfide","","- C12 H8 Cl N O2 S2 -","- C12 H8 Cl N O2 S2 -","- C24 H16 Cl2 N2 O4 S4 -","2","1","NA0107","Glidewell, Christopher; Low, John N; Wardell, James L","Conformational preferences and supramolecular aggregation in 2-nitrophenylthiolates: disulfides and thiosulfonates","Acta Crystallographica Section B","2000","56","5","893","905","10.1107/S0108768100007114","","","0.71073","MoKα","","0.0635","0.044","","","","0.1159","","","","","","1.049","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102154","10.1301","0.0002","6.3474","0.0001","11.1133","0.0002","90","","106.644","0.008","90","","684.64","0.04","150","2","150","2","","","","","","","","5","P 1 21 1","P 2yb","4","","2,4-Dinitro-4'-methyldiphenyl disulfide","","- C13 H10 N2 O4 S2 -","- C13 H10 N2 O4 S2 -","- C26 H20 N4 O8 S4 -","2","1","NA0107","Glidewell, Christopher; Low, John N; Wardell, James L","Conformational preferences and supramolecular aggregation in 2-nitrophenylthiolates: disulfides and thiosulfonates","Acta Crystallographica Section B","2000","56","5","893","905","10.1107/S0108768100007114","","","0.71073","MoKα","","0.0437","0.0392","","","","0.1069","","","","","","1.044","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2102155","8.1655","0.0003","8.2415","0.0003","9.3887","0.0004","72.1417","0.0015","83.3965","0.0014","80.332","0.003","591.48","0.04","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","2,4-Dinitrophenyl-2'-methoxycarbonylmethyl disulfide","","- C9 H8 N2 O6 S2 -","- C9 H8 N2 O6 S2 -","- C18 H16 N4 O12 S4 -","2","1","NA0107","Glidewell, Christopher; Low, John N; Wardell, James L","Conformational preferences and supramolecular aggregation in 2-nitrophenylthiolates: disulfides and thiosulfonates","Acta Crystallographica Section B","2000","56","5","893","905","10.1107/S0108768100007114","","","0.71073","MoKα","","0.0684","0.0435","","","","0.1105","","","","","","1.044","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2102156","7.1028","0.0011","22.925","0.004","7.7769","0.0014","90","","95.536","0.012","90","","1260.4","0.4","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis-(2-nitrophenyl) disulfide","","- C12 H8 N2 O4 S2 -","- C12 H8 N2 O4 S2 -","- C48 H32 N8 O16 S8 -","4","1","NA0107","Glidewell, Christopher; Low, John N; Wardell, James L","Conformational preferences and supramolecular aggregation in 2-nitrophenylthiolates: disulfides and thiosulfonates","Acta Crystallographica Section B","2000","56","5","893","905","10.1107/S0108768100007114","","","0.71073","MoKα","","0.1163","0.0557","","","","0.1352","","","","","","1.027","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102157","14.1617","0.0005","5.3367","0.0002","22.6233","0.001","90","","91.7376","0.0013","90","","1709.01","0.12","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis-(2-nitro-4-trifluoromethylphenyl) disulfide","","- C14 H6 F6 N2 O4 S2 -","- C14 H6 F6 N2 O4 S2 -","- C56 H24 F24 N8 O16 S8 -","4","1","NA0107","Glidewell, Christopher; Low, John N; Wardell, James L","Conformational preferences and supramolecular aggregation in 2-nitrophenylthiolates: disulfides and thiosulfonates","Acta Crystallographica Section B","2000","56","5","893","905","10.1107/S0108768100007114","","","0.71073","MoKα","","0.1578","0.0534","","","","0.1492","","","","","","0.941","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102158","8.8211","0.0018","11.042","0.002","21.258","0.004","101.06","0.03","91.97","0.03","91.07","0.03","2030.3","0.7","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","S-(2-Nitrophenyl) 2-nitrobenzene thiosulfonate","","- C12 H8 N2 O6 S2 -","- C12 H8 N2 O6 S2 -","- C72 H48 N12 O36 S12 -","6","3","NA0107","Glidewell, Christopher; Low, John N; Wardell, James L","Conformational preferences and supramolecular aggregation in 2-nitrophenylthiolates: disulfides and thiosulfonates","Acta Crystallographica Section B","2000","56","5","893","905","10.1107/S0108768100007114","","","0.71073","MoKα","","0.247","0.0788","","","","0.1892","","","","","","0.917","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102159","13.2352","0.0011","6.6666","0.0007","10.7483","0.0009","90","0.008","90","0.008","90","0.008","948.36","0.15","293","","293","","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- As O5 Rb Ti -","- As O5 Rb2 Ti -","- As8 O40 Rb16 Ti8 -","8","2","OS0048","Streltsov, Victor A.; Nordborg, Jenni; Albertsson, Jörgen","Synchrotron X-ray analysis of RbTiOAsO~4~","Acta Crystallographica Section B","2000","56","5","785","792","10.1107/S0108768100006285","","","0.75","synchrotron_xray_vertical_wiggler","","0.0179","0.0179","","0.0152","","0.0152","","","1.22","","","1.22","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2102160","7.8743","0.0004","7.8743","0.0004","5.0417","0.0002","90","","90","","90","","312.61","0.03","","","","","","","","","","","","5","P -4 21 m","P -4 2ab","","","","","- Ca1.74 Co O7 Si2 Sr0.26 -","- Ca1.744 Co O7 Si2 Sr0.256 -","- Ca3.488 Co2 O14 Si4 Sr0.512 -","2","0.25","SN0002","Bagautdinov, B.; Hagiya, K.; Kusaka, K.; Ohmasa, M.; Iishi, K.","Two-dimensional incommensurately modulated structure of (Sr~0.13~Ca~0.87~)~2~CoSi~2~O~7~ crystals","Acta Crystallographica Section B","2000","56","5","811","821","10.1107/S0108768100006716","","","0.71073","MoKα","","0.0701","0.0701","","0.0524","","","","","","2.34","2.34","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2102161","7.8177","0.0007","14.943","0.001","9.4845","0.0007","90","","90","","90","","1108","0.1","","","","","","","","","","","","4","C 2 2 21","C 2c 2","20","yttrium oxalate-carbonate","","","- C4 H4 O12 Y2 -","- C4 H4 O12 Y2 -","- C16 H16 O48 Y8 -","4","0.5","AN0567","Bataille, Thierry; Louër, Daniel","Powder and single-crystal X-ray diffraction study of the structure of [Y(H~2~O)]~2~(C~2~O~4~)(CO~3~)~2~","Acta Crystallographica Section B","2000","56","6","998","1002","10.1107/S0108768100010004","","","1.5406","CuKα","","","","","","","","","","","","","","","","","has coordinates","191101","2020-10-21","18:00:00",""
"2102162","7.8198","0.0005","14.949","0.001","9.4908","0.0005","90","","90","","90","","1109.46","0.12","293","2","293","2","","","","","","","","4","C 2 2 21","C 2c 2","20","yttrium oxalate-carbonate","","","- C4 H4 O12 Y2 -","- C4 H4 O12 Y2 -","- C16 H16 O48 Y8 -","4","0.5","AN0567","Bataille, Thierry; Louër, Daniel","Powder and single-crystal X-ray diffraction study of the structure of [Y(H~2~O)]~2~(C~2~O~4~)(CO~3~)~2~","Acta Crystallographica Section B","2000","56","6","998","1002","10.1107/S0108768100010004","","","0.71073","MoKα","","0.093","0.0464","","","0.0817","0.1039","","","","","","1.091","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102163","16.212","0.002","16.212","0.002","13.873","0.002","90","","90","","120","","3157.7","0.7","373","","373","","","","","","","","","3","R -3 m :H","-R 3 2""","166","tris-hydroquinone fullerene","","","- C78 H18 O6 -","- C198 H24 O6 -","- C594 H72 O18 -","3","0.0833333","BK0080","Blanc, Eric; Restori, Renzo; Schwarzenbach, Dieter; Bürgi, Hans-Beat; Förtsch, Marcel; Venugopalan, Paloth; Ermer, Otto","Orientational disorder as a function of temperature in the clathrate structure of hydroquinone and C~60~","Acta Crystallographica Section B","2000","56","6","1003","1010","10.1107/S0108768100007564","","","0.710769","MoKα","","","0.0471","","","","0.0733","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102164","16.177","0.002","16.177","0.002","13.813","0.002","90","","90","","120","","3130.5","0.7","293","","293","","","","","","","","","3","R -3 m :H","-R 3 2""","166","tris-hydroquinone fullerene","","","- C78 H18 O6 -","- C198 H24 O6 -","- C594 H72 O18 -","3","0.0833333","BK0080","Blanc, Eric; Restori, Renzo; Schwarzenbach, Dieter; Bürgi, Hans-Beat; Förtsch, Marcel; Venugopalan, Paloth; Ermer, Otto","Orientational disorder as a function of temperature in the clathrate structure of hydroquinone and C~60~","Acta Crystallographica Section B","2000","56","6","1003","1010","10.1107/S0108768100007564","","","0.710769","MoKα","","","0.0422","","","","0.0565","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102165","16.152","0.002","16.152","0.002","13.75","0.002","90","","90","","120","","3106.6","0.7","200","","200","","","","","","","","","3","R -3 m :H","-R 3 2""","166","tris-hydroquinone fullerene","","","- C78 H18 O6 -","- C198 H24 O6 -","- C594 H72 O18 -","3","0.0833333","BK0080","Blanc, Eric; Restori, Renzo; Schwarzenbach, Dieter; Bürgi, Hans-Beat; Förtsch, Marcel; Venugopalan, Paloth; Ermer, Otto","Orientational disorder as a function of temperature in the clathrate structure of hydroquinone and C~60~","Acta Crystallographica Section B","2000","56","6","1003","1010","10.1107/S0108768100007564","","","0.710769","MoKα","","","0.0322","","","","0.0565","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102166","16.119","0.002","16.119","0.002","13.687","0.002","90","","90","","120","","3079.7","0.7","100","","100","","","","","","","","","3","R -3 m :H","-R 3 2""","166","tris-hydroquinone fullerene","","","- C78 H18 O6 -","- C198 H24 O6 -","- C594 H72 O18 -","3","0.0833333","BK0080","Blanc, Eric; Restori, Renzo; Schwarzenbach, Dieter; Bürgi, Hans-Beat; Förtsch, Marcel; Venugopalan, Paloth; Ermer, Otto","Orientational disorder as a function of temperature in the clathrate structure of hydroquinone and C~60~","Acta Crystallographica Section B","2000","56","6","1003","1010","10.1107/S0108768100007564","","","0.710769","MoKα","","","0.0355","","","","0.0574","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102167","11.929","0.0002","11.7639","0.0002","9.0612","0.0002","90","","103.95","0.001","90","","1234.07","0.04","150","2","150","2","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","5H, 10H-dithiolo[2,3-b][2,5]benzodithiocine-2-thione [low temperature (150 K) P monoclinic form]","","- C11 H8 S5 -","- C11 H8 S5 -","- C44 H32 S20 -","4","1","BM0027","Chohan, Zahid H.; Harrison, William T. A.; Howie, R. Alan; Milne, Bruce F.; Wardell, James L.","Crystallographic and molecular mechanics investigation of an order‒disorder transition and dimorphism in 5<i>H</i>,10<i>H</i>-dithiolo[2,3-<i>b</i>]-2,5-benzodithiocine-2-thione","Acta Crystallographica Section B","2000","56","6","1011","1017","10.1107/S0108768100010636","","","0.71073","MoKα","","0.0328","0.0278","","","0.0687","0.0712","","","","","","1.051","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102168","12.075","0.008","11.825","0.008","9.063","0.006","90","","102.8","0.05","90","","1261.9","1.5","298","2","298","2","","","","","","","","3","C 1 2/m 1","-C 2y","12","","5H,10H-Dithiolo[2,3-b][2,5]benzodithiocine-2-thione (C-centred monoclinic form)","","- C11 H8 S5 -","- C11 H8 S5 -","- C44 H32 S20 -","4","0.5","BM0027","Chohan, Zahid H.; Harrison, William T. A.; Howie, R. Alan; Milne, Bruce F.; Wardell, James L.","Crystallographic and molecular mechanics investigation of an order‒disorder transition and dimorphism in 5<i>H</i>,10<i>H</i>-dithiolo[2,3-<i>b</i>]-2,5-benzodithiocine-2-thione","Acta Crystallographica Section B","2000","56","6","1011","1017","10.1107/S0108768100010636","","","0.71073","MoKα","","0.137","0.0862","","","0.1847","0.2153","","","","","","1.053","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2102169","8.5683","0.0002","16.208","0.0004","17.898","0.0004","90","","97.1103","0.0014","90","","2466.47","0.1","150","2","150","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","5H,10H-Dithiolo[2,3-b][2,5]benzodithiocine-2-thione (P monoclinic form)","","- C11 H8 S5 -","- C11 H8 S5 -","- C88 H64 S40 -","8","2","BM0027","Chohan, Zahid H.; Harrison, William T. A.; Howie, R. Alan; Milne, Bruce F.; Wardell, James L.","Crystallographic and molecular mechanics investigation of an order‒disorder transition and dimorphism in 5<i>H</i>,10<i>H</i>-dithiolo[2,3-<i>b</i>]-2,5-benzodithiocine-2-thione","Acta Crystallographica Section B","2000","56","6","1011","1017","10.1107/S0108768100010636","","","0.71073","MoKα","","0.0562","0.0363","","","0.083","0.0918","","","","","","1.032","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102170","6.618","0.003","6.618","0.003","6.019","0.003","90","","90","","90","","263.6","0.2","293","2","293","2","","","","","","","","4","I 41/a m d :2","-I 4bd 2","141","","","","- Hf0.01 O24 Si Zr0.99 -","- Hf0.01 O4 Si Zr0.99 -","- Hf0.04 O16 Si4 Zr3.96 -","4","0.125","BM0029","Ríos, Susana; Malcherek, Thomas; Salje, Ekhard K. H.; Domeneghetti, Chiara","Localized defects in radiation-damaged zircon","Acta Crystallographica Section B","2000","56","6","947","952","10.1107/S0108768100008582","","","0.71073","MoKα","","0.0162","0.0157","","","0.0392","0.0395","","","","","","1.204","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2102171","14.111","0.006","7.567","0.003","15.338","0.006","90","","99.967","0.01","90","","1613","1.1","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C17 H16 N4 O4 -","- C17 H16 N4 O4 -","- C68 H64 N16 O16 -","4","1","BM0031","Chisholm, Greig; Kennedy, Alan R.; Wilson, Sharon; Teat, Simon J.","Comparison of the structural motifs of acetoacetanilides and related azo pigments","Acta Crystallographica Section B","2000","56","6","1046","1053","10.1107/S0108768100010946","","","0.6891","synchrotron","","0.1045","0.0659","","","0.1554","0.1663","","","","","","0.998","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102172","8.8636","0.0015","6.605","0.003","9.2381","0.0017","90","","97.804","0.014","90","","535.8","0.3","123","2","123","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C12 H15 N O2 -","- C12 H15 N O2 -","- C24 H30 N2 O4 -","2","0.5","BM0031","Chisholm, Greig; Kennedy, Alan R.; Wilson, Sharon; Teat, Simon J.","Comparison of the structural motifs of acetoacetanilides and related azo pigments","Acta Crystallographica Section B","2000","56","6","1046","1053","10.1107/S0108768100010946","","","0.71069","MoKα","","0.0467","0.0333","","","0.0915","0.0985","","","","","","1.066","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2102173","26.766","0.005","9.3754","0.0018","8.1729","0.0013","90","","90","","90","","2050.9","0.6","123","2","123","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C11 H13 N O2 -","- C11 H13 N O2 -","- C88 H104 N8 O16 -","8","1","BM0031","Chisholm, Greig; Kennedy, Alan R.; Wilson, Sharon; Teat, Simon J.","Comparison of the structural motifs of acetoacetanilides and related azo pigments","Acta Crystallographica Section B","2000","56","6","1046","1053","10.1107/S0108768100010946","","","0.71069","MoKα","","0.0929","0.0349","","","0.0872","0.1026","","","","","","0.986","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2102174","7.3247","0.001","12.108","0.002","10.7479","0.0014","90","","99.357","0.013","90","","940.5","0.2","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C11 H13 N O2 -","- C11 H13 N O2 -","- C44 H52 N4 O8 -","4","1","BM0031","Chisholm, Greig; Kennedy, Alan R.; Wilson, Sharon; Teat, Simon J.","Comparison of the structural motifs of acetoacetanilides and related azo pigments","Acta Crystallographica Section B","2000","56","6","1046","1053","10.1107/S0108768100010946","","","0.71069","MoKα","","0.1137","0.0428","","","0.1098","0.128","","","","","","1.072","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102175","8.9002","0.0018","9.2388","0.0018","9.6721","0.0019","93.73","0.03","98.73","0.03","114.46","0.03","708.3","0.3","150","","150","","","","","","","","","4","P -1","-P 1","2","","2,3,5,6-tetrafluoro-trans-1,4-diethynyl-cyclohexa-2,5-diene-1,4-diol","","- C10 H4 F4 O2 -","- C10 H4 F4 O2 -","- C30 H12 F12 O6 -","3","1.5","BM0033","Madhavi, N. N. L.; Desiraju, Gautam R.; Bilton, Claire; Howard, Judith A. K.; Allen, Frank H.","Crystal engineering in the <i>gem</i>-alkynol family: interplay between strong and weak interactions in structures of 2,3,5,6-tetrahalo[F,Cl,Br]-<i>trans</i>-1,4-diethynylcyclohexa-2,5-diene-1,4-diols","Acta Crystallographica Section B","2000","56","6","1063","1070","10.1107/S0108768100011496","","","0.71073","MoKα","","0.0371","0.0336","","","0.0895","0.0928","","","","","","1.031","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102176","16.758","0.002","16.758","0.002","8.865","0.002","90","","90","","90","","2489.6","0.7","150","","150","","","","","","","","","4","I 41/a :2","-I 4ad","88","","2,3,5,6-tetrachloro-trans-1,4-diethynyl-cyclohexa-2,5-diene-1,4-diol","","- C10 H4 Cl4 O2 -","- C10 H4 Cl4 O2 -","- C80 H32 Cl32 O16 -","8","0.5","BM0033","Madhavi, N. N. L.; Desiraju, Gautam R.; Bilton, Claire; Howard, Judith A. K.; Allen, Frank H.","Crystal engineering in the <i>gem</i>-alkynol family: interplay between strong and weak interactions in structures of 2,3,5,6-tetrahalo[F,Cl,Br]-<i>trans</i>-1,4-diethynylcyclohexa-2,5-diene-1,4-diols","Acta Crystallographica Section B","2000","56","6","1063","1070","10.1107/S0108768100011496","","","0.71073","MoKα","","0.059","0.0489","","","0.116","0.1245","","","","","","1.091","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102177","8.9147","0.0003","12.6402","0.0005","12.6547","0.0005","85.738","0.001","69.625","0.001","72.72","0.01","1275.75","0.11","150","","150","","","","","","","","","4","P -1","-P 1","2","","2,3,5,6-tetrabromo-trans-1,4-diethynyl-cyclohexa-2,5-diene-1,4-diol","","- C10 H4 Br4 O2 -","- C10 H4 Br4 O2 -","- C40 H16 Br16 O8 -","4","2","BM0033","Madhavi, N. N. L.; Desiraju, Gautam R.; Bilton, Claire; Howard, Judith A. K.; Allen, Frank H.","Crystal engineering in the <i>gem</i>-alkynol family: interplay between strong and weak interactions in structures of 2,3,5,6-tetrahalo[F,Cl,Br]-<i>trans</i>-1,4-diethynylcyclohexa-2,5-diene-1,4-diols","Acta Crystallographica Section B","2000","56","6","1063","1070","10.1107/S0108768100011496","","","0.71073","MoKα","","0.0439","0.0336","","","0.073","0.0781","","","","","","1.148","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102178","6.8286","0.0014","8.2407","0.0016","12.658","0.003","106.73","0.03","98.71","0.03","101.39","0.03","652","0.3","150","","150","","","","","","","","","3","P -1","-P 1","2","","","","- C17 H16 O -","- C17 H16 O -","- C34 H32 O2 -","2","1","BM0034","Bilton, Clair; Howard, Judith A. K.; Madhavi, N. N. L.; Nangia, Ashwini; Desiraju, Gautam R.; Allen, Frank H.; Wilson, Chick C.","Crystal engineering in the <i>gem</i>-alkynol family; synthon repetitivity and topological similarity in diphenylethynylmethanols: structures that lack O—H···O hydrogen bonds","Acta Crystallographica Section B","2000","56","6","1071","1079","10.1107/S010876810001154X","","","0.71073","MoKα","","0.0634","0.0478","","","0.1199","0.1317","","","","","","1.033","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102179","5.7082","0.0001","11.3645","0.0002","11.5167","0.0001","117.268","0.001","99.257","0.001","96.726","0.001","639.735","0.019","150","","150","","","","","","","","","4","P -1","-P 1","2","","","","- C15 H10 Cl2 O -","- C15 H10 Cl2 O -","- C30 H20 Cl4 O2 -","2","1","BM0034","Bilton, Clair; Howard, Judith A. K.; Madhavi, N. N. L.; Nangia, Ashwini; Desiraju, Gautam R.; Allen, Frank H.; Wilson, Chick C.","Crystal engineering in the <i>gem</i>-alkynol family; synthon repetitivity and topological similarity in diphenylethynylmethanols: structures that lack O—H···O hydrogen bonds","Acta Crystallographica Section B","2000","56","6","1071","1079","10.1107/S010876810001154X","","","0.71073","MoKα","","0.0431","0.0378","","","0.0987","0.1043","","","","","","1.11","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102180","5.728","0.0001","11.362","0.0002","11.521","0.0001","117.24","0.001","99.25","0.001","96.86","0.001","641.866","0.019","150","","150","","","","","","","","","4","P -1","-P 1","2","","","","- C15 H10 Cl2 O -","- C15 H10 Cl2 O -","- C30 H20 Cl4 O2 -","2","1","BM0034","Bilton, Clair; Howard, Judith A. K.; Madhavi, N. N. L.; Nangia, Ashwini; Desiraju, Gautam R.; Allen, Frank H.; Wilson, Chick C.","Crystal engineering in the <i>gem</i>-alkynol family; synthon repetitivity and topological similarity in diphenylethynylmethanols: structures that lack O—H···O hydrogen bonds","Acta Crystallographica Section B","2000","56","6","1071","1079","10.1107/S010876810001154X","","neutron","","neutron","","0.0668","0.0668","","","0.1281","0.1281","","","","","","5.444","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102181","5.7906","0.0012","11.325","0.002","11.907","0.002","115.67","0.03","99.43","0.03","97.91","0.03","674.9","0.3","150","","150","","","","","","","","","4","P -1","-P 1","2","","","","- C15 H10 Br2 O -","- C15 H10 Br2 O -","- C30 H20 Br4 O2 -","2","1","BM0034","Bilton, Clair; Howard, Judith A. K.; Madhavi, N. N. L.; Nangia, Ashwini; Desiraju, Gautam R.; Allen, Frank H.; Wilson, Chick C.","Crystal engineering in the <i>gem</i>-alkynol family; synthon repetitivity and topological similarity in diphenylethynylmethanols: structures that lack O—H···O hydrogen bonds","Acta Crystallographica Section B","2000","56","6","1071","1079","10.1107/S010876810001154X","","","0.71073","MoKα","","0.0367","0.0276","","","0.0691","0.0718","","","","","","1.071","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102182","5.6413","0.0003","10.2599","0.0005","17.3238","0.0009","100.45","0.002","97.79","0.002","95.477","0.002","969.51","0.09","150","","150","","","","","","","","","3","P -1","-P 1","2","","","","- C27 H20 O -","- C27 H15 O -","- C54 H30 O2 -","2","1","BM0034","Bilton, Clair; Howard, Judith A. K.; Madhavi, N. N. L.; Nangia, Ashwini; Desiraju, Gautam R.; Allen, Frank H.; Wilson, Chick C.","Crystal engineering in the <i>gem</i>-alkynol family; synthon repetitivity and topological similarity in diphenylethynylmethanols: structures that lack O—H···O hydrogen bonds","Acta Crystallographica Section B","2000","56","6","1071","1079","10.1107/S010876810001154X","","","0.71073","MoKα","","0.1171","0.0759","","","0.2025","0.2336","","","","","","1.038","","","","has coordinates,has disorder","176768","2020-10-21","18:00:00",""
"2102183","15.25","0.002","15.25","0.002","6.8149","0.0014","90","","90","","120","","1372.6","0.4","150","2","150","2","","","","","","","","6","P 63","P 6c","173","","2,4,6-tris-(4-chlorophenoxy)-1,3,5-triazine tribromobenzene","","- C27 H15 Br3 Cl3 N3 O3 -","- C27 H15 Br3 Cl3 N3 O3 -","- C54 H30 Br6 Cl6 N6 O6 -","2","0.333333","BM0035","Broder, Charlotte K.; Howard, Judith A. K.; Keen, David A.; Wilson, Chick C.; Allen, Frank H.; Jetti, Ram K. R.; Nangia, Ashwini; Desiraju, Gautam R.","Halogen trimer synthons in crystal engineering: low-temperature X-ray and neutron diffraction study of the 1:1 complex of 2,4,6-tris(4-chlorophenoxy)-1,3,5-triazine with tribromobenzene","Acta Crystallographica Section B","2000","56","6","1080","1084","10.1107/S0108768100011551","","","0.71073","MoKα","","0.0328","0.0267","","","0.0623","0.0642","","","","","","1.037","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102184","15.166","0.006","15.166","0.006","6.743","0.002","90","","90","","120","","1343.2","0.9","100","5","100","5","","","","","","","","6","P 63","P 6c","173","","","","- C27 H15 Br3 Cl3 N3 O3 -","- C27 H15 Br3 Cl3 N3 O3 -","- C54 H30 Br6 Cl6 N6 O6 -","2","0.333333","BM0035","Broder, Charlotte K.; Howard, Judith A. K.; Keen, David A.; Wilson, Chick C.; Allen, Frank H.; Jetti, Ram K. R.; Nangia, Ashwini; Desiraju, Gautam R.","Halogen trimer synthons in crystal engineering: low-temperature X-ray and neutron diffraction study of the 1:1 complex of 2,4,6-tris(4-chlorophenoxy)-1,3,5-triazine with tribromobenzene","Acta Crystallographica Section B","2000","56","6","1080","1084","10.1107/S0108768100011551","","neutron","","neutron","","0.0834","0.0834","","","0.2121","0.2121","","","","","","1.23","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102185","6.6158","0.0002","6.6604","0.0002","12.0551","0.0004","94.373","0.002","90.836","0.002","91.512","0.002","529.39","0.03","293","2","293","2","","","","","","","hydrothermal synthesis, 0.10 GPa, 1008 K","3","P -1","-P 1","2","dysprosium disilicate","dysprosium disilicate","","- Dy2 O7 Si2 -","- Dy2 O7 Si2 -","- Dy8 O28 Si8 -","4","2","BR0099","Fleet, Michael E.; Liu, Xiaoyang","Structure and complex twinning of dysprosium disilicate (Dy~2~Si~2~O~7~), Type B","Acta Crystallographica Section B","2000","56","6","940","946","10.1107/S0108768100008545","","","0.70926","MoKα","","0.1313","0.0325","","0.0407","","0.0407","","","","","","0.978","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102186","11.079","0.002","11.262","0.001","12.195","0.002","64.843","0.01","76.119","0.01","66.059","0.01","1254.6","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","hexa(thiourea)dicopper(I) sulphate monohydrate","","- C12 H52 Cu4 N24 O10 S14 -","- C12 H52 Cu4 N24 O10 S14 -","- C12 H52 Cu4 N24 O10 S14 -","1","0.5","CA0005","Piro, O. E.; Piatti, R. C. V.; Bolzán, A. E.; Salvarezza, R. C.; Arvia, A. J.","X-ray diffraction study of copper(I) thiourea complexes formed in sulfate-containing acid solutions","Acta Crystallographica Section B","2000","56","6","993","997","10.1107/S0108768100008028","","","0.71073","MoKα","","0.0305","0.0255","","0.0676","0.0646","","","","1.08","1.094","1.094","","","","","has coordinates","219800","2020-10-21","18:00:00",""
"2102187","11.5945","0.0003","12.2912","0.0004","7.8944","0.0002","90","","90.018","0.001","90","","1125.03","0.05","90","2","90","2","","","","","","","","3","C 1 c 1","C -2yc","9","DCNP","","","- C13 H10 N4 -","- C13 H10 N4 -","- C52 H40 N16 -","4","1","HA0196","Cole, Jacqueline M.; Wilson, Chick C.; Howard, Judith A. K.; Cruickshank, Frank R.","Quantitative analysis of hydrogen bonding and atomic thermal motion in the organic non-linear optical material DCNP using X-ray and neutron diffraction","Acta Crystallographica Section B","2000","56","6","1085","1093","10.1107/S0108768100008855","","","0.71073","MoKα","","0.0412","0.0348","","0.085","","0.0787","","","1.158","","","1.117","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102188","11.5972","0.0002","12.2873","0.0002","7.8877","0.0001","90","","90.021","0.001","90","","1123.98","0.03","100","2","100","2","","","","","","","","3","C 1 c 1","C -2yc","9","DCNP","","","- C13 H10 N4 -","- C13 H10 N4 -","- C52 H40 N16 -","4","1","HA0196","Cole, Jacqueline M.; Wilson, Chick C.; Howard, Judith A. K.; Cruickshank, Frank R.","Quantitative analysis of hydrogen bonding and atomic thermal motion in the organic non-linear optical material DCNP using X-ray and neutron diffraction","Acta Crystallographica Section B","2000","56","6","1085","1093","10.1107/S0108768100008855","","","0.71073","MoKα","","0.1245","0.0763","","0.0814","","0.0745","","","2.382","","","2.846","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102189","11.7304","0.0004","12.3278","0.0002","7.8844","0.0002","90","","90.173","0.002","90","","1140.16","0.05","200","2","200","2","","","","","","","","3","C 1 c 1","C -2yc","9","DCNP","","","- C13 H10 N4 -","- C13 H10 N4 -","- C52 H40 N16 -","4","1","HA0196","Cole, Jacqueline M.; Wilson, Chick C.; Howard, Judith A. K.; Cruickshank, Frank R.","Quantitative analysis of hydrogen bonding and atomic thermal motion in the organic non-linear optical material DCNP using X-ray and neutron diffraction","Acta Crystallographica Section B","2000","56","6","1085","1093","10.1107/S0108768100008855","","","0.71073","MoKα","","0.0636","0.0463","","0.0743","","0.0678","","","1.668","","","1.721","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102190","11.8751","0.0005","12.3735","0.0005","7.8876","0.0003","90","","90.412","0.002","90","","1158.95","0.08","290","2","290","2","","","","","","","","3","C 1 c 1","C -2yc","9","DCNP","","","- C13 H10 N4 -","- C13 H10 N4 -","- C52 H40 N16 -","4","1","HA0196","Cole, Jacqueline M.; Wilson, Chick C.; Howard, Judith A. K.; Cruickshank, Frank R.","Quantitative analysis of hydrogen bonding and atomic thermal motion in the organic non-linear optical material DCNP using X-ray and neutron diffraction","Acta Crystallographica Section B","2000","56","6","1085","1093","10.1107/S0108768100008855","","","0.71073","MoKα","","0.0826","0.0514","","0.1106","","0.0886","","","1.305","","","1.297","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102191","11.571","0.002","12.258","0.003","7.868","0.002","90","","90.11","0.03","90","","1116","0.4","100","2","100","2","","","","","","","","3","C 1 c 1","C -2yc","9","DCNP","","","- C13 H10 N4 -","- C13 H10 N4 -","- C52 H40 N16 -","4","1","HA0196","Cole, Jacqueline M.; Wilson, Chick C.; Howard, Judith A. K.; Cruickshank, Frank R.","Quantitative analysis of hydrogen bonding and atomic thermal motion in the organic non-linear optical material DCNP using X-ray and neutron diffraction","Acta Crystallographica Section B","2000","56","6","1085","1093","10.1107/S0108768100008855","","neutron","","PulsedneutronsatISIS,UK","","0.0737","0.0731","","0.1073","","0.0832","","","4.016","","","4.016","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102192","14.3179","0.0004","7.1112","0.0002","10.1023","0.0003","90","","90","","90","","1028.59","0.05","","","","","","","","","","","","3","P n a 21","P 2c -2n","33","","","","- Cu7 P Se6 -","- Cu7 P Se6 -","- Cu28 P4 Se24 -","4","1","LC0028","Gaudin, E.; Petricek, V.; Boucher, F.; Taulelle, F.; Evain, M.","Structures and phase transitions of the <i>A</i>~7~PSe~6~ (<i>A</i> = Ag, Cu) argyrodite-type ionic conductors. III. α-Cu~7~PSe~6~","Acta Crystallographica Section B","2000","56","6","972","979","10.1107/S0108768100010260","","x-ray","0.71073","MoKα","","0.2954","0.0466","","","0.0486","0.0804","","","","0.62","0.62","1.06","","","","has coordinates","277836","2022-09-14","17:02:02",""
"2102193","10.356","0.004","10.35","0.002","10.353","0.006","90","","90","","90.04","0.03","1109.7","0.8","121","","","","","","","","","","","4","P 1 1 21","P 2c","4","","","","- Cd2 O12 S3 Tl2 -","- Cd2 O12 S3 Tl2 -","- Cd8 O48 S12 Tl8 -","4","2","NA0103","Guelylah, A.; Madariaga, G.; Morgenroth, W.; Aroyo, M. I.; Breczewski, T.; Bocanegra, E. H.","X-ray structure determination of the monoclinic (121K) and orthorhombic (85K) phases of langbeinite-type dithallium dicadmium sulfate","Acta Crystallographica Section B","2000","56","6","921","935","10.1107/S0108768100009514","","x-ray","0.5502","Synchrotron","","0.0442","0.0442","","0.0639","","0.0639","","","13.78","","","13.78","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2102194","10.327","0.003","10.345","0.004","10.406","0.005","90","","90","","90","","1111.7","0.8","85","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- Cd2 O12 S3 Tl2 -","- Cd2 O12 S3 Tl2 -","- Cd8 O48 S12 Tl8 -","4","1","NA0103","Guelylah, A.; Madariaga, G.; Morgenroth, W.; Aroyo, M. I.; Breczewski, T.; Bocanegra, E. H.","X-ray structure determination of the monoclinic (121K) and orthorhombic (85K) phases of langbeinite-type dithallium dicadmium sulfate","Acta Crystallographica Section B","2000","56","6","921","935","10.1107/S0108768100009514","","x-ray","0.71073","MoKα","","0.0888","0.0573","","0.0804","","0.0602","","","1.94","","","2.33","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2102195","8.7336","0.0003","10.9388","0.0003","11.0284","0.0003","114.58","0.0017","91.966","0.0018","111.674","0.0018","868.09","0.05","150","2","150","2","","","","","","","Synthesised by authors, see text","4","P -1","-P 1","2","","meso-5,5,7,12,12,14-Hexamethyl-1,4,8,11-tetraazacyclotetradecane‒3,5- dinitrobenzoic acid(1/2)","","- C30 H44 N8 O12 -","- C30 H44 N8 O12 -","- C30 H44 N8 O12 -","1","0.5","NA0108","Burchell, Colin J.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher","Adducts of <i>meso</i> and racemic 5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradecane with trigonally trisubstituted benzene carboxylic acids: supramolecular structures in one and two dimensions","Acta Crystallographica Section B","2000","56","6","1054","1062","10.1107/S0108768100008302","","","0.71073","MoKα","","0.0756","0.049","","","0.1167","0.1329","","","","","","1.071","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102196","11.876","0.0005","13.8395","0.0006","15.8571","0.0007","90","","90","","90","","2606.2","0.2","100","2","100","2","","","","","","","Synthesised by authors, see text","4","P 21 21 21","P 2ac 2ab","19","","meso-5,5,7,12,12,14-Hexamethyl-1,4,8,11-tetraazacyclotetradecane‒5- hydroxyisophthalic acid‒water (1/1/1)","","- C24 H44 N4 O6 -","- C24 H44 N4 O6 -","- C96 H176 N16 O24 -","4","1","NA0108","Burchell, Colin J.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher","Adducts of <i>meso</i> and racemic 5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradecane with trigonally trisubstituted benzene carboxylic acids: supramolecular structures in one and two dimensions","Acta Crystallographica Section B","2000","56","6","1054","1062","10.1107/S0108768100008302","","","0.71073","MoKα","","0.075","0.0579","","","0.1169","0.1243","","","","","","1.044","","","","has coordinates,has disorder","176768","2020-10-21","18:00:00",""
"2102197","16.0262","0.0004","11.6461","0.0003","15.7907","0.0003","90","","118.652","0.0012","90","","2586.33","0.11","100","2","100","2","","","","","","","Synthesised by authors, see text","4","P 1 21/c 1","-P 2ybc","14","","racemic-5,5,7,12,12,14-Hexamethyl-1,4,8,11-tetraazacyclotetradecane‒5- hydroxyisophthalic acid‒water (1/1/1)","","- C24 H44 N4 O6 -","- C24 H44 N4 O6 -","- C96 H176 N16 O24 -","4","1","NA0108","Burchell, Colin J.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher","Adducts of <i>meso</i> and racemic 5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradecane with trigonally trisubstituted benzene carboxylic acids: supramolecular structures in one and two dimensions","Acta Crystallographica Section B","2000","56","6","1054","1062","10.1107/S0108768100008302","","","0.71073","MoKα","","0.0661","0.0485","","","0.116","0.1257","","","","","","1.017","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102198","57.368","0.001","22.783","0.001","5.6945","0.0005","90","","90","","90","","7442.8","0.7","293","","293","","","","","","","","","3","I b a 2","I 2 -2c","45","","","","- C35 H66 O6 -","- C35 H66 O6 -","- C280 H528 O48 -","8","1","NA0109","Van Langevelde, Arjen; Van Malssen, Kees; Driessen, René; Goubitz, Kees; Hollander, Frank; Peschar, René; Zwart, Peter; Schenk, Henk","Structure of C~<i>n~</i>C~<i>n~+2</i>C~<i>n~</i>-type (<i>n</i> = even) β'-triacylglycerols","Acta Crystallographica Section B","2000","56","6","1103","1111","10.1107/S0108768100009927","","","0.5061","synchrotron","","0.312","0.175","","0.323","","0.165","","","1.547","","","1.163","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102199","76.21","0.04","22.63","0.01","5.673","0.002","90","","90","","90","","9784","8","295","","295","2","","","","","","","","3","I b a 2","I 2 -2c","45","","","","- C47 H90 O6 -","- C47 H90 O6 -","- C376 H720 O48 -","8","1","NA0109","Van Langevelde, Arjen; Van Malssen, Kees; Driessen, René; Goubitz, Kees; Hollander, Frank; Peschar, René; Zwart, Peter; Schenk, Henk","Structure of C~<i>n~</i>C~<i>n~+2</i>C~<i>n~</i>-type (<i>n</i> = even) β'-triacylglycerols","Acta Crystallographica Section B","2000","56","6","1103","1111","10.1107/S0108768100009927","powder diffraction","","0.650515","","","","","","","","","7.4","5.7","2.92","","","","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102200","12.287","0.006","7.511","0.003","10.775","0.005","90","","112.542","0.014","90","","918.4","0.7","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- Ca2 H8 O11 P2 -","- Ca2 O11 P2 -","- Ca8 O44 P8 -","4","1","OS0054","Balić-Zunić, Tonci; Christoffersen, Margaret R.; Christoffersen, Jørgen","Structure of the β form of calcium pyrophosphate tetrahydrate","Acta Crystallographica Section B","2000","56","6","953","958","10.1107/S0108768100009447","","","0.71073","MoKα","","0.1751","0.0695","","","0.1344","0.1651","","","","","","0.874","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2102201","5.8838","0.0011","16.0925","0.0019","14.929","0.002","90","","95.547","0.015","90","","1406.9","0.4","122","0.5","122","0.5","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","dihydroxy phenylselenonium 4-methylphenyl sulfonate","","- C13 H14 O5 S Se -","- C13 H14 O5 S Se -","- C52 H56 O20 S4 Se4 -","4","1","OS0057","Sørensen, Henning Osholm; Stuhr-Hansen, Nicolai; Henriksen, Lars; Larsen, Sine","Structural characterization of protonated benzeneseleninic acid, the dihydroxyselenonium ion","Acta Crystallographica Section B","2000","56","6","1029","1034","10.1107/S0108768100010697","","","1.54184","CuKα","","0.0276","0.0269","","","0.075","0.0752","","","","","","2.386","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102202","40.641","0.005","22.268","0.003","5.7881","0.0013","90","","90","","90","","5238.2","1.5","122","0.5","122","0.5","","","","","","","","5","F d d 2","F 2 -2d","43","","dihydroxy phenylselenonium benzene sulfonate","","- C12 H12 O5 S Se -","- C12 H10 O5 S Se -","- C192 H160 O80 S16 Se16 -","16","1","OS0057","Sørensen, Henning Osholm; Stuhr-Hansen, Nicolai; Henriksen, Lars; Larsen, Sine","Structural characterization of protonated benzeneseleninic acid, the dihydroxyselenonium ion","Acta Crystallographica Section B","2000","56","6","1029","1034","10.1107/S0108768100010697","","","1.54184","CuKα","","0.0772","0.0737","","","0.1416","0.1425","","","","","","5.839","","","","has coordinates,has disorder,has Fobs","176768","2020-10-21","18:00:00",""
"2102203","12.786","0.002","6.3927","0.0008","10.5585","0.0009","90","","90","","90","","863.02","0.19","293","1","293","1","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- Cr0.05 K0.87 O5 P Sr0.06 Ti0.95 -","- Cr0.0485 K0.8695 O5 P Sr0.058 Ti0.9515 -","- Cr0.388 K6.956 O40 P8 Sr0.464 Ti7.612 -","8","2","OS0060","Norberg, Stefan T.; Streltsov, Victor A.; Svensson, Göran; Albertsson, Jörgen","Dopant positions in strontium/chromium- and barium-doped KTP, determined with synchrotron X-radiation","Acta Crystallographica Section B","2000","56","6","980","987","10.1107/S0108768100012866","","","0.75","synchrotronx-rayverticalwiggler","","0.028","0.028","","0.032","","0.032","","","2.493","","","2.493","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2102204","12.851","0.006","6.418","0.003","10.62","0.005","90","","90","","90","","875.9","0.7","120","1","120","1","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- Ba0.06 K0.88 O5 P Ti -","- Ba0.0615 K0.8775 O5 P Ti -","- Ba0.492 K7.02 O40 P8 Ti8 -","8","2","OS0060","Norberg, Stefan T.; Streltsov, Victor A.; Svensson, Göran; Albertsson, Jörgen","Dopant positions in strontium/chromium- and barium-doped KTP, determined with synchrotron X-radiation","Acta Crystallographica Section B","2000","56","6","980","987","10.1107/S0108768100012866","","","0.75","synchrotronx-rayverticalwiggler","","0.033","0.031","","0.051","","0.045","","","3.34","","","2.97","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2102205","7.5866","0.0002","8.9294","0.0002","13.4851","0.0003","95.762","0.001","106.263","0.001","101.386","0.001","847.87","0.04","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","diethylstilbestrol acetonitrile solvate (1/1)","","- C20 H23 N O2 -","- C20 H23 N O2 -","- C40 H46 N2 O4 -","2","1","OS0062","Görbitz, Carl Henrik; Hersleth, Hans-Petter","Selective solvent inclusion as a tool for mapping molecular properties in crystal structures: a diethylstilbestrol example","Acta Crystallographica Section B","2000","56","6","1094","1102","10.1107/S0108768100012805","","","0.71073","MoKα","","0.0734","0.0512","","","0.1385","0.16","","","","","","1.065","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102206","7.8841","0.0005","9.1401","0.0005","13.6505","0.0008","90.975","0.002","105.924","0.002","100.892","0.002","926.41","0.1","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","diethylstilbestrol dimethylsulfoxide solvate (1/1)","","- C20 H26 O3 S -","- C20 H26 O3 S -","- C40 H52 O6 S2 -","2","1","OS0062","Görbitz, Carl Henrik; Hersleth, Hans-Petter","Selective solvent inclusion as a tool for mapping molecular properties in crystal structures: a diethylstilbestrol example","Acta Crystallographica Section B","2000","56","6","1094","1102","10.1107/S0108768100012805","","","0.71073","MoKα","","0.0507","0.0404","","","0.111","0.1214","","","","","","1.065","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102207","7.6393","0.0001","9.9833","0.0003","13.3161","0.0001","91.883","0.002","104.036","0.001","104.311","0.001","950","0.03","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","diethylstilbestrol N,N-dimethylformamide solvate (1/1)","","- C21 H27 N O3 -","- C21 H27 N O3 -","- C42 H54 N2 O6 -","2","1","OS0062","Görbitz, Carl Henrik; Hersleth, Hans-Petter","Selective solvent inclusion as a tool for mapping molecular properties in crystal structures: a diethylstilbestrol example","Acta Crystallographica Section B","2000","56","6","1094","1102","10.1107/S0108768100012805","","","0.71073","MoKα","","0.0605","0.0468","","","0.1334","0.1467","","","","","","1.035","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102208","9.6266","0.0015","13.662","0.002","15.365","0.002","69.979","0.002","77.853","0.002","83.927","0.003","1854.9","0.5","150","2","150","2","","","","","","","","3","P -1","-P 1","2","","diethylstilbestrol acetone solvate (1/1)","","- C21 H26 O3 -","- C21 H26 O3 -","- C84 H104 O12 -","4","2","OS0062","Görbitz, Carl Henrik; Hersleth, Hans-Petter","Selective solvent inclusion as a tool for mapping molecular properties in crystal structures: a diethylstilbestrol example","Acta Crystallographica Section B","2000","56","6","1094","1102","10.1107/S0108768100012805","","","0.71073","MoKα","","0.0902","0.0527","","","0.1125","0.1336","","","","","","1.042","","","","has coordinates,has disorder","176768","2020-10-21","18:00:00",""
"2102209","5.6981","0.0002","21.1274","0.0007","16.0891","0.0006","90","","90.914","0.002","90","","1936.66","0.12","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","diethylstilbestrol 2-propanol solvate (1/1)","","- C21 H28 O3 -","- C21 H28 O3 -","- C84 H112 O12 -","4","1","OS0062","Görbitz, Carl Henrik; Hersleth, Hans-Petter","Selective solvent inclusion as a tool for mapping molecular properties in crystal structures: a diethylstilbestrol example","Acta Crystallographica Section B","2000","56","6","1094","1102","10.1107/S0108768100012805","","","0.71073","MoKα","","0.0655","0.0491","","","0.1234","0.1346","","","","","","1.044","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102210","6.2717","0.0006","7.433","0.0008","20.364","0.002","85.14","0.002","85.031","0.002","82.626","0.002","935.32","0.16","150","2","150","2","","","","","","","","3","P -1","-P 1","2","","diethylstilbestrol tert-butanol solvate (1/4)","","- C34 H60 O6 -","- C33.984 H59.964 O5.996 -","- C33.984 H59.964 O5.996 -","1","0.5","OS0062","Görbitz, Carl Henrik; Hersleth, Hans-Petter","Selective solvent inclusion as a tool for mapping molecular properties in crystal structures: a diethylstilbestrol example","Acta Crystallographica Section B","2000","56","6","1094","1102","10.1107/S0108768100012805","","","0.71073","MoKα","","0.0734","0.0572","","","0.1491","0.1648","","","","","","1.046","","","warnings","has coordinates,has disorder","249446","2020-10-21","18:00:00",""
"2102211","7.7092","0.0004","8.932","0.0005","15.3466","0.0008","93.797","0.002","100.629","0.002","98.866","0.002","1021.32","0.09","150","2","150","2","","","","","","","","3","P -1","-P 1","2","","diethylstilbestrol etanol solvate dihydrate (1/1/2)","","- C20 H30 O5 -","- C19.994 H29.985 O4.997 -","- C39.988 H59.97 O9.994 -","2","1","OS0062","Görbitz, Carl Henrik; Hersleth, Hans-Petter","Selective solvent inclusion as a tool for mapping molecular properties in crystal structures: a diethylstilbestrol example","Acta Crystallographica Section B","2000","56","6","1094","1102","10.1107/S0108768100012805","","","0.71073","MoKα","","0.0626","0.0463","","","0.1344","0.1465","","","","","","1.027","","","","has coordinates,has disorder","176768","2020-10-21","18:00:00",""
"2102212","7.7102","0.0002","8.9295","0.0002","15.4299","0.0003","94.337","0.001","100.071","0.001","98.291","0.001","1029.46","0.04","150","2","150","2","","","","","","","","3","P -1","-P 1","2","","diethylstilbestrol 1-propanol solvate dihydrate (1/1/2)","","- C21 H32 O5 -","- C21.006 H32.014 O5 -","- C42.012 H64.028 O10 -","2","1","OS0062","Görbitz, Carl Henrik; Hersleth, Hans-Petter","Selective solvent inclusion as a tool for mapping molecular properties in crystal structures: a diethylstilbestrol example","Acta Crystallographica Section B","2000","56","6","1094","1102","10.1107/S0108768100012805","","","0.71073","MoKα","","0.0584","0.0418","","","0.1101","0.1219","","","","","","1.048","","","","has coordinates,has disorder","176768","2020-10-21","18:00:00",""
"2102213","7.5712","0.0006","9.1543","0.0007","13.5964","0.001","73.691","0.003","75.46","0.003","80.517","0.003","870.95","0.12","150","2","150","2","","","","","","","","3","P -1","-P 1","2","","diethylstilbestrol methanol solvate hydrate (1/1/0.79)","","- C19 H25.58 O3.79 -","- C19.001 H24.301 O3.799 -","- C38.002 H48.602 O7.598 -","2","1","OS0062","Görbitz, Carl Henrik; Hersleth, Hans-Petter","Selective solvent inclusion as a tool for mapping molecular properties in crystal structures: a diethylstilbestrol example","Acta Crystallographica Section B","2000","56","6","1094","1102","10.1107/S0108768100012805","","","0.71073","MoKα","","0.0767","0.0618","","","0.1692","0.1875","","","","","","1.047","","","","has coordinates,has disorder","176768","2020-10-21","18:00:00",""
"2102214","4.988","0.003","4.988","0.003","9.997","0.007","90","","90","","120","","215.4","0.2","298","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","","","- D K S -","- D K S -","- D3 K3 S3 -","3","0.0833333","SN0007","Haarmann, Frank; Jacobs, Herbert; Reehuis, Manfred; Loose, Anja","Anharmonicity of potentials of atoms in potassium hydrogensulfide (KDS) determined by neutron single-crystal diffraction","Acta Crystallographica Section B","2000","56","6","988","992","10.1107/S0108768100011952","","neutron","0.912","neutron","","","0.0582","","","0.0293","0.0309","","","2.24","","","1.76","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2105357","29.21999","","12.67","","5.62","","90","","90","","90","","2080.62","","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","Ag2 Sn O3","","- Ag2 O3 Sn -","- Ag2 O3 Sn -","- Ag48 O72 Sn24 -","24","6","","Carlsson, A.; Linke, C.; Svensson, C.; Bovin, J.O.; Oku, T.; Wallenberg, L.R.; Jansen, M.","Modulated structure of Ag2 Sn O3 studied by high-resolution electron microscopy","Acta Crystallographica B (39,1983-)","2000","56","","363","368","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2106073","4.905","","5.112","","29.857","","90","","93.45","","90","","747.288","","","","","","","","","","","","","3","I 1 2/a 1","-I 2ya","15","","Bi0.868 Sr O2","","- Bi0.868 O2 Sr -","- Bi0.868 O2 Sr -","- Bi6.944 O16 Sr8 -","8","1","","Leligny, H.; Grebille, D.; Perez, O.; Masset, A.C.; Hervieu, M.; Raveau, B.","A five-dimensional structural investigation of the misfit layer compound (Bi0.87 Sr O2)2 (Co O2)1.82","Acta Crystallographica B (39,1983-)","2000","56","","173","182","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2300511","12.5488","","12.5488","","3.9129","","90","","90","","90","","616.174","","","","","","","","","","","","","5","P 4/m b m","-P 4 2ab","127","","Pb2.41 K2.92 Li2 Ta10 O30","","- K2.92 Li2 O30 Pb2.41 Ta10 -","- K2.916 O30 Pb2.408 Ta10 -","- K2.916 O30 Pb2.408 Ta10 -","1","0.0625","","Hornebecq, V.; Weill, F.; Elissalde, C.; Villesuzanne, A.; Menetrier, M.; Ravez, J.","Study of disorder in a tetragonal tungsten bronze ferroelectric relaxor: a structural approach","Journal of Applied Crystallography","2000","33","","1037","1045","","","","","","","","","","","","","","","","","","","","","","has coordinates","140860","2020-10-21","18:00:00",""
"2300512","12.5159","","12.5159","","3.8947","","90","","90","","90","","610.096","","","","","","","","","","","","","5","P 4/m b m","-P 4 2ab","127","","Pb3.67 K1.46 Li Ta10 O30","","- K1.46 Li O30 Pb3.67 Ta10 -","- K1.464 O30 Pb3.672 Ta10 -","- K1.464 O30 Pb3.672 Ta10 -","1","0.0625","","Hornebecq, V.; Elissalde, C.; Weill, F.; Villesuzanne, A.; Menetrier, M.; Ravez, J.","Study of disorder in a tetragonal tungsten bronze ferroelectric relaxor: a structural approach","Journal of Applied Crystallography","2000","33","","1037","1045","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4000000","9.6395","0.0002","8.0062","0.0002","12.7395","0.0002","90","","97.0381","0.0011","90","","975.77","0.04","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C26 H26 Fe -","- C26 H26 Fe -","- C52 H52 Fe2 -","2","0.5","","Blanchard, Mélanie D.; Hughes, Russell P.; Concolino, Thomas E.; Rheingold, Arnold L.","π-Stacking between Pentafluorophenyl and Phenyl Groups as a Controlling Feature of Intra- and Intermolecular Crystal Structure Motifs in Substituted Ferrocenes. Observation of Unexpected Face-to-Face Stacking between Pentafluorophenyl Rings","Chemistry of Materials","2000","12","6","1604","1610","10.1021/cm000093j","","","0.71073","MoKα","","0.0656","0.0534","","","0.1714","0.1871","","","","","","1.484","","","","has coordinates","178371","2020-10-21","18:00:00",""
"4000001","7.5442","0.0014","10.5836","0.0021","12.1279","0.0023","86.346","0.004","83.046","0.004","73.886","0.003","923","0.5","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C24 H17 F5 Fe -","- C24 H17 F5 Fe -","- C48 H34 F10 Fe2 -","2","1","","Blanchard, Mélanie D.; Hughes, Russell P.; Concolino, Thomas E.; Rheingold, Arnold L.","π-Stacking between Pentafluorophenyl and Phenyl Groups as a Controlling Feature of Intra- and Intermolecular Crystal Structure Motifs in Substituted Ferrocenes. Observation of Unexpected Face-to-Face Stacking between Pentafluorophenyl Rings","Chemistry of Materials","2000","12","6","1604","1610","10.1021/cm000093j","","","0.71073","MoKα","","0.0911","0.0565","","","0.1336","0.1557","","","","","","0.974","","","","has coordinates","178371","2020-10-21","18:00:00",""
"4000004","10.7378","0.0003","13.9667","0.0005","13.4215","0.0004","90","","108.263","0.0003","90","","1911.44","0.16","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C22 H8 F10 Fe -","- C22 H8 F10 Fe -","- C88 H32 F40 Fe4 -","4","2","","Blanchard, Mélanie D.; Hughes, Russell P.; Concolino, Thomas E.; Rheingold, Arnold L.","π-Stacking between Pentafluorophenyl and Phenyl Groups as a Controlling Feature of Intra- and Intermolecular Crystal Structure Motifs in Substituted Ferrocenes. Observation of Unexpected Face-to-Face Stacking between Pentafluorophenyl Rings","Chemistry of Materials","2000","12","6","1604","1610","10.1021/cm000093j","","","0.71073","MoKα","","0.1211","0.0981","","","0.2509","0.2857","","","","","","1.029","","","","has coordinates","178371","2020-10-21","18:00:00",""
"4000005","5.9556","0.0004","19.964","0.002","7.0281","0.0005","90","","90","","90","","835.6","0.1","293","2","293","2","","","","","","","","2","C m c a","-C 2ac 2","64","","","","- Sn3 Ti2 -","- Sn3 Ti2 -","- Sn24 Ti16 -","8","","","Kleinke, Holger; Waldeck, Markus; Gütlich, Philipp","Ti~2~Sn~3~: A Novel Binary Intermetallic Phase, Prepared by Chemical Transport at Intermediate Temperature","Chemistry of Materials","2000","12","8","2219","2224","10.1021/cm000131z","","","0.71073","MoKα","","0.0183","0.0116","","0.0256","0.0248","","","","0.785","0.852","0.852","","","","","has coordinates","178361","2020-10-21","18:00:00",""
"4000006","4.5376","0.001","11.4249","0.001","14.7464","0.001","75.604","0.01","83.876","0.01","83.047","0.01","732.69","0.18","293","2","293","2","","","","","","","","6","P -1","-P 1","2","[EDT-TTF-CONHMe]2Cl.H2O","Bis[3-methylamido-3',4'-ethylenedithiotetrathiafulvalene] chloride, water solvate","","- C10 H9 Cl0.5 N O1.5 S6 -","- C10 H9 Cl0.603 N O1.397 S6 -","- C20 H18 Cl1.206 N2 O2.794 S12 -","2","1","","Heuzé, Karine; Mézière, Cécile; Fourmigué, Marc; Batail, Patrick; Coulon, Claude; Canadell, Enric; Auban-Senzier, Pascale; Jérome, Denis","An Efficient, Redox-Enhanced Pair of Hydrogen-Bond Tweezers for Chloride Anion Recognition, a Key Synthon in the Construction of a Novel Type of Organic Metal based on the Secondary Amide-Functionalized Ethylenedithiotetrathiafulvalene, β''-(EDT-TTF-CONHMe)~2~[Cl·H~2~O]","Chemistry of Materials","2000","12","7","1898","1904","10.1021/cm000143k","","","0.71073","MoKα","","0.1265","0.0446","","","0.0554","0.0668","","","","","","0.772","","","","has coordinates","178370","2020-10-21","18:00:00",""
"4000007","5.973","0.001","8.069","0.001","29.524","0.003","95.02","0.01","93.26","0.01","97.48","0.01","1402.1","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C30 H46 O3 S -","- C30 H46 O3 S -","- C60 H92 O6 S2 -","2","1","","Lindsell, W. Edward; Preston, Peter N.; Seddon, John M.; Rosair, Georgina M.; Woodman, Thomas A. J.","Macroscopic Helical and Cylindrical Morphologies from Achiral 1,3-Diynes","Chemistry of Materials","2000","12","6","1572","1576","10.1021/cm000172v","","","0.71073","MoKα","","0.0619","0.0427","","","0.1067","0.1173","","","","","","1.022","","","","has coordinates","178370","2020-10-21","18:00:00",""
"4000008","14.805","0.003","7.485","0.001","21.038","0.004","90","","90","","90","","2331.3","0.7","293","2","293","2","","","","","","","","7","P b c n","-P 2n 2ab","60","","","","- C2 H10 F Mn N2 O9 V3 -","- C2 H10 F Mn N2 O9 V3 -","- C16 H80 F8 Mn8 N16 O72 V24 -","8","1","","Law, Teresa S-C.; Williams, Ian D.","Organo-Directed Synthesis of Manganese Vanadates with Variable Stoichiometry and Dimensionality: 1-D [(Hen)~2~Mn(VO~3~)~4~], 2-D [H~2~en]~2~[Mn(VO~3~)~6~], and 3-D [H~2~en][MnF(VO~3~)~3~]","Chemistry of Materials","2000","12","8","2070","2072","10.1021/cm000190c","","","0.71073","MoKα","","0.077","0.0439","","0.1351","0.1004","","","","1.041","1.089","1.089","","","","","has coordinates","178360","2020-10-21","18:00:00",""
"4000009","5.811","0.001","17.884","0.004","8.417","0.002","90","","101.04","0.01","90","","858.5","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C4 H18 Mn N4 O12 V4 -","- C4 H18 Mn N4 O12 V4 -","- C8 H36 Mn2 N8 O24 V8 -","2","0.5","","Law, Teresa S-C.; Williams, Ian D.","Organo-Directed Synthesis of Manganese Vanadates with Variable Stoichiometry and Dimensionality: 1-D [(Hen)~2~Mn(VO~3~)~4~], 2-D [H~2~en]~2~[Mn(VO~3~)~6~], and 3-D [H~2~en][MnF(VO~3~)~3~]","Chemistry of Materials","2000","12","8","2070","2072","10.1021/cm000190c","","","0.71073","MoKα","","0.0246","0.0222","","","0.0573","0.0586","","","","","","1.1","","","","has coordinates","178360","2020-10-21","18:00:00",""
"4000010","8.074","0.001","8.522","0.001","8.794","0.001","77.83","0.01","63.44","0.01","83.6","0.02","528.96","0.11","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C4 H20 Mn N4 O18 V6 -","- C4 H20 Mn N4 O18 V6 -","- C4 H20 Mn N4 O18 V6 -","1","0.5","","Law, Teresa S-C.; Williams, Ian D.","Organo-Directed Synthesis of Manganese Vanadates with Variable Stoichiometry and Dimensionality: 1-D [(Hen)~2~Mn(VO~3~)~4~], 2-D [H~2~en]~2~[Mn(VO~3~)~6~], and 3-D [H~2~en][MnF(VO~3~)~3~]","Chemistry of Materials","2000","12","8","2070","2072","10.1021/cm000190c","","","0.71073","MoKα","","0.0457","0.0426","","","0.1119","0.1154","","","","","","1.077","","","","has coordinates","178360","2020-10-21","18:00:00",""
"4000011","28.315","0.006","3.8719","0.0008","11.271","0.002","90","","90.45","0.03","90","","1235.6","0.4","153","2","153","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- Ce3.67 O3 Se6 Ti2 -","- Ce3.6884 O3 Se6 Ti2 -","- Ce14.7536 O12 Se24 Ti8 -","4","0.5","","Tougait, Olivier; Ibers, James A.","Synthesis and Characterization of Three New Rare-Earth Titanium Oxyselenides: Ln~3.67~Ti~2~O~3~Se~6~ (Ln = Ce, Nd, Sm)","Chemistry of Materials","2000","12","9","2653","2658","10.1021/cm000203m","","","0.71073","MoKα","","0.0286","0.0245","","","0.0589","0.0604","","","","","","1.015","","","","has coordinates","178370","2020-10-21","18:00:00",""
"4000012","28.121","0.006","3.8232","0.0008","11.179","0.002","90","","90.15","0.03","90","","1201.8","0.4","153","2","153","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- Nd3.67 O3 Se6 Ti2 -","- Nd3.713 O3 Se6 Ti2 -","- Nd14.852 O12 Se24 Ti8 -","4","0.5","","Tougait, Olivier; Ibers, James A.","Synthesis and Characterization of Three New Rare-Earth Titanium Oxyselenides: Ln~3.67~Ti~2~O~3~Se~6~ (Ln = Ce, Nd, Sm)","Chemistry of Materials","2000","12","9","2653","2658","10.1021/cm000203m","","","0.71073","MoKα","","0.0322","0.0281","","","0.0689","0.0705","","","","","","1.206","","","","has coordinates","178370","2020-10-21","18:00:00",""
"4000013","27.961","0.006","3.7827","0.0008","11.128","0.002","90","","90.26","0.03","90","","1177","0.4","153","2","153","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- O3 Se6 Sm3.67 Ti2 -","- O3 Se6 Sm3.6434 Ti2 -","- O12 Se24 Sm14.5736 Ti8 -","4","0.5","","Tougait, Olivier; Ibers, James A.","Synthesis and Characterization of Three New Rare-Earth Titanium Oxyselenides: Ln~3.67~Ti~2~O~3~Se~6~ (Ln = Ce, Nd, Sm)","Chemistry of Materials","2000","12","9","2653","2658","10.1021/cm000203m","","","0.71073","MoKα","","0.0294","0.0253","","","0.0594","0.0607","","","","","","0.998","","","","has coordinates","178370","2020-10-21","18:00:00",""
"4000014","10.137","0.005","44.006","0.004","4.709","0.007","90","","90","","90","","2100","3","298.2","","298.2","","","","","","","","","7","I 2 2 2","I 2 2","23","","","","- C24 H16 N4 Rb S12 Se8 Zn -","- C22 H16 N4 Rb0.25 S12 Se8 Zn0.25 -","- C44 H32 N8 Rb0.5 S24 Se16 Zn0.5 -","2","0.25","","Mori, Hatsumi; Sakurai, Naoki; Tanaka, Shoji; Moriyama, Hiroshi; Mori, Takehiko; Kobayashi, Hayao; Kobayashi, Akiko","Control of Electronic State by Dihedral Angle in θ-type Bis(ethylenedithio)tetraselenafulvalene Salts","Chemistry of Materials","2000","12","10","2984","2987","10.1021/cm000321+","","","0.7107","MoKa","","","0.0857","","","0.067","","","","","2.933","2.933","","","","","has coordinates","178376","2020-10-21","18:00:00",""
"4000015","9.812","0.004","44.104","0.004","4.907","0.005","90","","90","","90","","2123","1","298.2","","298.2","","","","","","","","","7","I 2 2 2","I 2 2","23","","","","- C24 H16 Co Cs N4 S12 Se8 -","- C22 H16 Co0.25 Cs0.25 N4 S12 Se8 -","- C44 H32 Co0.5 Cs0.5 N8 S24 Se16 -","2","0.25","","Mori, Hatsumi; Sakurai, Naoki; Tanaka, Shoji; Moriyama, Hiroshi; Mori, Takehiko; Kobayashi, Hayao; Kobayashi, Akiko","Control of Electronic State by Dihedral Angle in θ-type Bis(ethylenedithio)tetraselenafulvalene Salts","Chemistry of Materials","2000","12","10","2984","2987","10.1021/cm000321+","","","0.7107","MoKa","","","0.1007","","","0.0705","","","","","3.126","3.126","","","","","has coordinates","178376","2020-10-21","18:00:00",""
"4000016","9.818","0.006","44.13","0.005","4.906","0.007","90","","90","","90","","2125","2","298.2","","298.2","","","","","","","","","7","I 2 2 2","I 2 2","23","","","","- C24 H16 Cs N4 S12 Se8 Zn -","- C22 H16 Cs0.25 N4 S12 Se8 Zn0.25 -","- C44 H32 Cs0.5 N8 S24 Se16 Zn0.5 -","2","0.25","","Mori, Hatsumi; Sakurai, Naoki; Tanaka, Shoji; Moriyama, Hiroshi; Mori, Takehiko; Kobayashi, Hayao; Kobayashi, Akiko","Control of Electronic State by Dihedral Angle in θ-type Bis(ethylenedithio)tetraselenafulvalene Salts","Chemistry of Materials","2000","12","10","2984","2987","10.1021/cm000321+","","","0.7107","MoKa","","","0.0673","","","0.0437","","","","","1.792","1.792","","","","","has coordinates","178376","2020-10-21","18:00:00",""
"4000017","10.802","0.006","34.644","0.006","4.981","0.008","90","","117.44","0.05","90","","1654","3","298.2","","298.2","","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C22 H16 Ag N2 S8 Se8 -","- C20 H16 Ag0.5 N2 S8 Se8 -","- C40 H32 Ag N4 S16 Se16 -","2","0.5","","Mori, Hatsumi; Sakurai, Naoki; Tanaka, Shoji; Moriyama, Hiroshi; Mori, Takehiko; Kobayashi, Hayao; Kobayashi, Akiko","Control of Electronic State by Dihedral Angle in θ-type Bis(ethylenedithio)tetraselenafulvalene Salts","Chemistry of Materials","2000","12","10","2984","2987","10.1021/cm000321+","","","0.7107","MoKa","","","0.0577","","","0.0432","","","","","2.103","2.103","","","","","has coordinates","178376","2020-10-21","18:00:00",""
"4000018","10.128","0.009","43.97","0.01","4.71","0.01","90","","90","","90","","2098","4","298.2","","298.2","","","","","","","","","7","I 2 2 2","I 2 2","23","","","","- C24 H16 Co N4 Rb S12 Se8 -","- C22 H16 Co0.25 N4 Rb0.25 S12 Se8 -","- C44 H32 Co0.5 N8 Rb0.5 S24 Se16 -","2","0.25","","Mori, Hatsumi; Sakurai, Naoki; Tanaka, Shoji; Moriyama, Hiroshi; Mori, Takehiko; Kobayashi, Hayao; Kobayashi, Akiko","Control of Electronic State by Dihedral Angle in θ-type Bis(ethylenedithio)tetraselenafulvalene Salts","Chemistry of Materials","2000","12","10","2984","2987","10.1021/cm000321+","","","0.7107","MoKa","","","0.0799","","","0.0476","","","","","3.412","3.412","","","","","has coordinates","178376","2020-10-21","18:00:00",""
"4000019","18.905","0.004","6.484","0.001","5.016","0.001","90","","90","","90","","614.9","0.2","100","1","100","1","","","","","","","","4","P c a 21","P 2c -2ac","29","m-nitroaniline","m-nitroaniline","","- C6 H6 N2 O2 -","- C6 H6 N2 O2 -","- C24 H24 N8 O8 -","4","1","","Goeta, Andrés E.; Wilson, Chick C.; Autino, Juan C.; Ellena, Javier; Punte, Graciela","Hydrogen Bonding in Nitroanilines: Neutron Diffraction Study of m-Nitroaniline at 100 K","Chemistry of Materials","2000","12","11","3342","3346","10.1021/cm001092u","","neutron","","neutron","","0.0529","0.0529","","","0.1377","0.1377","","","","","","1.117","","","","has coordinates","178334","2020-10-21","18:00:00",""
"4000020","24.691","0.001","24.691","0.001","14.556","0.001","90","","90","","90","","8873.5","0.9","153.2","","153.2","","","","","","","","","7","I 41/a c d :2","-I 4bd 2c","142","","","","- C40 H43 Cu2 F8 N8 Nb O2 -","- C40 H40 Cu F4.5 N8 Nb0.25 O2.5 -","- C320 H320 Cu8 F36 N64 Nb2 O20 -","8","0.25","","Norquist, Alexander J.; Welk, Margaret E.; Stern, Charlotte L.; Poeppelmeier, Kenneth R.","Synthesis of the Neutral (CuF(NC~5~H~5~)~4~)~2~NbOF~5~ Cluster","Chemistry of Materials","2000","12","7","1905","1909","10.1021/cm0001354","","","0.7107","MoKα","","0.0515","0.052","","0.042","","0.042","","","1.401","","","1.4","","","","has coordinates","277839","2022-09-14","18:07:02",""
"4000021","11.6493","0.0014","9.5395","0.0014","21.751","0.003","90","","90","","90","","2417.1","0.6","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","Bis(EDT)ethane","1,2-bis(3',4'-(ethylendithio)-tetrathiafulvalen-3-yl)ethane","","- C18 H14 S12 -","- C18 H14 S12 -","- C72 H56 S48 -","4","0.5","","Mézière, Cécile; Fourmigué, Marc; Canadell, Enric; Clérac, Rodolphe; Bechgaard, Klaus; Auban-Senzier, Pascale","Mixed-Valence, Layered, Cation Radical Salts of the Ethane-Bridged Dimeric Tetrathiafulvalene [(EDT-TTF‒CH~2^‒^~)~2~^•+^][X^-^][THF]~0.5~, X^-^ = FeCl~4~^-^, GaCl~4~^-^","Chemistry of Materials","2000","12","8","2250","2256","10.1021/cm0001511","","","0.71073","MoKα","","0.3571","0.0546","","0.1133","0.0693","","","","0.914","1.157","1.157","","","","","has coordinates","178342","2020-10-21","18:00:00",""
"4000022","14.503","0.0014","13.9152","0.0014","31.148","0.003","90","","90.644","0.01","90","","6285.6","1","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Bis(EDT-TTF)ethane,FeCl4,0.5 THF","1,2-Bis(ethylenedithiotetrathiafulvalene)ethane cation, tetrachloroferrate, THF solvate","","- C20 H18 Cl4 Fe O0.5 S12 -","- C20 H18 Cl4 Fe O0.5 S12 -","- C160 H144 Cl32 Fe8 O4 S96 -","8","1","","Mézière, Cécile; Fourmigué, Marc; Canadell, Enric; Clérac, Rodolphe; Bechgaard, Klaus; Auban-Senzier, Pascale","Mixed-Valence, Layered, Cation Radical Salts of the Ethane-Bridged Dimeric Tetrathiafulvalene [(EDT-TTF‒CH~2^‒^~)~2~^•+^][X^-^][THF]~0.5~, X^-^ = FeCl~4~^-^, GaCl~4~^-^","Chemistry of Materials","2000","12","8","2250","2256","10.1021/cm0001511","","","0.71073","MoKα","","0.2077","0.0458","","0.0728","0.0489","","","","0.686","0.962","0.962","","","","","has coordinates","178342","2020-10-21","18:00:00",""
"4000023","14.5016","0.0014","13.9153","0.0014","31.139","0.003","90","","90.804","0.01","90","","6283","1.1","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Bis(EDT)ethane, GaCl4, 0.5 THF","1,2-bis(ethylenedithiotetrathiafulvalenyl)ethane, tetrachlorogallate, 1/2 tetrahydrofurane","","- C20 H18 Cl4 Ga O0.5 S12 -","- C20 H18 Cl4 Ga O0.5 S12 -","- C160 H144 Cl32 Ga8 O4 S96 -","8","1","","Mézière, Cécile; Fourmigué, Marc; Canadell, Enric; Clérac, Rodolphe; Bechgaard, Klaus; Auban-Senzier, Pascale","Mixed-Valence, Layered, Cation Radical Salts of the Ethane-Bridged Dimeric Tetrathiafulvalene [(EDT-TTF‒CH~2^‒^~)~2~^•+^][X^-^][THF]~0.5~, X^-^ = FeCl~4~^-^, GaCl~4~^-^","Chemistry of Materials","2000","12","8","2250","2256","10.1021/cm0001511","","","0.71073","MoKα","","0.0873","0.0479","","0.1138","0.1006","","","","0.933","1.084","1.084","","","","","has coordinates","178342","2020-10-21","18:00:00",""
"4000024","15.252","0.008","15.2516","","10.749","0.004","90","","90","","120","","2165","1","296.2","","","","","","","","","","","5","R -3 :H","-R 3","148","","","","- Ce9 F18 H67.5 N10.5 O27 -","- Ce9 F18 N10.5 O27 -","- Ce18 F36 N21 O54 -","2","0.111111","","Yu, Ranbo; Wang, Dan; Kumada, Nobuhiro; Kinomura, Nobukazu","Novel Open-Framework Material: Cerium Oxyfluoride with CeO~6~F~2~ Dodecahedron","Chemistry of Materials","2000","12","12","3527","3529","10.1021/cm0003830","","","0.7107","MoKα","","","0.0446","","","","0.0509","","","","","","1.9","","","","has coordinates","180555","2020-10-21","18:00:00",""
"4000025","8.8052","0.0002","11.7986","0.0002","17.7276","0.0003","75.884","0.001","86.163","0.001","77.333","0.001","1742.44","0.06","298","2","298","2","","","","","","","grown by electrocrystallization","5","P -1","-P 1","2","","Bis(ethylenedithio)tetrathiafulvalenium pentafluorothiomethylsulfonate","","- C21 H18 F5 O3 S18 -","- C21 H18 F5 O3 S18 -","- C42 H36 F10 O6 S36 -","2","1","","Ward, Brian H.; Schlueter, John A.; Geiser, Urs; Wang, H. Hau; Morales, Emilio; Parakka, James P.; Thomas, Seddon Y.; Williams, Jack M.; Nixon, Paul G.; Winter, R. W.; Gard, Gary L.; Koo, H.-J.; Whangbo, M.-H.","Comparison of the Crystal and Electronic Structures of Three 2:1 Salts of the Organic Donor Molecule BEDT-TTF with Pentafluorothiomethylsulfonate Anions SF~5~CH~2~SO~3~^-^, SF~5~CHFSO~3~^-^, and SF~5~CF~2~SO~3~^-^","Chemistry of Materials","2000","12","2","343","351","10.1021/cm990238q","","","0.71073","MoKα","","0.0686","0.0504","","0.1474","0.1319","","","","0.963","1.019","1.019","","","","","has coordinates,has disorder","178359","2020-10-21","18:00:00",""
"4000026","8.7965","0.0002","11.7264","0.0002","17.5763","0.0004","95.893","0.001","90.178","0.001","102.286","0.001","1761.55","0.06","293","2","293","2","","","","","","","grown by electrocrystallization","5","P -1","-P 1","2","","Bis(ethylenedithio)tetrathiafulvalenium pentafluorothiofluoromethylsulfonate","","- C21 H17 F6 O3 S18 -","- C21 H17 F6 O3 S18 -","- C42 H34 F12 O6 S36 -","2","1","","Ward, Brian H.; Schlueter, John A.; Geiser, Urs; Wang, H. Hau; Morales, Emilio; Parakka, James P.; Thomas, Seddon Y.; Williams, Jack M.; Nixon, Paul G.; Winter, R. W.; Gard, Gary L.; Koo, H.-J.; Whangbo, M.-H.","Comparison of the Crystal and Electronic Structures of Three 2:1 Salts of the Organic Donor Molecule BEDT-TTF with Pentafluorothiomethylsulfonate Anions SF~5~CH~2~SO~3~^-^, SF~5~CHFSO~3~^-^, and SF~5~CF~2~SO~3~^-^","Chemistry of Materials","2000","12","2","343","351","10.1021/cm990238q","","","0.71073","MoKα","","0.0647","0.0508","","","0.126","0.1378","","","","","","1.06","","","","has coordinates,has disorder","178359","2020-10-21","18:00:00",""
"4000027","7.6994","0.0002","13.1514","0.0002","17.6425","0.0004","81.323","0.001","87.416","0.001","74.994","0.001","1705.74","0.06","120","2","120","2","","","","","","","grown by electrocrystallization","5","P -1","-P 1","2","","Bis(ethylenedithio)tetrathiafulvalenium pentafluorothiodifluoromethylsulfonate","","- C21 H16 F7 O3 S18 -","- C21 H16 F7 O3 S18 -","- C42 H32 F14 O6 S36 -","2","1","","Ward, Brian H.; Schlueter, John A.; Geiser, Urs; Wang, H. Hau; Morales, Emilio; Parakka, James P.; Thomas, Seddon Y.; Williams, Jack M.; Nixon, Paul G.; Winter, R. W.; Gard, Gary L.; Koo, H.-J.; Whangbo, M.-H.","Comparison of the Crystal and Electronic Structures of Three 2:1 Salts of the Organic Donor Molecule BEDT-TTF with Pentafluorothiomethylsulfonate Anions SF~5~CH~2~SO~3~^-^, SF~5~CHFSO~3~^-^, and SF~5~CF~2~SO~3~^-^","Chemistry of Materials","2000","12","2","343","351","10.1021/cm990238q","","","0.71073","MoKα","","0.0653","0.045","","","0.1051","0.1161","","","","","","1.007","","","","has coordinates","178359","2020-10-21","18:00:00",""
"4000028","9.383","0.003","9.923","0.003","8.342","0.002","97.85","0.02","111.75","0.02","113.01","0.02","627","0.5","296.2","","296.2","","","","","","","","","6","P -1","-P 1","2","","","","- C4 H68 N6 O22 P4 Zr3 -","- C4 N6 O22 P4 Zr2.5 -","- C4 N6 O22 P4 Zr2.5 -","1","0.5","","Wang, Dan; Yu, Ranbo; Kumada, Nobuhiro; Kinomura, Nobukazu","Nonaqueous Synthesis and Characterization of a Novel Layered Zirconium Phosphate Templated with Mixed Organic and Inorganic Cations","Chemistry of Materials","2000","12","4","956","960","10.1021/cm990454z","","","0.7107","MoKα","","0.2028","0.0511","","0.0717","0.0563","","","","1.317","1.632","1.632","","","","","has coordinates","178372","2020-10-21","18:00:00",""
"4000029","8.6139","0.0004","14.929","0.001","9.3109","0.0004","90","","106.541","0.004","90","","1147.82","","293","","293","","","","","","","","solvothermal synthesis","6","C 1 c 1","C -2yc","9","","ethyldiammonium gallium dihydrogen phosphate diphosphate","","- C2 H12 Ga N2 O11 P3 -","- C2 H12 Ga N2 O11 P3 -","- C8 H48 Ga4 N8 O44 P12 -","4","1","","Chippindale, Ann M.","Amine-Templated Unidimensional Phosphate‒Diphosphates of Gallium and Vanadium, [NH~3~CH~2~CH~2~NH~3~][M(H~2~PO~4~)(P~2~O~7~)] (M = Ga, V)","Chemistry of Materials","2000","12","3","818","822","10.1021/cm990578b","","","1.5418","CuKα","","","0.0439","","","0.0503","","","","","1.1104","1.1104","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4000030","10.131","0.003","10.131","0.003","25.682","0.006","90","","90","","90","","2635.9","0.9","296.2","","296.2","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C28 H28 I O4 P -","- C28 H28 I O4 P -","- C112 H112 I4 O16 P4 -","4","1","","Bourgogne, Cyril; Fur, Yvette Le; Juen, Patrick; Masson, Patrick; Nicoud, Jean-François; Masse, René","Tetra(4-methoxyphenyl)phosphonium Iodide: A Twinned Crystal Built Up with Three-Dimensional Octupolar Nonlinear Optical Chromophores","Chemistry of Materials","2000","12","4","1025","1033","10.1021/cm991155c","","","0.5608","AgKα","","0.0482","0.048","","0.032","","0.032","","","1.163","","","1.16","","","","has coordinates","277839","2022-09-14","18:07:02",""
"4000693","15.119","0.006","11.23","0.006","8.327","0.006","90","","90","","90","","1413.8","1.4","295","2","295","2","","","","","","","","5","C m c m","-C 2c 2","63","","","","- C7 H14 I N5 S2 -","- C8 I N4 S2 -","- C32 I4 N16 S8 -","4","0.25","","Keith Prout; Stephen J. Heyes; Christopher M. Dobson; Andrew McDaid; Thierry Maris; Matthias Muller; Matthew J. Seaman","Variable-Temperature Studies of Order/Disorder Transitions in the Thiourea Pyridinium Halide Crystals by XRD and Solid-State 2H NMR","Chemistry of Material","2000","12","","3561","3569","10.1021/cm0001612","","","0.71073","MoKα","","","0.044","","","0.066","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4000694","14.869","","11.312","","8.305","","90","","90","","90","","1396.89","","110","2","110","2","","","","","","","","5","P 21 c n","P -2n 2a","33","","","","- C7 H14 I N5 S2 -","- C7 H14 I N5 S2 -","- C28 H56 I4 N20 S8 -","4","1","","Keith Prout; Stephen J. Heyes; Christopher M. Dobson; Andrew McDaid; Thierry Maris; Matthias Muller; Matthew J. Seaman","Variable-Temperature Studies of Order/Disorder Transitions in the Thiourea Pyridinium Halide Crystals by XRD and Solid-State 2H NMR","Chemistry of Material","2000","12","","3561","3569","10.1021/cm0001612","","","0.7107","MoKα","","","0.035","","","0.038","","","","","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4000695","14.563","0.008","10.561","0.004","8.398","0.002","90","","90","","90","","1291.6","0.9","265","2","265","2","","","","","","","","5","C m c m","-C 2c 2","63","","","","- C7 H14 Cl N5 S2 -","- C8 Cl N4 S2 -","- C32 Cl4 N16 S8 -","4","0.25","","Keith Prout; Stephen J. Heyes; Christopher M. Dobson; Andrew McDaid; Thierry Maris; Matthias Muller; Matthew J. Seaman","Variable-Temperature Studies of Order/Disorder Transitions in the Thiourea Pyridinium Halide Crystals by XRD and Solid-State 2H NMR","Chemistry of Material","2000","12","","3561","3569","10.1021/cm0001612","","","1.54178","CuKα","","","0.0817","","","","","","","","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4000696","29.021","0.001","10.418","0.001","8.374","0.005","90","","90","","90","","2531.8","1.5","110","2","110","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C7 H14 Cl N5 S2 -","- C6 Cl N6 S2 -","- C48 Cl8 N48 S16 -","8","1","","Keith Prout; Stephen J. Heyes; Christopher M. Dobson; Andrew McDaid; Thierry Maris; Matthias Muller; Matthew J. Seaman","Variable-Temperature Studies of Order/Disorder Transitions in the Thiourea Pyridinium Halide Crystals by XRD and Solid-State 2H NMR","Chemistry of Material","2000","12","","3561","3569","10.1021/cm0001612","","","1.54178","CuKα","","","0.0723","","","0.098","","","","","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4000697","14.771","0.007","10.897","0.004","8.368","0.002","90","","90","","90","","1346.9","0.9","295","2","295","2","","","","","","","","5","C m c m","-C 2c 2","63","","","","- C7 H14 Br N5 S2 -","- C8 Br N4 S2 -","- C32 Br4 N16 S8 -","4","0.25","","Keith Prout; Stephen J. Heyes; Christopher M. Dobson; Andrew McDaid; Thierry Maris; Matthias Muller; Matthew J. Seaman","Variable-Temperature Studies of Order/Disorder Transitions in the Thiourea Pyridinium Halide Crystals by XRD and Solid-State 2H NMR","Chemistry of Material","2000","12","","3561","3569","10.1021/cm0001612","","","0.71073","MoKα","","","0.0408","","","0.047","","","","","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4000698","44.128","0.006","10.789","0.0006","8.351","0.001","90","","90","","90","","3975.9","0.8","150","2","150","2","","","","","","","","5","C m c 21","C 2c -2","36","","","","- C7 H14 Br N5 S2 -","- C8 Br N4 S2 -","- C96 Br12 N48 S24 -","12","1.5","","Keith Prout; Stephen J. Heyes; Christopher M. Dobson; Andrew McDaid; Thierry Maris; Matthias Muller; Matthew J. Seaman","Variable-Temperature Studies of Order/Disorder Transitions in the Thiourea Pyridinium Halide Crystals by XRD and Solid-State 2H NMR","Chemistry of Material","2000","12","","3561","3569","10.1021/cm0001612","","","1.5418","CuKα","","","0.059","","","0.057","","","","","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4000699","14.431","0.002","10.984","0.002","8.291","0.005","90","","90","","90","","1314.2","0.8","100","2","100","2","","","","","","","","5","P 21 c n","P -2n 2a","33","","","","- C7 H14 Br N5 S2 -","- C7 H14 Br N5 S2 -","- C28 H56 Br4 N20 S8 -","4","1","","Keith Prout; Stephen J. Heyes; Christopher M. Dobson; Andrew McDaid; Thierry Maris; Matthias Muller; Matthew J. Seaman","Variable-Temperature Studies of Order/Disorder Transitions in the Thiourea Pyridinium Halide Crystals by XRD and Solid-State 2H NMR","Chemistry of Material","2000","12","","3561","3569","10.1021/cm0001612","","","1.5418","CuKα","","","0.0347","","","0.05","","","","","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001727","7.575","","5.92","","12.148","","90","","113.56","","90","","499.354","","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","K2 (Ag2 Sn Se4)","","- Ag2 K2 Se4 Sn -","- Ag2 K2 Se4 Sn -","- Ag4 K4 Se8 Sn2 -","2","0.5","","Fu, A.-H.; Chen, X.; Huang, X.-Y.; Guo, H.-Y.; Li, J.; Zhang, L.-D.","From 1D chain to 3D network: syntheses, structures, and 1D properties of K2 Mn Sn2 Se6, K2 Mn Sn Se4, and K2 Ag2 Sn Se4","Chemistry of Materials (1,1989-)","2000","12","","2385","2391","","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001751","5.1328","","5.1328","","16.65189","","90","","90","","120","","379.929","","","","","","","","","","","","","3","P 6/m m m","-P 6 2","191","","Nd5 Co19 B6","","- B6 Co19 Nd5 -","- B6 Co19 Nd5 -","- B6 Co19 Nd5 -","1","0.0416667","","Liang, J.K.; Rao, G.-H.; Chen, X.L.; Li, X.; Jin, L.P.; Liu, Q.L.; Shen, B.-G.; Wang, M.Z.; Chen, Y.","Phase relation, crystal structures and magnetic properties of Nd - Co - B borides","Chemistry of Materials (1,1989-)","2000","12","","1240","1247","","","","","","","","","","","","","","","","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001896","8.2483","0.0006","8.2483","0.0006","8.2483","0.0006","90","","90","","90","","561.17","0.07","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Lithium Manganese(III) Manganese(IV) Oxide","","- Li Mn2 O4 -","- Li Mn2 O4 -","- Li8 Mn16 O32 -","8","0.0416667","","Akimoto, Junji; Takahashi, Yasuhiko; Gotoh, Yoshito; Mizuta, Susumu","Single crystal X-ray diffraction study of the spinel-type LiMn~2~O~4~","Chemistry of Materials","2000","12","11","3246","3248","10.1021/cm0003673","","","","","","0.024","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002219","5.415","","5.5224","","7.7066","","90","","89.969","","90","","230.457","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Ca2 (Fe Mo O6)","","- Ca2 Fe Mo O6 -","- Ca2 Fe Mo O6 -","- Ca4 Fe2 Mo2 O12 -","2","0.5","","Alonso, J.A.; Casais, M.T.; Velasco, P.; Martinez-Lopez, M.J.; Martinez, J.L.; Munoz, A.; Fernandez-Diaz, M.T.","Preparation, crystal structure, and magnetic and magnetotransport properties of the double perovskite Ca2 Fe Mo O6","Chemistry of Materials (1,1989-)","2000","12","","161","168","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002220","7.2219","","10.0354","","12.9278","","90","","91.447","","90","","936.639","","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","K1.2 H0.8 Ti (Si3 O9) (H2 O)1.8","","- H4.4 K1.2 O10.8 Si3 Ti -","- K1.2 O10.8 Si3 Ti -","- K4.8 O43.2 Si12 Ti4 -","4","1","","Bortun, A.I.; Poojary, D.M.; Bortun, L.N.; Clearfield, A.; Xiang, O.-Y.","Synthesis, characterization, and ion exchange behaviour of a framework potassium titanium trisilicate K2 Ti Si3 O9 . (H2 O) and its protonated phases","Chemistry of Materials (1,1989-)","2000","12","","294","305","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002221","9.683","","9.683","","9.518","","90","","90","","120","","772.852","","","","","","","","","","","","","4","P -6","P -6","174","","Ba3 Co2 O6 (C O3)0.6","","- C0.6 Ba3 Co2 O7.8 -","- C0.595 Ba3 Co2 O7.785 -","- C2.38 Ba12 Co8 O31.14 -","4","0.666667","","Boulahya, K.; Amador, U.; Parras, M.; Gonzalez-Calbet, J.M.","The oxycarbonate Ba3 Co2 O6 (C O3)0.60 with a 2H-(A B O3)-related structure","Chemistry of Materials (1,1989-)","2000","12","","966","972","","","","","","","","","","","","","","","","","","","","","","has coordinates","140443","2020-10-21","18:00:00",""
"4002222","7.386","","22.45399","","14.018","","90","","90","","90","","2324.82","","","","","","","","","","","","","3","C m c m","-C 2c 2","63","","(C14 N2 H30) (Si18 O36 (O H)2) (H2 O)2","","- C14 O38 Si18 -","- C14 O38 Si18 -","- C28 O76 Si36 -","2","0.125","","Burton, A.; Accardi, R.J.; Lobo, R.F.; Deem, M.W.; Falcioni, M.","MCM-47: a highly crystalline silicate composed of hydrogen-bonded ferrierite layers","Chemistry of Materials (1,1989-)","2000","12","","2936","2942","","","","","","","","","","","","","","","","","","","","","","has coordinates","140492","2020-10-21","18:00:00",""
"4002223","7.1678","","7.9291","","4.89409","","86.874","","102.686","","113.792","","248.119","","","","","","","","","","","","","4","P -1","-P 1","2","","Ho2 (Cu Ge4 O12)","","- Cu Ge4 Ho2 O12 -","- Cu Ge4 Ho2 O12 -","- Cu Ge4 Ho2 O12 -","1","0.5","","Cascales, C.; Monge, M.A.; Fernandez Diaz, M.T.","Low-temperature magnetic ordering in rare-earth copper germanates R2 Cu Ge4 O12, R = Ho, Er","Chemistry of Materials (1,1989-)","2000","12","","3369","3375","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002224","7.1594","","7.9205","","4.9075","","86.926","","102.651","","113.735","","248.376","","","","","","","","","","","","","4","P -1","-P 1","2","","Er2 (Cu Ge4 O12)","","- Cu Er2 Ge4 O12 -","- Cu Er2 Ge4 O12 -","- Cu Er2 Ge4 O12 -","1","0.5","","Cascales, C.; Fernandez Diaz, M.T.; Monge, M.A.","Low-temperature magnetic ordering in rare-earth copper germanates R2 Cu Ge4 O12, R = Ho, Er","Chemistry of Materials (1,1989-)","2000","12","","3369","3375","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002225","8.167","","8.167","","19.724","","90","","90","","90","","1315.59","","","","","","","","","","","","","4","P 4/n c c :2","-P 4a 2ac","130","","K2 (Mn Sn2 Se6)","","- K2 Mn Se6 Sn2 -","- K2 Mn Se6 Sn2 -","- K8 Mn4 Se24 Sn8 -","4","0.25","","Chen, X.; Huang, X.-Y.; Fu, A.-H.; Li, J.; Zhang, L.-D.; Guo, H.-Y.","From 1D chain to 3D network: syntheses, structures, and 1D properties of K2 Mn Sn2 Se6, K2 Mn Sn Se4, and K2 Ag2 Sn Se4","Chemistry of Materials (1,1989-)","2000","12","","2385","2391","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002226","10.574","","10.574","","8.301","","90","","90","","90","","928.13","","","","","","","","","","","","","4","P -4 n 2","P -4 -2n","118","","K2 (Mn Sn Se4)","","- K2 Mn Se4 Sn -","- K2 Mn Se4 Sn -","- K8 Mn4 Se16 Sn4 -","4","0.5","","Chen, X.; Zhang, L.-D.; Huang, X.-Y.; Fu, A.-H.; Li, J.; Guo, H.-Y.","From 1D chain to 3D network: syntheses, structures, and 1D properties of K2 Mn Sn2 Se6, K2 Mn Sn Se4, and K2 Ag2 Sn Se4","Chemistry of Materials (1,1989-)","2000","12","","2385","2391","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002227","7.652","","7.652","","4.96","","90","","90","","90","","290.423","","","","","","","","","","","","","4","P -4 21 m","P -4 2ab","113","","Y2 (Si3 O3 N4)","","- N4 O3 Si3 Y2 -","- N4 O3 Si3 Y2 -","- N8 O6 Si6 Y4 -","2","0.25","","Fang, C.M.; de Wijs, G.A.; de Groot, R.A.; Metselaar, R.; Hintzen, H.T.; de With, G.","O/N ordering in Y2 Si3 O3 N4 with the melilite-type structure from first-principles calculations","Chemistry of Materials (1,1989-)","2000","12","","1071","1075","","","","","","","","","","","","","","","","","","","","","","has coordinates","140594","2020-10-21","18:00:00",""
"4002228","5.6991","","5.6991","","4.8148","","90","","90","","120","","135.432","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","Ba (Mn O3)","","- Ba Mn O3 -","- Ba Mn O3 -","- Ba2 Mn2 O6 -","2","0.0833333","","Cussen, E.J.; Battle, P.D.","Crystal and magnetic structures of 2H Ba Mn O3","Chemistry of Materials (1,1989-)","2000","12","","831","838","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002229","9.8467","","9.8467","","4.8075","","90","","90","","120","","403.675","","","","","","","","","","","","","3","P 63 c m","P 6c -2","185","","Ba (Mn O3)","","- Ba Mn O3 -","- Ba Mn O3 -","- Ba6 Mn6 O18 -","6","0.5","","Cussen, E.J.; Battle, P.D.","Crystal and magnetic structures of 2H Ba Mn O3","Chemistry of Materials (1,1989-)","2000","12","","831","838","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002230","5.8003","","5.8003","","38.958","","90","","90","","120","","1135.08","","","","","","","","","","","","","4","P -6 m 2","P -6 2","187","","","","- Ba4 Ca0.9 Mn3.1 O11.5 -","- Ba4 Ca0.9 Mn3.1 O11.5 -","- Ba16 Ca3.6 Mn12.4 O46 -","4","0.333333","","Floros, N.; Michel, C.; Hervieu, M.; Raveau, B.","A new hexagonal 16L perovskite-related structure: Ba4 Ca1-x Mn3+x O12-d","Chemistry of Materials (1,1989-)","2000","12","","3197","3201","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4002231","7.2014","","7.2014","","7.2014","","90","","90","","90","","373.466","","","","","","","","","","","","","3","P 21 3","P 2ac 2ab 3","198","","(La2 Mo2 O9)0.889","","- La1.778 Mo1.778 O8.001 -","- La1.778 Mo1.778 O8 -","- La3.556 Mo3.556 O16 -","2","0.166667","","Goutenoire, F.; Isnard, O.; Retoux, R.; Lacorre, P.","Crystal structure of La2 Mo2 O9, a new fast oxide-ion conductor","Chemistry of Materials (1,1989-)","2000","12","","2575","2580","","","","","","","","","","","","","","","","","","","","","","has coordinates","140725","2020-10-21","18:00:00",""
"4002232","12.544","","8.934","","11.3222","","90","","90","","90","","1268.86","","","","","","","","","","","","","5","P b c n","-P 2n 2ab","60","","Rb2 (Te Mo2 O6 (P O4)2)","","- Mo2 O14 P2 Rb2 Te -","- Mo2 O14 P2 Rb2 Te -","- Mo8 O56 P8 Rb8 Te4 -","4","0.5","","Guesdon, A.; Raveau, B.","A series of Mo(VI) monophosphates involving the lone pair cation Te(IV): A2 Te Mo2 O6 (P O4)2 (A = K, Rb, Tl, Cs)","Chemistry of Materials (1,1989-)","2000","12","","2239","2243","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002233","19.202","","5.4561","","5.415","","90","","90","","90","","567.319","","","","","","","","","","","","","4","C m c m","-C 2c 2","63","","La Ca2 (Mn2 O7)","","- Ca2 La Mn2 O7 -","- Ca2 La Mn2 O7 -","- Ca8 La4 Mn8 O28 -","4","0.25","","Green, M.A.; Neumann, D.A.","Synthesis, structure and electronic properties of La Ca2 Mn2 O7","Chemistry of Materials (1,1989-)","2000","12","","90","97","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002234","12.503","","8.912","","11.3","","90","","90","","90","","1259.12","","","","","","","","","","","","","5","P b c n","-P 2n 2ab","60","","Tl2 (Te Mo2 O6 (P O4)2)","","- Mo2 O14 P2 Te Tl2 -","- Mo2 O14 P2 Te Tl2 -","- Mo8 O56 P8 Te4 Tl8 -","4","0.5","","Guesdon, A.; Raveau, B.","A series of Mo(VI) monophosphates involving the lone pair cation Te(IV): A2 Te Mo2 O6 (P O4)2 (A = K, Rb, Tl, Cs)","Chemistry of Materials (1,1989-)","2000","12","","2239","2243","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002235","12.367","","9.4907","","11.515","","90","","90","","90","","1351.53","","","","","","","","","","","","","5","P b c n","-P 2n 2ab","60","","Cs2 (Te Mo2 O6 (P O4)2)","","- Cs2 Mo2 O14 P2 Te -","- Cs2 Mo2 O14 P2 Te -","- Cs8 Mo8 O56 P8 Te4 -","4","0.5","","Guesdon, A.; Raveau, B.","A series of Mo(VI) monophosphates involving the lone pair cation Te(IV): A2 Te Mo2 O6 (P O4)2 (A = K, Rb, Tl, Cs) D","Chemistry of Materials (1,1989-)","2000","12","","2239","2243","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002236","10.1715","","10.1715","","10.1715","","90","","90","","90","","1052.34","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","(Mn2 Y2) (Mn Sb3) O14","","- Mn3 O14 Sb3 Y2 -","- Mn3 O14 Sb3 Y2 -","- Mn12 O56 Sb12 Y8 -","4","0.0208333","","Garcia Casado, P.; Alonso, J.A.; Rasines, I.; Fernandez, M.T.; Martinez, J.L.","A new family of manganese(II,III) - rare earth pyrochlores","Chemistry of Materials (1,1989-)","2000","12","","1217","1221","","","","","","","","","","","","","","","","","","","","","","has coordinates","140785","2020-10-21","18:00:00",""
"4002237","10.1227","","10.1227","","10.1227","","90","","90","","90","","1037.26","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","(Mn2 In2) (Mn Sb3) O14","","- In2 Mn3 O14 Sb3 -","- In2 Mn3 O14 Sb3 -","- In8 Mn12 O56 Sb12 -","4","0.0208333","","Garcia Casado, P.; Alonso, J.A.; Martinez, J.L.; Fernandez, M.T.; Rasines, I.","A new family of manganese(II,III) - rare earth pyrochlores","Chemistry of Materials (1,1989-)","2000","12","","1217","1221","","","","","","","","","","","","","","","","","","","","","","has coordinates","140787","2020-10-21","18:00:00",""
"4002238","10.347","","10.347","","10.347","","90","","90","","90","","1107.75","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","(Mn2 La2) (Mn Sb3) O14","","- La2 Mn3 O14 Sb3 -","- La2 Mn3 O14 Sb3 -","- La8 Mn12 O56 Sb12 -","4","0.0208333","","Garcia Casado, P.; Alonso, J.A.; Martinez, J.L.; Fernandez, M.T.; Rasines, I.","A new family of manganese(II,III) - rare earth pyrochlores","Chemistry of Materials (1,1989-)","2000","12","","1217","1221","","","","","","","","","","","","","","","","","","","","","","has coordinates","140789","2020-10-21","18:00:00",""
"4002239","10.3014","","10.3014","","10.3014","","90","","90","","90","","1093.17","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","(Mn2 Pr2) (Mn Sb3) O14","","- Mn3 O14 Pr2 Sb3 -","- Mn3 O14 Pr2 Sb3 -","- Mn12 O56 Pr8 Sb12 -","4","0.0208333","","Garcia Casado, P.; Martinez, J.L.; Alonso, J.A.; Fernandez, M.T.; Rasines, I.","A new family of manganese(II,III) - rare earth pyrochlores","Chemistry of Materials (1,1989-)","2000","12","","1217","1221","","","","","","","","","","","","","","","","","","","","","","has coordinates","140791","2020-10-21","18:00:00",""
"4002240","10.2809","","10.2809","","10.2809","","90","","90","","90","","1086.66","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","(Mn2 Nd2) (Mn Sb3) O14","","- Mn3 Nd2 O14 Sb3 -","- Mn3 Nd2 O14 Sb3 -","- Mn12 Nd8 O56 Sb12 -","4","0.0208333","","Garcia Casado, P.; Alonso, J.A.; Martinez, J.L.; Fernandez, M.T.; Rasines, I.","A new family of manganese(II,III) - rare earth pyrochlores","Chemistry of Materials (1,1989-)","2000","12","","1217","1221","","","","","","","","","","","","","","","","","","","","","","has coordinates","140793","2020-10-21","18:00:00",""
"4002241","10.2297","","10.2297","","10.2297","","90","","90","","90","","1070.51","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","(Mn2 Eu2) (Mn Sb3) O14","","- Eu2 Mn3 O14 Sb3 -","- Eu2 Mn3 O14 Sb3 -","- Eu8 Mn12 O56 Sb12 -","4","0.0208333","","Garcia Casado, P.; Alonso, J.A.; Martinez, J.L.; Fernandez, M.T.; Rasines, I.","A new family of manganese(II,III) - rare earth pyrochlores","Chemistry of Materials (1,1989-)","2000","12","","1217","1221","","","","","","","","","","","","","","","","","","","","","","has coordinates","140795","2020-10-21","18:00:00",""
"4002242","10.219","","10.219","","10.219","","90","","90","","90","","1067.15","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","(Mn2 Gd2) (Mn Sb3) O14","","- Gd2 Mn3 O14 Sb3 -","- Gd2 Mn3 O14 Sb3 -","- Gd8 Mn12 O56 Sb12 -","4","0.0208333","","Garcia Casado, P.; Martinez, J.L.; Alonso, J.A.; Fernandez, M.T.; Rasines, I.","A new family of manganese(II,III) - rare earth pyrochlores","Chemistry of Materials (1,1989-)","2000","12","","1217","1221","","","","","","","","","","","","","","","","","","","","","","has coordinates","140797","2020-10-21","18:00:00",""
"4002243","10.2083","","10.2083","","10.2083","","90","","90","","90","","1063.8","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","(Mn2 Tb2) (Mn Sb3) O14","","- Mn3 O14 Sb3 Tb2 -","- Mn3 O14 Sb3 Tb2 -","- Mn12 O56 Sb12 Tb8 -","4","0.0208333","","Garcia Casado, P.; Alonso, J.A.; Martinez, J.L.; Rasines, I.; Fernandez, M.T.","A new family of manganese(II,III) - rare earth pyrochlores","Chemistry of Materials (1,1989-)","2000","12","","1217","1221","","","","","","","","","","","","","","","","","","","","","","has coordinates","140799","2020-10-21","18:00:00",""
"4002244","10.1871","","10.1871","","10.1871","","90","","90","","90","","1057.19","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","(Mn2 Dy2) (Mn Sb3) O14","","- Dy2 Mn3 O14 Sb3 -","- Dy2 Mn3 O14 Sb3 -","- Dy8 Mn12 O56 Sb12 -","4","0.0208333","","Garcia Casado, P.; Alonso, J.A.; Fernandez, M.T.; Martinez, J.L.; Rasines, I.","A new family of manganese(II,III) - rare earth pyrochlores","Chemistry of Materials (1,1989-)","2000","12","","1217","1221","","","","","","","","","","","","","","","","","","","","","","has coordinates","140800","2020-10-21","18:00:00",""
"4002245","10.1714","","10.1714","","10.1714","","90","","90","","90","","1052.31","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","(Mn2 Ho2) (Mn Sb3) O14","","- Ho2 Mn3 O14 Sb3 -","- Ho2 Mn3 O14 Sb3 -","- Ho8 Mn12 O56 Sb12 -","4","0.0208333","","Garcia Casado, P.; Alonso, J.A.; Martinez, J.L.; Fernandez, M.T.; Rasines, I.","A new family of manganese(II,III) - rare earth pyrochlores","Chemistry of Materials (1,1989-)","2000","12","","1217","1221","","","","","","","","","","","","","","","","","","","","","","has coordinates","140802","2020-10-21","18:00:00",""
"4002246","10.1591","","10.1591","","10.1591","","90","","90","","90","","1048.49","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","(Mn2 Er2) (Mn Sb3) O14","","- Er2 Mn3 O14 Sb3 -","- Er2 Mn3 O14 Sb3 -","- Er8 Mn12 O56 Sb12 -","4","0.0208333","","Garcia Casado, P.; Alonso, J.A.; Martinez, J.L.; Fernandez, M.T.; Rasines, I.","A new family of manganese(II,III) - rare earth pyrochlores","Chemistry of Materials (1,1989-)","2000","12","","1217","1221","","","","","","","","","","","","","","","","","","","","","","has coordinates","140804","2020-10-21","18:00:00",""
"4002247","10.1515","","10.1515","","10.1515","","90","","90","","90","","1046.14","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","(Mn2 Tm2) (Mn Sb3) O14","","- Mn3 O14 Sb3 Tm2 -","- Mn3 O14 Sb3 Tm2 -","- Mn12 O56 Sb12 Tm8 -","4","0.0208333","","Garcia Casado, P.; Rasines, I.; Alonso, J.A.; Fernandez, M.T.; Martinez, J.L.","A new family of manganese(II,III) - rare earth pyrochlores","Chemistry of Materials (1,1989-)","2000","12","","1217","1221","","","","","","","","","","","","","","","","","","","","","","has coordinates","140806","2020-10-21","18:00:00",""
"4002248","10.1386","","10.1386","","10.1386","","90","","90","","90","","1042.16","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","(Mn2 Yb2) (Mn Sb3) O14","","- Mn3 O14 Sb3 Yb2 -","- Mn3 O14 Sb3 Yb2 -","- Mn12 O56 Sb12 Yb8 -","4","0.0208333","","Garcia Casado, P.; Alonso, J.A.; Rasines, I.; Martinez, J.L.; Fernandez, M.T.","A new family of manganese(II,III) - rare earth pyrochlores","Chemistry of Materials (1,1989-)","2000","12","","1217","1221","","","","","","","","","","","","","","","","","","","","","","has coordinates","140808","2020-10-21","18:00:00",""
"4002249","10.1316","","10.1316","","10.1316","","90","","90","","90","","1040","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","(Mn2 Lu2) (Mn Sb3) O14","","- Lu2 Mn3 O14 Sb3 -","- Lu2 Mn3 O14 Sb3 -","- Lu8 Mn12 O56 Sb12 -","4","0.0208333","","Garcia Casado, P.; Rasines, I.; Alonso, J.A.; Martinez, J.L.; Fernandez, M.T.","A new family of manganese(II,III) - rare earth pyrochlores","Chemistry of Materials (1,1989-)","2000","12","","1217","1221","","","","","","","","","","","","","","","","","","","","","","has coordinates","140810","2020-10-21","18:00:00",""
"4002250","7.6209","","7.6209","","6.32","","90","","90","","90","","367.054","","","","","","","","","","","","","4","P -4","P -4","81","","Cu2 Te2 O5 Cl2","","- Cl2 Cu2 O5 Te2 -","- Cl2 Cu2 O5 Te2 -","- Cl4 Cu4 O10 Te4 -","2","0.5","","Johnsson, M.; Tornroos, K.W.; Mila, F.; Millet, P.","Tetrahedral clusters of copper(II): crystal structures and magnetic properties of Cu2 Te2 O5 X2 (X = Cl, Br)","Chemistry of Materials (1,1989-)","2000","12","","2853","2857","","","","","","","","","","","","","","","","","","","","","","has coordinates","140936","2020-10-21","18:00:00",""
"4002251","7.8355","","7.8355","","6.3785","","90","","90","","90","","391.608","","","","","","","","","","","","","4","P -4","P -4","81","","Cu2 Te2 O5 Br2","","- Br2 Cu2 O5 Te2 -","- Br2 Cu2 O5 Te2 -","- Br4 Cu4 O10 Te4 -","2","0.5","","Johnsson, M.; Tornroos, K.W.; Mila, F.; Millet, P.","Tetrahedral clusters of copper(II): crystal structures and magnetic properties of Cu2 Te2 O5 X2 (X = Cl, Br)","Chemistry of Materials (1,1989-)","2000","12","","2853","2857","","","","","","","","","","","","","","","","","","","","","","has coordinates","140938","2020-10-21","18:00:00",""
"4002252","11.21661","","11.21661","","11.21661","","90","","90","","90","","1411.19","","","","","","","","","","","","","3","I m -3","-I 2 2 3","204","","K3.07 Ba2.90 C60","","- C60 Ba2.9 K3.07 -","- C60 Ba2.904 K3.072 -","- C120 Ba5.808 K6.144 -","2","0.0416667","","Margadonna, S.; Aslanis, E.; Li, W.Z.; Prassides, K.; Fitch, A.N.; Hansen, T.C.","Crystal structure of superconducting K3 Ba3 C60 : a combined synchrotron X-ray and neutron diffraction study","Chemistry of Materials (1,1989-)","2000","12","","2736","2740","","","","","","","","","","","","","","","","","","","","","","has coordinates","141035","2020-10-21","18:00:00",""
"4002253","8.727","","8.727","","21.80779","","90","","90","","120","","1438.38","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","Na3 Fe2 (P O4)3","","- Fe2 Na3 O12 P3 -","- Fe2 Na3.01 O12 P3 -","- Fe12 Na18.06 O72 P18 -","6","0.166667","","Masquelier, C.; Wurm, C.; Rodriguez-Carvajal, J.; Gaubicher, J.; Nazar, L.","A powder neutron diffraction investigation of the two rhombohedral NASICON analogues: gamma-(Na3 Fe2 (P O4)3) and Li3 Fe2 (P O4)3","Chemistry of Materials (1,1989-)","2000","12","","525","532","","","","","","","","","","","","","","","","","","","","","","has coordinates","141040","2020-10-21","18:00:00",""
"4002254","8.3162","","8.3162","","22.459","","90","","90","","120","","1345.15","","","","","","","","","","","","","4","R -3 :H","-R 3","148","","Li3 Fe2 (P O4)3","","- Fe2 Li3 O12 P3 -","- Fe2 Li3 O12 P3 -","- Fe12 Li18 O72 P18 -","6","0.333333","","Masquelier, C.; Rodriguez-Carvajal, J.; Wurm, C.; Gaubicher, J.; Nazar, L.","A powder neutron diffraction investigation of the two rhombohedral NASICON analogues: gamma-(Na3 Fe2 (P O4)3) and Li3 Fe2 (P O4)3","Chemistry of Materials (1,1989-)","2000","12","","525","532","","","","","","","","","","","","","","","","","","","","","","has coordinates","141041","2020-10-21","18:00:00",""
"4002255","5.9207","","3.4249","","6.3836","","90","","107.96","","90","","123.138","","","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","In0.99 Ti0.76 Fe0.25 O3.36","","- Fe0.25 In0.99 O3.36 Ti0.76 -","- Fe0.25 In0.99 O3.36 Ti0.76 -","- Fe0.5 In1.98 O6.72 Ti1.52 -","2","0.25","","Michiue, Y.; Onoda, M.; Brown, F.; Kimizuka, N.; Nakamura, M.; Watanabe, M.; Orita, M.; Ohta, H.","Crystal structure of In Ti0.75 Fe0.25 O3.375 and phase relations in the pseudobinary system In Fe O3 - In2 Ti2 O7 at 1300 C","Chemistry of Materials (1,1989-)","2000","12","","2244","2249","","","","","","","","","","","","","","","","","","","","","","has coordinates","141065","2020-10-21","18:00:00",""
"4002256","6.02","","6.02","","14.726","","90","","90","","120","","462.177","","","","","","","","","","","","","3","R 3 :H","R 3","146","","(Li0.275 Ni0.725) O","","- Li0.275 Ni0.725 O -","- Li0.275 Ni0.725 O -","- Li6.6 Ni17.4 O24 -","24","2.66667","","Monge, M.A.; Gutierrez-Puebla, E.; Martinez, J.L.; Campa, J.A.; Rasines, I.","Cation distribution in lithium nickel oxide crystals","Chemistry of Materials (1,1989-)","2000","12","","2001","2007","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002257","18.937","","18.937","","12.484","","90","","90","","120","","3877.1","","","","","","","","","","","","","4","P 31","P 31","144","","K5 (Co W12 O40) (H2 O)20","","- Co K2 O52 W12 -","- Co K2 O52 W12 -","- Co3 K6 O156 W36 -","3","1","","Muncaster, G.; Thomas, J.M.; Catlow, C.R.A.; Sankar, G.; Coles, S.J.; Hursthouse, M.","The local structure of tetrahedral Co(III): a detailed crystal structure investigation of K5 Co(III) W12 O40 . 20(H2 O)","Chemistry of Materials (1,1989-)","2000","12","","16","18","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002258","10.3369","","8.2125","","5.0074","","90","","90","","90","","425.087","","","","","","","","","","","","","5","P n a 21","P 2c -2n","33","","Li (Al Si O4) (H2 O)","","- Al H2 Li O5 Si -","- Al Li O5 Si -","- Al4 Li4 O20 Si4 -","4","1","","Norby, P.; Hanson, J.C.; Fitch, A.N.; Vaughan, G.; Flaks, L.; Gualtieri, A.","Formation of alpha-eucryptite, Li Al Si O4: an in-situ synchrotron X-ray powder diffraction study of a high temperature hydrothermal synthesis","Chemistry of Materials (1,1989-)","2000","12","","1473","1479","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002259","8.605","","4.951","","10.06","","90","","90","","90","","428.59","","","","","","","","","","","","","4","C m c a","-C 2ac 2","64","","Li0.667 (Ni0.333 Mn0.667) O2","","- Li0.667 Mn0.667 Ni0.333 O2 -","- Li0.666667 Mn0.666667 Ni0.333333 O2 -","- Li8 Mn8 Ni4 O24 -","12","","","Paulsen, J.M.; Donaberger, R.A.; Dahn, J.R.","Layered T2-, O6-, O2-, and P2-type A2/3 (M'(2+)1/3 M(4+)2/3) O2 bronzes, A = Li, Na; M' = Ni, Mg; M = Mn, Ti","Chemistry of Materials (1,1989-)","2000","12","","2257","2267","","","","","","","","","","","","","","","","","","","","","","has coordinates","141093","2020-10-21","18:00:00",""
"4002260","2.885","","2.885","","11.155","","90","","90","","120","","80.407","","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","Na0.58 (Ni0.333 Mn0.667) O1.95","","- Mn0.667 Na0.58 Ni0.333 O1.95 -","- Mn0.667 Na0.58 Ni0.333 O1.95 -","- Mn1.334 Na1.16 Ni0.666 O3.9 -","2","0.0833333","","Paulsen, J.M.; Donaberger, R.A.; Dahn, J.R.","Layered T2-, O6-, O2-, and P2-type A2/3 (M'(2+)1/3 M(4+)2/3) O2 bronzes, A = Li, Na; M' = Ni, Mg; M = Mn, Ti","Chemistry of Materials (1,1989-)","2000","12","","2257","2267","","","","","","","","","","","","","","","","","","","","","","has coordinates","141094","2020-10-21","18:00:00",""
"4002261","4.926","","8.532","","9.706","","90","","99.74","","90","","402.05","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","Li0.667 (Mg0.3 Mn0.7) O2","","- Mg0.3 Mn0.7 O2 -","- Mg0.3 Mn0.7 O2 -","- Mg3.6 Mn8.4 O24 -","12","1.5","","Paulsen, J.M.; Donaberger, R.A.; Dahn, J.R.","Layered T2-, O6-, O2-, and P2-type A2/3 (M'(2+)1/3 M(4+)2/3) O2 bronzes, A = Li, Na; M' = Ni, Mg; M = Mn, Ti","Chemistry of Materials (1,1989-)","2000","12","","2257","2267","","","","","","","","","","","","","","","","","","","","","","has coordinates","141095","2020-10-21","18:00:00",""
"4002262","5.009","","5.009","","11.218","","90","","90","","120","","243.752","","","","","","","","","","","","","4","P 63/m c m","-P 6c 2","193","","Na0.547 (Mg0.25 Mn0.75) O2.09","","- Mg0.25 Mn0.75 Na0.547 O2.09 -","- Mg0.25 Mn0.75 Na0.546333 O2.09 -","- Mg1.5 Mn4.5 Na3.278 O12.54 -","6","0.25","","Paulsen, J.M.; Donaberger, R.A.; Dahn, J.R.","Layered T2-, O6-, O2-, and P2-type A2/3 (M'(2+)1/3 M(4+)2/3) O2 bronzes, A = Li, Na; M' = Ni, Mg; M = Mn, Ti","Chemistry of Materials (1,1989-)","2000","12","","2257","2267","","","","","","","","","","","","","","","","","","","","","","has coordinates","141096","2020-10-21","18:00:00",""
"4002263","9.661","","9.661","","9.661","","90","","90","","90","","901.709","","","","","","","","","","","","","3","F -4 3 m","F -4 2 3","216","","Ga V4 S8","","- Ga S8 V4 -","- Ga S8 V4 -","- Ga4 S32 V16 -","4","0.0416667","","Pocha, R.; Johrendt, D.; Poettgen, R.","Electronic and structural instabilities in Ga V4 S8 and Ga Mo4 S8","Chemistry of Materials (1,1989-)","2000","12","","2882","2887","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002264","6.799","","6.799","","16.782","","90","","90","","120","","671.838","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","Ga V4 S8","","- Ga S8 V4 -","- Ga S8 V4 -","- Ga3 S24 V12 -","3","0.166667","","Pocha, R.; Poettgen, R.; Johrendt, D.","Electronic and structural instabilities in Ga V4 S8 and Ga Mo4 S8","Chemistry of Materials (1,1989-)","2000","12","","2882","2887","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002265","7.1964","","7.0367","","5.5139","","84.44","","113.462","","112.319","","236.459","","","","","","","","","","","","","4","P -1","-P 1","2","","Na0.886 (Bi3.114 V2 O9.792)","","- Bi3.114 Na0.886 O9.792 V2 -","- Bi3.114 Na0.886 O9.792 V2 -","- Bi3.114 Na0.886 O9.792 V2 -","1","0.5","","Porob, D.G.; Guru Row, T.N.","A novel oxide ion conductor in a doped Bi2 O3 - V2 O5 system: ab initio structure of a new polymorph of Na Bi3 V2 O10 via powder X-ray diffraction","Chemistry of Materials (1,1989-)","2000","12","","3658","3661","","","","","","","","","","","","","","","","","","","","","","has coordinates","141103","2020-10-21","18:00:00",""
"4002266","6.3009","","8.413","","9.937","","107.894","","90.247","","92.782","","500.581","","","","","","","","","","","","","4","P -1","-P 1","2","","Li5.88 Co5.06 (P2 O7)4","","- Co5.06 Li5.88 O28 P8 -","- Co5.122 Li5.878 O28 P8 -","- Co5.122 Li5.878 O28 P8 -","1","0.5","","Sanz, F.; Parada, C.; Ruiz-Valero, C.","Crystal growth, crystal structure, and magnetic properties of a new lithium cobalt diphosphate","Chemistry of Materials (1,1989-)","2000","12","","671","676","","","","","","","","","","","","","","","","","","","","","","has coordinates","141113","2020-10-21","18:00:00",""
"4002267","10.311","","9.749","","10.225","","90","","90","","90","","1027.84","","","","","","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","K (Al Ge O4) (H2 O)","","- Al Ge H2 K O5 -","- Al Ge K O5 -","- Al8 Ge8 K8 O40 -","8","1","","Tripathi, A.; Parise, J.B.; Kim, S.-J.; Johnson, G.M.; Lee, Y.-J.; Uh, Y.S.","Structural changes and cation site ordering in Na and K forms of aluminogermanates with the zeolite gismondine topology","Chemistry of Materials (1,1989-)","2000","12","","3760","3769","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002268","14.49","","9.94","","23.53","","90","","105.9","","90","","3259.38","","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Na3 (Al Ge O4)3 (H2 O)4.75","","- Al3 Ge3 H9.5 Na3 O16.75 -","- Al3 Ge3 Na3 O16.75 -","- Al24 Ge24 Na24 O134 -","8","1","","Tripathi, A.; Parise, J.B.; Uh, Y.S.; Johnson, G.M.; Kim, S.-J.; Lee, Y.-J.","Structural changes and cation site ordering in Na and K forms of aluminogermanates with the zeolite gismondine topology","Chemistry of Materials (1,1989-)","2000","12","","3760","3769","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002269","10.323","","9.754","","10.238","","90","","90.01","","90","","1030.87","","","","","","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","K0.5 Na0.5 (Al Ge O4) (H2 O)","","- Al Ge H2 K0.5 Na0.5 O5 -","- Al Ge K0.5 Na0.5 O5 -","- Al8 Ge8 K4 Na4 O40 -","8","1","","Tripathi, A.; Parise, J.B.; Kim, S.-J.; Uh, Y.S.; Johnson, G.M.; Lee, Y.-J.","Structural changes and cation site ordering in Na and K forms of aluminogermanates with the zeolite gismondine topology","Chemistry of Materials (1,1989-)","2000","12","","3760","3769","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002270","5.848","","3.34142","","11.0596","","90","","91.907","","90","","215.992","","","","","","","","","","","","","4","I 1 2/m 1","-I 2y","12","","Ni Cr V S4","","- Cr Ni S4 V -","- Cr0.999 Ni1.001 S4 V -","- Cr1.998 Ni2.002 S8 V2 -","2","0.25","","Vaqueiro, P.; Bold, M.; Powell, A.V.; Ritter, C.","Structural, magnetic, and electronic properties of vanadium-substituted nickel chromium sulfide","Chemistry of Materials (1,1989-)","2000","12","","1034","1041","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002271","5.8447","","3.3272","","11.0749","","90","","91.971","","90","","215.24","","","","","","","","","","","","","4","I 1 2/m 1","-I 2y","12","","Ni Cr0.8 V1.2 S4","","- Cr0.8 Ni S4 V1.2 -","- Cr0.801 Ni0.999 S4 V1.2 -","- Cr1.602 Ni1.998 S8 V2.4 -","2","0.25","","Vaqueiro, P.; Bold, M.; Powell, A.V.; Ritter, C.","Structural, magnetic, and electronic properties of vanadium-substituted nickel chromium sulfide","Chemistry of Materials (1,1989-)","2000","12","","1034","1041","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002272","5.8391","","3.31464","","11.065","","90","","92.123","","90","","214.011","","","","","","","","","","","","","4","I 1 2/m 1","-I 2y","12","","Ni Cr0.6 V1.4 S4","","- Cr0.6 Ni S4 V1.4 -","- Cr0.6 Ni S4 V1.4 -","- Cr1.2 Ni2 S8 V2.8 -","2","0.25","","Vaqueiro, P.; Bold, M.; Powell, A.V.; Ritter, C.","Structural, magnetic, and electronic properties of vanadium-substituted nickel chromium sulfide","Chemistry of Materials (1,1989-)","2000","12","","1034","1041","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002273","5.8376","","3.28741","","11.06386","","90","","92.267","","90","","212.156","","","","","","","","","","","","","4","I 1 2/m 1","-I 2y","12","","Ni Cr0.2 V1.8 S4","","- Cr0.2 Ni S4 V1.8 -","- Cr0.201 Ni0.999 S4 V1.8 -","- Cr0.402 Ni1.998 S8 V3.6 -","2","0.25","","Vaqueiro, P.; Powell, A.V.; Bold, M.; Ritter, C.","Structural, magnetic, and electronic properties of vanadium-substituted nickel chromium sulfide","Chemistry of Materials (1,1989-)","2000","12","","1034","1041","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002274","5.8411","","3.3969","","11.011","","90","","91.642","","90","","218.387","","","","","","","","","","","","","4","I 1 2/m 1","-I 2y","12","","Ni Cr1.9 V0.1 S4","","- Cr1.9 Ni S4 V0.1 -","- Cr1.899 Ni1.001 S4 V0.1 -","- Cr3.798 Ni2.002 S8 V0.2 -","2","0.25","","Vaqueiro, P.; Bold, M.; Powell, A.V.; Ritter, C.","Structural, magnetic, and electronic properties of vanadium-substituted nickel chromium sulfide","Chemistry of Materials (1,1989-)","2000","12","","1034","1041","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002275","5.8422","","3.3836","","11.026","","90","","91.654","","90","","217.867","","","","","","","","","","","","","4","I 1 2/m 1","-I 2y","12","","Ni Cr1.7 V0.3 S4","","- Cr1.7 Ni S4 V0.3 -","- Cr1.701 Ni0.999 S4 V0.3 -","- Cr3.402 Ni1.998 S8 V0.6 -","2","0.25","","Vaqueiro, P.; Bold, M.; Powell, A.V.; Ritter, C.","Structural, magnetic, and electronic properties of vanadium-substituted nickel chromium sulfide","Chemistry of Materials (1,1989-)","2000","12","","1034","1041","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002276","5.8285","","3.3701","","11.004","","90","","91.689","","90","","216.054","","","","","","","","","","","","","4","I 1 2/m 1","-I 2y","12","","Ni Cr1.6 V0.4 S4","","- Cr1.6 Ni S4 V0.4 -","- Cr1.6 Ni S4 V0.4 -","- Cr3.2 Ni2 S8 V0.8 -","2","0.25","","Vaqueiro, P.; Bold, M.; Ritter, C.; Powell, A.V.","Structural, magnetic, and electronic properties of vanadium-substituted nickel chromium sulfide","Chemistry of Materials (1,1989-)","2000","12","","1034","1041","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002277","5.825","","3.365","","10.999","","90","","91.803","","90","","215.486","","","","","","","","","","","","","4","I 1 2/m 1","-I 2y","12","","Ni Cr1.5 V0.5 S4","","- Cr1.5 Ni S4 V0.5 -","- Cr1.499 Ni1.001 S4 V0.5 -","- Cr2.998 Ni2.002 S8 V -","2","0.25","","Vaqueiro, P.; Bold, M.; Powell, A.V.; Ritter, C.","Structural, magnetic, and electronic properties of vanadium-substituted nickel chromium sulfide","Chemistry of Materials (1,1989-)","2000","12","","1034","1041","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002278","5.91079","","5.91079","","16.7829","","90","","90","","120","","507.795","","","","","","","","","","","","","3","R -3 :H","-R 3","148","","(V0.133 Cr0.189) (V0.203 Cr0.797) S2","","- Cr0.986 S2 V0.336 -","- Cr0.986 S2 V0.336 -","- Cr8.874 S18 V3.024 -","9","0.5","","Vaqueiro, P.; Powell, A.V.","Structures and properties of new ordered defect phases in the vanadium chromium sulfide system","Chemistry of Materials (1,1989-)","2000","12","","2705","2714","","","","","","","","","","","","","","","","","","","","","","has coordinates","141159","2020-10-21","18:00:00",""
"4002279","5.908","","5.908","","11.2254","","90","","90","","120","","339.323","","","","","","","","","","","","","3","P -3 1 c","-P 3 2c","163","","(V0.187 Cr0.183) (V0.24 Cr0.76) S2","","- Cr0.943 S2 V0.427 -","- Cr0.943333 S2 V0.426667 -","- Cr5.66 S12 V2.56 -","6","0.5","","Vaqueiro, P.; Powell, A.V.","Structures and properties of new ordered defect phases in the vanadium chromium sulfide system","Chemistry of Materials (1,1989-)","2000","12","","2705","2714","","","","","","","","","","","","","","","","","","","","","","has coordinates","141160","2020-10-21","18:00:00",""
"4002280","5.9449","","3.3834","","11.2263","","90","","91.573","","90","","225.72","","","","","","","","","","","","","3","I 1 2/m 1","-I 2y","12","","(V0.239 Cr0.261) (V0.285 Cr0.715) S2","","- Cr0.976 S2 V0.524 -","- Cr0.9765 S2 V0.5235 -","- Cr3.906 S8 V2.094 -","4","0.5","","Vaqueiro, P.; Powell, A.V.","Structures and properties of new ordered defect phases in the vanadium chromium sulfide system","Chemistry of Materials (1,1989-)","2000","12","","2705","2714","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4002281","5.9461","","3.3773","","11.2353","","90","","91.68","","90","","225.528","","","","","","","","","","","","","3","I 1 2/m 1","-I 2y","12","","(V0.252 Cr0.267) (V0.326 Cr0.674) S2","","- Cr0.941 S2 V0.578 -","- Cr0.941 S2 V0.578 -","- Cr3.764 S8 V2.312 -","4","0.5","","Vaqueiro, P.; Powell, A.V.","Structures and properties of new ordered defect phases in the vanadium chromium sulfide system","Chemistry of Materials (1,1989-)","2000","12","","2705","2714","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4002282","5.9536","","3.3942","","11.331","","90","","91.31","","90","","228.914","","","","","","","","","","","","","3","I 1 2/m 1","-I 2y","12","","(V0.256 Cr0.313) (V0.35 Cr0.65) S2","","- Cr0.963 S2 V0.606 -","- Cr0.963 S2 V0.606 -","- Cr3.852 S8 V2.424 -","4","0.5","","Vaqueiro, P.; Powell, A.V.","Structures and properties of new ordered defect phases in the vanadium chromium sulfide system","Chemistry of Materials (1,1989-)","2000","12","","2705","2714","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4002283","5.9574","","3.4009","","11.3825","","90","","91.127","","90","","230.571","","","","","","","","","","","","","3","I 1 2/m 1","-I 2y","12","","(V0.258 Cr0.350) (V0.369 Cr0.631) S2","","- Cr0.981 S2 V0.627 -","- Cr0.981 S2 V0.6275 -","- Cr3.924 S8 V2.51 -","4","0.5","","Vaqueiro, P.; Powell, A.V.","Structures and properties of new ordered defect phases in the vanadium chromium sulfide system","Chemistry of Materials (1,1989-)","2000","12","","2705","2714","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4002284","5.9562","","3.40467","","11.412","","90","","90.995","","90","","231.388","","","","","","","","","","","","","3","I 1 2/m 1","-I 2y","12","","(V0.283 Cr0.356) (V0.388 Cr0.612) S2","","- Cr0.968 S2 V0.671 -","- Cr0.968 S2 V0.6715 -","- Cr3.872 S8 V2.686 -","4","0.5","","Vaqueiro, P.; Powell, A.V.","Structures and properties of new ordered defect phases in the vanadium chromium sulfide system","Chemistry of Materials (1,1989-)","2000","12","","2705","2714","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4002285","5.9511","","3.4163","","11.4716","","90","","90.62","","90","","233.212","","","","","","","","","","","","","3","I 1 2/m 1","-I 2y","12","","(V0.305 Cr0.399) (V0.43 Cr0.57) S2","","- Cr0.969 S2 V0.735 -","- Cr0.969 S2 V0.7355 -","- Cr3.876 S8 V2.942 -","4","0.5","","Vaqueiro, P.; Powell, A.V.","Structures and properties of new ordered defect phases in the vanadium chromium sulfide system","Chemistry of Materials (1,1989-)","2000","12","","2705","2714","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4002286","6.85625","","6.85625","","17.2504","","90","","90","","120","","702.268","","","","","","","","","","","","","3","P 31 2 1","P 31 2""","152","","(V0.29 Cr0.42) (V0.465 Cr0.535) S2","","- Cr0.955 S2 V0.755 -","- Cr0.955 S2 V0.755 -","- Cr11.46 S24 V9.06 -","12","2","","Vaqueiro, P.; Powell, A.V.","Structures and properties of new ordered defect phases in the vanadium chromium sulfide system","Chemistry of Materials (1,1989-)","2000","12","","2705","2714","","","","","","","","","","","","","","","","","","","","","","has coordinates","141168","2020-10-21","18:00:00",""
"4002287","3.43854","","3.43854","","5.7966","","90","","90","","120","","59.354","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","V0.812 Cr0.968 S2","","- Cr0.968 S2 V0.812 -","- Cr0.968 S2 V0.812 -","- Cr0.968 S2 V0.812 -","1","0.0416667","","Vaqueiro, P.; Powell, A.V.","Structures and properties of new ordered defect phases in the vanadium chromium sulfide system","Chemistry of Materials (1,1989-)","2000","12","","2705","2714","","","","","","","","","","","","","","","","","","","","","","has coordinates","141169","2020-10-21","18:00:00",""
"4002288","5.8653","","3.3712","","11.061","","90","","91.68","","90","","218.616","","","","","","","","","","","","","4","I 1 2/m 1","-I 2y","12","","Ni Cr1.4 V0.6 S4","","- Cr1.4 Ni S4 V0.6 -","- Cr1.4 Ni S4 V0.6 -","- Cr2.8 Ni2 S8 V1.2 -","2","0.25","","Vaqueiro, P.; Bold, M.; Ritter, C.; Powell, A.V.","Structural, magnetic, and electronic properties of vanadium-substituted nickel chromium sulfide","Chemistry of Materials (1,1989-)","2000","12","","1034","1041","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002289","5.8517","","3.35413","","11.0542","","90","","91.834","","90","","216.854","","","","","","","","","","","","","4","I 1 2/m 1","-I 2y","12","","Ni Cr1.2 V0.8 S4","","- Cr1.2 Ni S4 V0.8 -","- Cr1.201 Ni0.999 S4 V0.8 -","- Cr2.402 Ni1.998 S8 V1.6 -","2","0.25","","Vaqueiro, P.; Bold, M.; Ritter, C.; Powell, A.V.","Structural, magnetic, and electronic properties of vanadium-substituted nickel chromium sulfide","Chemistry of Materials (1,1989-)","2000","12","","1034","1041","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002290","17.22279","","4.2729","","18.4659","","90","","90.72","","90","","1358.82","","","","","","","","","","","","","3","P 1 21/m 1","-P 2yb","11","","","","- Ba3 Bi6.67 Se13 -","- Ba3 Bi6.6667 Se13 -","- Ba6 Bi13.3334 Se26 -","2","0.5","","Wang, Y.C.; DiSalvo, F.J.","Synthesis and characterization of Ba3 Bi6.67 Se13 and its filled variants Ba3 Bi6 Pb Se13 and Ba3 Bi6 Sn Se13","Chemistry of Materials (1,1989-)","2000","12","","1011","1017","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4002291","17.24269","","4.2736","","18.45599","","90","","90.861","","90","","1359.84","","","","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- Ba3 Bi6 Pb Se13 -","- Ba3 Bi6 Pb Se13 -","- Ba6 Bi12 Pb2 Se26 -","2","0.5","","Wang, Y.C.; DiSalvo, F.J.","Synthesis and characterization of Ba3 Bi6.67 Se13 and its filled variants Ba3 Bi6 Pb Se13 and Ba3 Bi6 Sn Se13","Chemistry of Materials (1,1989-)","2000","12","","1011","1017","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4002292","17.24979","","4.2912","","18.459","","90","","90.679","","90","","1366.28","","","","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","Ba3 Bi6 Sn Se13","","- Ba3 Bi6 Se13 Sn -","- Ba3 Bi5.99 Se13 Sn1.01 -","- Ba6 Bi11.98 Se26 Sn2.02 -","2","0.5","","Wang, Y.C.; DiSalvo, F.J.","Synthesis and characterization of Ba3 Bi6.67 Se13 and its filled variants Ba3 Bi6 Pb Se13 and Ba3 Bi6 Sn Se13","Chemistry of Materials (1,1989-)","2000","12","","1011","1017","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002293","6.7329","","6.7329","","11.6747","","90","","90","","120","","458.333","","","","","","","","","","","","","3","P -3 1 c","-P 3 2c","163","","Ba2 Cu15.34 As10","","- As10 Ba2 Cu15.34 -","- As10 Ba2 Cu15.342 -","- As10 Ba2 Cu15.342 -","1","0.0833333","","Kim, S.-J.; Kannewurf, C.R.; Ireland, J.; Kanatzidis, M.G.","Ba2 Cu18-x As10: a new mixed-valent ternary copper-rich arsenide with metallic properties","Chemistry of Materials (1,1989-)","2000","12","","3133","3138","","","","","","","","","","","","","","","","","","","","","","has coordinates","141190","2020-10-21","18:00:00",""
"4002294","3.8412","","3.8412","","28.567","","90","","90","","90","","421.501","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","Na2 La2 ((Ti2.75 Ru0.25) O10)","","- La2 Na2 O10 Ru0.25 Ti2.75 -","- La2 Na2 O10 Ru0.248 Ti2.749 -","- La4 Na4 O20 Ru0.496 Ti5.498 -","2","0.0625","","Lalena, J.N.; Falster, A.U.; Simmons, W.B.jr.; Carpenter, E.E.; Wiggins, J.; Wiley, J.B.; Hariharan, S.","Synthesis and characterization of new mixed-metal triple-layered perovskites, Na2 La2 Ti3-x Rux O10 (x<= 1.0)","Chemistry of Materials (1,1989-)","2000","12","","2418","2423","","","","","","","","","","","","","","","","","","","","","","has coordinates","141199","2020-10-21","18:00:00",""
"4002295","3.8464","","3.8464","","28.532","","90","","90","","90","","422.125","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","Na2 La2 ((Ti2.5 Ru0.5) O10)","","- La2 Na2 O10 Ru0.5 Ti2.5 -","- La2 Na2 O10 Ru0.498 Ti2.499 -","- La4 Na4 O20 Ru0.996 Ti4.998 -","2","0.0625","","Lalena, J.N.; Carpenter, E.E.; Simmons, W.B.jr.; Falster, A.U.; Hariharan, S.; Wiley, J.B.; Wiggins, J.","Synthesis and characterization of new mixed-metal triple-layered perovskites, Na2 La2 Ti3-x Rux O10 (x<=1.0)","Chemistry of Materials (1,1989-)","2000","12","","2418","2423","","","","","","","","","","","","","","","","","","","","","","has coordinates","141200","2020-10-21","18:00:00",""
"4002296","3.856","","3.856","","28.41","","90","","90","","90","","422.421","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","Na2 La2 ((Ti2.25 Ru0.75) O10)","","- La2 Na2 O10 Ru0.75 Ti2.25 -","- La2 Na2 O10 Ru0.75 Ti2.249 -","- La4 Na4 O20 Ru1.5 Ti4.498 -","2","0.0625","","Lalena, J.N.; Falster, A.U.; Wiley, J.B.; Simmons, W.B.jr.; Wiggins, J.; Hariharan, S.; Carpenter, E.E.","Synthesis and characterization of new mixed-metal triple-layered perovskites, Na2 La2 Ti3-x Rux O10 (x<=1.0)","Chemistry of Materials (1,1989-)","2000","12","","2418","2423","","","","","","","","","","","","","","","","","","","","","","has coordinates","141201","2020-10-21","18:00:00",""
"4002297","3.8606","","3.8606","","28.377","","90","","90","","90","","422.937","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","Na2 La2 (Ti2 Ru O10)","","- La2 Na2 O10 Ru Ti2 -","- La2 Na2 O10 Ru0.999 Ti1.998 -","- La4 Na4 O20 Ru1.998 Ti3.996 -","2","0.0625","","Lalena, J.N.; Simmons, W.B.jr.; Falster, A.U.; Carpenter, E.E.; Wiggins, J.; Wiley, J.B.; Hariharan, S.","Synthesis and characterization of new mixed-metal triple-layered perovskites, Na2 La2 Ti3-x Rux O10 (x<=1.0)","Chemistry of Materials (1,1989-)","2000","12","","2418","2423","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002298","9.4583","","9.4583","","15.707","","90","","90","","120","","1216.89","","","","","","","","","","","","","5","P 65 2 2","P 65 2 (0 0 1)","179","","(Fe (H2 O)2) (B P2 O8) (H2 O)","","- B Fe H6 O11 P2 -","- B Fe O11 P2 -","- B6 Fe6 O66 P12 -","6","0.5","","Yilmaz, A.; Bu Xianhui; Kizilyalli, M.; Stucky, G.D.","Fe (H2 O)2 B P2 O8 . (H2 O), a first zeotype ferriborophosphate with chiral tetrahedral framework topology","Chemistry of Materials (1,1989-)","2000","12","","3243","3245","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002299","9.496","","9.496","","15.623","","90","","90","","120","","1220.05","","","","","","","","","","","","","5","P 61 2 2","P 61 2 (0 0 5)","178","","(H0.5 Co1.25 (H2 O)1.5) (B P2 O8) (H2 O)","","- B Co1.25 H5.5 O10.5 P2 -","- B Co1.25 O10.5 P2 -","- B6 Co7.5 O63 P12 -","6","0.5","","Yilmaz, A.; Kizilyalli, M.; Bu Xianhui; Stucky, G.D.","Fe (H2 O)2 B P2 O8 . (H2 O), a first zeotype ferriborophosphate with chiral tetrahedral framework topology","Chemistry of Materials (1,1989-)","2000","12","","3243","3245","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002300","3.90262","","3.90262","","14.3089","","90","","90","","90","","217.931","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","Sr2 (Co O3 Cl)","","- Cl Co O3 Sr2 -","- Cl Co O3 Sr2 -","- Cl2 Co2 O6 Sr4 -","2","0.125","","Loureiro, S.M.; Felser, C.; Huang, Q.; Cava, R.J.","Refinement of the crystal structures of strontium cobalt oxychlorides by neutron powder diffraction","Chemistry of Materials (1,1989-)","2000","12","","3181","3185","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002301","3.9142","","3.9142","","24.0098","","90","","90","","90","","367.853","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Sr3 (Co2 O5 Cl2)","","- Cl2 Co2 O5 Sr3 -","- Cl2 Co2 O5 Sr3 -","- Cl4 Co4 O10 Sr6 -","2","0.0625","","Loureiro, S.M.; Huang, Q.; Felser, C.; Cava, R.J.","Refinement of the crystal structures of strontium cobalt oxychlorides by neutron powder diffraction","Chemistry of Materials (1,1989-)","2000","12","","3181","3185","","","","","","","","","","","","","","","","","","","","","","has coordinates","141221","2020-10-21","18:00:00",""
"4002302","3.9012","","3.9012","","31.688","","90","","90","","90","","482.271","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Sr4 (Co3 O7.5 Cl2)","","- Cl2 Co3 O7.5 Sr4 -","- Cl2 Co3 O7.5 Sr4 -","- Cl4 Co6 O15 Sr8 -","2","0.0625","","Loureiro, S.M.; Cava, R.J.; Felser, C.; Huang, Q.","Refinement of the crystal structures of strontium cobalt oxychlorides by neutron powder diffraction","Chemistry of Materials (1,1989-)","2000","12","","3181","3185","","","","","","","","","","","","","","","","","","","","","","has coordinates","141222","2020-10-21","18:00:00",""
"4027830","12.9772","","12.9772","","9.5322","","90","","90","","120","","1390.23","","","","","","","","","","","","","4","P 63 2 2","P 6c 2c","182","","Cr Si3 (B12) Se12 (B2 Se3)1.327","","- B12 Cr Se15.98 Si3 -","- B12 Cr Se15.98 Si3 -","- B24 Cr2 Se31.96 Si6 -","2","0.166667","","Fukuoka, H.; Saito, T.; Sugimori, M.; Imoto, H.","Preparation and crystal structure of chromium silicon selenide containing a B12 icosahedron with a tunnel structure","Journal of Organometallic Chemistry","2000","611","","547","550","10.1016/S0022-328X(00)00407-1","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4031165","14.0685","","14.0685","","14.0685","","90","","90","","90","","2784.48","","","","","","","","","","","","","2","P 41 3 2","P 4bd 2ab 3","213","","","","- Ba24 Si100 -","- Ba24 Si100 -","- Ba24 Si100 -","1","0.0416667","","Fukuoka, H.; Yamanaka, S.; Ueno, K.","High-pressure synthesis and structure of a new silicon clathrate Ba24 Si100","Journal of Organometallic Chemistry","2000","611","","543","546","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4031171","5.4881","","5.4757","","7.7407","","90","","90","","90","","232.617","","","","","","","","","","","","","5","I b m m","-I 2c 2c","74","","(La1.33 Na0.66) (Mn0.66 Ti1.34) O6","","- La1.33 Mn0.66 Na0.66 O6 Ti1.34 -","- La1.33 Mn0.66 Na0.66 O6 Ti1.34 -","- La2.66 Mn1.32 Na1.32 O12 Ti2.68 -","2","0.125","","Ruiz, A.I.; Lopez, M.L.; Pico, C.; Veiga, M.L.","Structural and electrical characterisation of the series La1.33 Nax Mnx Ti2-x O6","European Journal of Inorganic Chemistry","2000","2000","","659","664","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4031172","5.5055","","5.5055","","13.4618","","90","","90","","120","","353.368","","","","","","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","(La1.33 Na0.66) (Mn0.66 Ti1.34) O6","","- La1.33 Mn0.66 Na0.66 O6 Ti1.34 -","- La1.33 Mn0.66 Na0.66 O6 Ti1.34 -","- La3.99 Mn1.98 Na1.98 O18 Ti4.02 -","3","0.0833333","","Ruiz, A.I.; Veiga, M.L.; Lopez, M.L.; Pico, C.","Structural and electrical characterisation of the series La1.33 Nax Mnx Ti2-x O6","European Journal of Inorganic Chemistry","2000","2000","","659","664","","","","","","","","","","","","","","","","","","","","","","has coordinates","141110","2020-10-21","18:00:00",""
"4031173","5.49","","5.49","","13.434","","90","","90","","120","","350.656","","","","","","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","(La1.33 Na0.44) (Mn0.44 Ti1.56) O6","","- La1.33 Mn0.44 Na0.44 O6 Ti1.56 -","- La1.33 Mn0.44 Na0.44 O6 Ti1.56 -","- La3.99 Mn1.32 Na1.32 O18 Ti4.68 -","3","0.0833333","","Ruiz, A.I.; Lopez, M.L.; Veiga, M.L.; Pico, C.","Structural and electrical characterisation of the series La1.33 Nax Mnx Ti2-x O6","European Journal of Inorganic Chemistry","2000","2000","","659","664","","","","","","","","","","","","","","","","","","","","","","has coordinates","141111","2020-10-21","18:00:00",""
"4031579","18.144","","18.638","","18.443","","90","","95.789","","90","","6205.02","","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Na8 (Th W10 O36) (H2 O)28","","- H56 Na8 O64 Th W10 -","- H56 Na8 O64 Th W10 -","- H224 Na32 O256 Th4 W40 -","4","0.5","","Griffith, W.P.; Morley-Smith, N.; Nogueira, H.I.S.; Shoair, A.G.F.; Suriaatmaja, M.; White, A.J.P.; Williams, D.J.","Studies on polyoxo and polyperoxo-metalates. Part 7. Lanthano- and thoriopolyoxotungstates as catalytic oxidants with H2 O2 and the X-ray crystal structure of Na8 (Th W10 O36) * 28(H2 O)","Journal of Organometallic Chemistry","2000","607","","146","155","","","","","","","","","","","","","","","","","","","","","","has coordinates","189367","2020-10-21","18:00:00",""
"4031632","25.577","","25.577","","25.577","","90","","90","","90","","16732","","","","","","","","","","","","","7","F m -3 m","-F 4 2 3","225","","(Co (H2 O)4)3 (W4 Te4 (C N)12) (H2 O)15.38","","- C12 H54.76 Co3 N12 O27.38 Te4 W4 -","- C12 Co3 N12 O27.42 Te4 W4 -","- C96 Co24 N96 O219.36 Te32 W32 -","8","0.0416667","","Fedin, V.P.; Elsegood, M.R.J.; Virovets, A.V.; Clegg, W.; Kalinina, I.V.; Ikorskii, V.N.","A three-dimensional cyano-bridged cluster-metal coordination polymer with large cavities","European Journal of Inorganic Chemistry","2000","2000","","2341","2343","","","","","","","","","","","","","","","","","","","","","","has coordinates","164743","2020-10-21","18:00:00",""
"4037612","17.1992","0.001","11.0779","0.0006","10.6606","0.0006","90","","97.526","0.001","90","","2013.7","0.2","297","2","297","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C29 H20 O2 -","- C29 H20 O2 -","- C116 H80 O8 -","4","1","","Kimber, M. C.; Try, A. C.; Painter, L.; Harding, M. M.; Turner, P.","Synthesis of functionalized chiral carbocyclic cleft molecules complementary to Tröger's base derivatives.","The Journal of organic chemistry","2000","65","10","3042","3046","10.1021/jo991741p","","","0.71073","MoKα","","0.1096","0.0599","","","0.1152","0.1369","","","","","","1.072","","","","has coordinates","243451","2020-10-21","18:00:00",""
"4037613","8.2666","0.0007","8.808","0.001","32.691","0.001","90","","90","","90","","2380.3","0.3","294","2","294","2","","","","","","","","3","P b c n","-P 2n 2ab","60","","","","- C31 H24 O4 -","- C31 H24 O4 -","- C124 H96 O16 -","4","0.5","","Kimber, M. C.; Try, A. C.; Painter, L.; Harding, M. M.; Turner, P.","Synthesis of functionalized chiral carbocyclic cleft molecules complementary to Tröger's base derivatives.","The Journal of organic chemistry","2000","65","10","3042","3046","10.1021/jo991741p","","","1.54178","CuKα","","0.0414","0.0332","","","0.0934","0.0987","","","","","","1.026","","","","has coordinates","243451","2020-10-21","18:00:00",""
"4037614","11.763","0.001","10.521","0.002","11.45","0.001","90","","92.85","0.01","90","","1415.3","0.3","294","2","294","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C17 H10 N2 O6 -","- C17 H10 N2 O6 -","- C68 H40 N8 O24 -","4","0.5","","Kimber, M. C.; Try, A. C.; Painter, L.; Harding, M. M.; Turner, P.","Synthesis of functionalized chiral carbocyclic cleft molecules complementary to Tröger's base derivatives.","The Journal of organic chemistry","2000","65","10","3042","3046","10.1021/jo991741p","","","1.54178","CuKα","","0.0637","0.0397","","","0.1146","0.1273","","","","","","1.037","","","","has coordinates","243451","2020-10-21","18:00:00",""
"4037615","14.1687","0.0019","5.1867","0.0007","22.746","0.003","90","","100.692","0.002","90","","1642.6","0.4","297","2","297","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C19 H14 N2 O6 -","- C19 H14 N2 O6 -","- C76 H56 N8 O24 -","4","0.5","","Kimber, M. C.; Try, A. C.; Painter, L.; Harding, M. M.; Turner, P.","Synthesis of functionalized chiral carbocyclic cleft molecules complementary to Tröger's base derivatives.","The Journal of organic chemistry","2000","65","10","3042","3046","10.1021/jo991741p","","","0.71073","MoKα","","0.0698","0.056","","","0.1536","0.1655","","","","","","1.074","","","","has coordinates","243451","2020-10-21","18:00:00",""
"4063195","8.6646","0.0002","9.6965","0.0001","25.4076","0.0006","90","","90","","90","","2134.65","0.07","130","2","130","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C18 H4 As Cl F18 -","- C18 H4 As Cl F18 -","- C72 H16 As4 Cl4 F72 -","4","1","","Neil Burford; Charles L. B. Macdonald; Daren J. LeBlanc; T. Stanley Cameron","Synthesis and Characterization of Bis(2,4,6-tris(trifluoromethyl)phenyl) Derivatives of Arsenic and Antimony: X-ray Crystal Structures of As(RF)2Cl, Sb(RF)2Cl, and Sb(RF)2OSO2CF3","Organometallics","2000","19","","152","155","10.1021/om990768w","","","0.71073","MoKα","","0.0403","0.0334","","","0.0775","0.0822","","","","","","1.062","","","","has coordinates,has disorder","130149","2020-10-21","18:00:00",""
"4063196","8.705","0.009","30.38","0.01","8.167","0.004","90","","91.53","0.06","90","","2159","2","296","1","296","1","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C18 H4 As Cl F18 -","- C18 H4 As Cl F18 -","- C72 H16 As4 Cl4 F72 -","4","1","","Neil Burford; Charles L. B. Macdonald; Daren J. LeBlanc; T. Stanley Cameron","Synthesis and Characterization of Bis(2,4,6-tris(trifluoromethyl)phenyl) Derivatives of Arsenic and Antimony: X-ray Crystal Structures of As(RF)2Cl, Sb(RF)2Cl, and Sb(RF)2OSO2CF3","Organometallics","2000","19","","152","155","10.1021/om990768w","","","0.71073","MoKα","","","0.067","","","0.073","0.073","","","","","","1.73","","","","has coordinates,has disorder","178526","2020-10-21","18:00:00",""
"4063197","8.296","0.002","30.43","0.007","8.779","0.003","90","","94.03","0.003","90","","2211","1","296","1","296","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H4 Cl F18 Sb -","- C18 H4 Cl F18 Sb -","- C72 H16 Cl4 F72 Sb4 -","4","1","","Neil Burford; Charles L. B. Macdonald; Daren J. LeBlanc; T. Stanley Cameron","Synthesis and Characterization of Bis(2,4,6-tris(trifluoromethyl)phenyl) Derivatives of Arsenic and Antimony: X-ray Crystal Structures of As(RF)2Cl, Sb(RF)2Cl, and Sb(RF)2OSO2CF3","Organometallics","2000","19","","152","155","10.1021/om990768w","","","1.54178","CuKα","","","0.055","","","","0.22","","","","","","1","","","","has coordinates,has disorder","178526","2020-10-21","18:00:00",""
"4063198","16.172","0.004","17.758","0.002","9.119","0.001","90","","90","","90","","2618.8","0.6","296","1","296","1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C19 H4 F21 O3 S Sb -","- C19 H4 F21 O3 S Sb -","- C76 H16 F84 O12 S4 Sb4 -","4","1","","Neil Burford; Charles L. B. Macdonald; Daren J. LeBlanc; T. Stanley Cameron","Synthesis and Characterization of Bis(2,4,6-tris(trifluoromethyl)phenyl) Derivatives of Arsenic and Antimony: X-ray Crystal Structures of As(RF)2Cl, Sb(RF)2Cl, and Sb(RF)2OSO2CF3","Organometallics","2000","19","","152","155","10.1021/om990768w","","","0.71069","MoKα","","","0.043","","","0.044","0.044","","","","","","1.4","","","","has coordinates,has disorder","130149","2020-10-21","18:00:00",""
"4063201","10.758","0.004","10.987","0.004","24.968","0.009","91.809","0.005","96.237","0.005","116.248","0.005","2621","2","238","2","238","2","","","","","","","","6","P -1","-P 1","2","","","","- C58 H64 N4 Na2 O4 Yb -","- C58 H64 N4 Na2 O4 Yb -","- C116 H128 N8 Na4 O8 Yb2 -","2","1","","Tiffany Dube; Dominique Freckmann; Sabrina Conoci; Sandro Gambarotta; Glenn P. A. Yap","Monomeric and Octameric Divalent Ytterbium Complexes of Diphenylmethyl Dipyrrolyl Dianion","Organometallics","2000","19","","209","211","10.1021/om990798z","","","0.71073","MoKα","","0.0722","0.0518","","","0.1021","0.1076","","","","","","1.055","","","","has coordinates","178527","2020-10-21","18:00:00",""
"4063202","17.254","0.004","19.145","0.004","19.659","0.004","61.167","0.005","84.757","0.004","74.114","0.004","5465","2","233","2","233","2","","","","","","","","7","P -1","-P 1","2","","","","- C240 H272 Cl2 Li2 N16 O18 Yb8 -","- C240 H272 Cl2 Li2 N16 O18 Yb8 -","- C240 H272 Cl2 Li2 N16 O18 Yb8 -","1","0.5","","Tiffany Dube; Dominique Freckmann; Sabrina Conoci; Sandro Gambarotta; Glenn P. A. Yap","Monomeric and Octameric Divalent Ytterbium Complexes of Diphenylmethyl Dipyrrolyl Dianion","Organometallics","2000","19","","209","211","10.1021/om990798z","","","0.71073","MoKα","","0.1158","0.058","","","0.1211","0.138","","","","","","1.041","","","","has coordinates","178527","2020-10-21","18:00:00",""
"4063203","9.595","0.002","13.832","0.004","10.998","0.004","90","","107.96","0.02","90","","1388.5","0.7","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","{η^4^:η^4^-[3~4~]Cyclobutadienophane}bis(η^5^- methoxycarbonylcyclopentadienyl)cobalt (2)","","- C34 H38 Co2 O4 -","- C34 H38 Co2 O4 -","- C68 H76 Co4 O8 -","2","0.5","","Rolf Gleiter; Rolf Roers; Jörg Classen; Albrecht Jacobi; Gottfried Huttner; Thomas Oeser","Synthesis and Properties of Donor-Acceptor-Substituted Metal-Capped Fourfold-Bridged Cyclobutadienophanes","Organometallics","2000","19","","147","151","10.1021/om9907270","","","0.71073","MoKα","","0.05","0.035","","","0.092","0.099","","","","","","1.042","","","","has coordinates","178527","2020-10-21","18:00:00",""
"4063204","20.022","0.004","8.155","0.002","16.421","0.003","90","","110.85","0.03","90","","2505.7","0.9","200","","200","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","{η^4^:η^4^-[3~4~]Cyclobutadienophane}(η^5^- methoxycarbonylcyclopentadienyl)(η^5^- cyclopentadienyl)cobalt (5)","","- C32 H36 Co2 O2 -","- C32 H36 Co2 O2 -","- C128 H144 Co8 O8 -","4","1","","Rolf Gleiter; Rolf Roers; Jörg Classen; Albrecht Jacobi; Gottfried Huttner; Thomas Oeser","Synthesis and Properties of Donor-Acceptor-Substituted Metal-Capped Fourfold-Bridged Cyclobutadienophanes","Organometallics","2000","19","","147","151","10.1021/om9907270","","","0.71073","MoKα","","0.0704","0.0397","","","0.0745","0.0814","","","","","","1.027","","","","has coordinates","178527","2020-10-21","18:00:00",""
"4063205","14.033","0.003","15.803","0.003","14.497","0.003","90","","109.59","0.03","90","","3028.8","1.1","200","","200","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","{η^4^:η^4^-[3~4~]Cyclobutadienophane}(η^5^- methoxycarbonylcyclopentadienyl)(η^5^- pentamethyl-cyclopentadienyl)cobalt (7)","","- C37 H46 Co2 O2 -","- C37 H46 Co2 O2 -","- C148 H184 Co8 O8 -","4","1","","Rolf Gleiter; Rolf Roers; Jörg Classen; Albrecht Jacobi; Gottfried Huttner; Thomas Oeser","Synthesis and Properties of Donor-Acceptor-Substituted Metal-Capped Fourfold-Bridged Cyclobutadienophanes","Organometallics","2000","19","","147","151","10.1021/om9907270","","","0.71073","MoKα","","0.0686","0.0373","","","0.0738","0.0797","","","","","","0.973","","","","has coordinates","178527","2020-10-21","18:00:00",""
"4063206","10.623","0.009","11.739","0.009","24.887","0.021","90","","102.28","0.02","90","","3032.4","4.3","299","2","299","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C36 H28 Fe O5 -","- C36 H28 Fe O5 -","- C144 H112 Fe4 O20 -","4","1","","Hari K. Gupta; Nicole Rampersad; Mark Stradiotto; Michael J. McGlinchey","Rhodium Acetylacetonate and Iron Tricarbonyl Complexes of Tetracyclone and 3-Ferrocenyl-2,4,5-triphenylcyclopentadienone: An X-ray Crystallographic and NMR Study","Organometallics","2000","19","","184","191","10.1021/om990559b","","","0.71073","MoKα","","0.2075","0.0944","","0.2594","0.2008","","","","0.909","1.187","1.187","","","","","has coordinates","178527","2020-10-21","18:00:00",""
"4063207","10.618","0.003","21.506","0.006","12.99","0.003","90","","102.332","0.013","90","","2897.8","1.3","299","2","299","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C36 H24 Fe2 O4 -","- C36 H24 Fe2 O4 -","- C144 H96 Fe8 O16 -","4","1","","Hari K. Gupta; Nicole Rampersad; Mark Stradiotto; Michael J. McGlinchey","Rhodium Acetylacetonate and Iron Tricarbonyl Complexes of Tetracyclone and 3-Ferrocenyl-2,4,5-triphenylcyclopentadienone: An X-ray Crystallographic and NMR Study","Organometallics","2000","19","","184","191","10.1021/om990559b","","","0.71073","MoKα","","0.0506","0.0283","","0.0721","0.0663","","","","0.909","1.008","1.008","","","","","has coordinates","178527","2020-10-21","18:00:00",""
"4063208","8.823","0.003","12.404","0.004","15.694","0.005","66.929","0.007","81.291","0.008","73.873","0.006","1516.2","0.8","299","2","299","2","","","","","","","","4","P -1","-P 1","2","","","","- C34 H29 O4 Rh -","- C34 H29 O4 Rh -","- C68 H58 O8 Rh2 -","2","1","","Hari K. Gupta; Nicole Rampersad; Mark Stradiotto; Michael J. McGlinchey","Rhodium Acetylacetonate and Iron Tricarbonyl Complexes of Tetracyclone and 3-Ferrocenyl-2,4,5-triphenylcyclopentadienone: An X-ray Crystallographic and NMR Study","Organometallics","2000","19","","184","191","10.1021/om990559b","","","0.71073","MoKα","","0.133","0.1161","","0.3462","0.3339","","","","1.52","1.653","1.653","","","","","has coordinates","178527","2020-10-21","18:00:00",""
"4063209","20.834","0.011","12.455","0.007","25.752","0.02","90","","97.09","0.02","90","","6631.2","7.4","299","2","299","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","","","- C38 H31 Fe O3 Rh -","- C38 H31 Fe O3 Rh -","- C304 H248 Fe8 O24 Rh8 -","8","1","","Hari K. Gupta; Nicole Rampersad; Mark Stradiotto; Michael J. McGlinchey","Rhodium Acetylacetonate and Iron Tricarbonyl Complexes of Tetracyclone and 3-Ferrocenyl-2,4,5-triphenylcyclopentadienone: An X-ray Crystallographic and NMR Study","Organometallics","2000","19","","184","191","10.1021/om990559b","","","0.71073","MoKα","","0.094","0.0478","","0.1123","0.0997","","","","0.913","1.079","1.079","","","","","has coordinates","178527","2020-10-21","18:00:00",""
"4063212","8.3011","0.0014","19.742","0.003","14.552","0.003","90","","93.448","0.015","90","","2380.5","0.7","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","{(C5Me5)Ir}2B4H8","","- C20 H38 B4 Ir2 -","- C20 H38 B4 Ir2 -","- C80 H152 B16 Ir8 -","4","1","","Xinjian Lei; Maoyu Shang; Thomas P. Fehlner","Utilization of Transition-Metal Properties To Control Polyborane Formation. Synthesis of the arachno-Diiridahexaborane(12) 2,5-{Cp*IrH}2B4H8 and Its Conversion to the nido-Diiridahexaborane(10) 1,2-{Cp*Ir}2(-H)B4H7 (Cp* =5-C5Me5)","Organometallics","2000","19","","118","120","10.1021/om990816c","","","0.71073","MoKα","","0.0551","0.0382","","","0.0942","0.1007","","","","","","1.118","","","","has coordinates","178527","2020-10-21","18:00:00",""
"4063213","8.7599","0.0007","8.7599","0.0007","30.4203","0.001","90","","90","","90","","2334.3","0.3","293","2","293","2","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","","{(C5Me5)Ir2B4H10","","- C20 H40 B4 Ir2 -","- C20 H40 B4 Ir2 -","- C80 H160 B16 Ir8 -","4","0.5","","Xinjian Lei; Maoyu Shang; Thomas P. Fehlner","Utilization of Transition-Metal Properties To Control Polyborane Formation. Synthesis of the arachno-Diiridahexaborane(12) 2,5-{Cp*IrH}2B4H8 and Its Conversion to the nido-Diiridahexaborane(10) 1,2-{Cp*Ir}2(-H)B4H7 (Cp* =5-C5Me5)","Organometallics","2000","19","","118","120","10.1021/om990816c","","","0.71073","MoKα","","0.0498","0.0429","","0.1003","0.0968","","","","1.112","1.132","1.132","","","","","has coordinates","178527","2020-10-21","18:00:00",""
"4077455","9.968","0.002","15.862","0.003","26.481","0.005","90","","90.56","0.03","90","","4186.8","1.4","200","1","200","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C39 H50 Bi Cl Mo2 O6 -","- C39 H50 Bi Cl Mo2 O6 -","- C156 H200 Bi4 Cl4 Mo8 O24 -","4","1","","Gröer, Thomas; Scheer, Manfred","Transition-Metal-Substituted Dichlorobismuthanes as Starting Materials for Novel Bismuth−Transition-Metal Clusters†","Organometallics","2000","19","18","3683","","10.1021/om000372g","","","0.71073","MoKα","","0.0762","0.0643","","","0.1549","0.1612","","","","","","1.05","","","","has coordinates","178663","2020-10-21","18:00:00",""
"4077456","7.216","0.0014","9.698","0.002","15.022","0.003","81.2","0.03","84.06","0.03","71.59","0.03","984","0.4","203","2","203","2","","","","","","","","6","P -1","-P 1","2","","","","- C15 H5 Bi Co2 Fe O10 -","- C15 H5 Bi Co2 Fe O10 -","- C30 H10 Bi2 Co4 Fe2 O20 -","2","1","","Gröer, Thomas; Scheer, Manfred","Transition-Metal-Substituted Dichlorobismuthanes as Starting Materials for Novel Bismuth−Transition-Metal Clusters†","Organometallics","2000","19","18","3683","","10.1021/om000372g","","","0.71073","MoKa","","0.0368","0.0302","","0.0744","0.0685","","","","1.077","1.051","1.051","","","","","has coordinates","178663","2020-10-21","18:00:00",""
"4077457","9.796","0.002","11.19","0.002","12.212","0.002","90","","104.51","0.03","90","","1295.9","0.4","200","2","200","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C13 H2 Bi4 Cl2 Co4 O12 -","- C13 H3 Bi4 Cl2 Co4 O12 -","- C26 H6 Bi8 Cl4 Co8 O24 -","2","0.5","","Gröer, Thomas; Scheer, Manfred","Transition-Metal-Substituted Dichlorobismuthanes as Starting Materials for Novel Bismuth−Transition-Metal Clusters†","Organometallics","2000","19","18","3683","","10.1021/om000372g","","","0.71073","MoKα","","0.063","0.0551","","","0.1367","0.1426","","","","","","1.092","","","","has coordinates,has disorder","178663","2020-10-21","18:00:00",""
"4077458","9.654","0.002","9.756","0.002","27.598","0.004","83.25","0.03","81.25","0.03","63.9","0.03","2303.3","1","200","1","203","2","","","","","","","","5","P -1","-P 1","2","","","","- C39 H42 Bi2 Fe5 O13 -","- C39 H42 Bi2 Fe5 O13 -","- C78 H84 Bi4 Fe10 O26 -","2","1","","Gröer, Thomas; Scheer, Manfred","Transition-Metal-Substituted Dichlorobismuthanes as Starting Materials for Novel Bismuth−Transition-Metal Clusters†","Organometallics","2000","19","18","3683","","10.1021/om000372g","","","0.71073","MoKα","","0.046","0.0333","","0.0833","0.0796","","","","1.064","1.141","1.141","","","","","has coordinates","178663","2020-10-21","18:00:00",""
"4077459","17.677","0.004","13.518","0.003","12.95","0.003","90","","90","","90","","3094.5","1.2","200","1","200","1","","","","","","","","6","A b m 2","A 2 -2b","39","","","","- C23 H21 Bi3 Fe O10 W2 -","- C24 H21 Bi3 Fe O10 W2 -","- C96 H84 Bi12 Fe4 O40 W8 -","4","","","Gröer, Thomas; Scheer, Manfred","Transition-Metal-Substituted Dichlorobismuthanes as Starting Materials for Novel Bismuth−Transition-Metal Clusters†","Organometallics","2000","19","18","3683","","10.1021/om000372g","","","0.71073","MoKα","","0.1326","0.1171","","","0.2646","0.2726","","","","","","1.325","","","","has coordinates,has disorder","178663","2020-10-21","18:00:00",""
"4077460","17.835","0.003","13.276","0.002","18.353","0.004","90","","112.88","0.03","90","","4003.7","1.5","200","1","200","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H50 Bi Cl7 Mo2 O3 -","- C32 H50 Bi Cl7 Mo2 O3 -","- C128 H200 Bi4 Cl28 Mo8 O12 -","4","1","","Gröer, Thomas; Scheer, Manfred","Transition-Metal-Substituted Dichlorobismuthanes as Starting Materials for Novel Bismuth−Transition-Metal Clusters†","Organometallics","2000","19","18","3683","","10.1021/om000372g","","","0.71073","MoKα","","0.0523","0.043","","0.1086","0.1047","","","","0.954","1.021","1.021","","","","","has coordinates","178663","2020-10-21","18:00:00",""
"4077461","8.324","0.001","14.841","0.003","16.296","0.002","90","","93.01","0.007","90","","2010.4","0.5","293","2","293","2","","","","","","","synthesis by authors","7","P 1 21/c 1","-P 2ybc","14","","","","- C15 H15 F3 Fe2 N2 O6 S -","- C15 H15 F3 Fe2 N2 O6 S -","- C60 H60 F12 Fe8 N8 O24 S4 -","4","1","","Guennou-de Cadenet, Karine; Rumin, René; Pétillon, François Y.; Muir, Kenneth W.","Carbon−Fluorine Bond Cleavages and Organoiron Ring Transformations: Reaction of a Perfluorosulfanylvinyldiiron(I) Complex with Amines","Organometallics","2000","19","10","1912","","10.1021/om000003k","","","0.71073","MoKα","","0.2896","0.1235","","0.4648","0.3092","","","","0.869","1.01","1.01","","","","","has coordinates","178663","2020-10-21","18:00:00",""
"4077462","8.083","0.0008","15.5721","0.0012","8.617","0.0005","90","","116.66","0.006","90","","969.3","0.14","295","2","295","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C15 H13 F3 Fe2 N2 O6 S -","- C15 H13 F3 Fe2 N2 O6 S -","- C30 H26 F6 Fe4 N4 O12 S2 -","2","1","","Guennou-de Cadenet, Karine; Rumin, René; Pétillon, François Y.; Muir, Kenneth W.","Carbon−Fluorine Bond Cleavages and Organoiron Ring Transformations: Reaction of a Perfluorosulfanylvinyldiiron(I) Complex with Amines","Organometallics","2000","19","10","1912","","10.1021/om000003k","","","0.71073","MoKα","","0.0433","0.0335","","","0.081","0.0847","","","","","","1.043","","","","has coordinates","178663","2020-10-21","18:00:00",""
"4077463","13.762","0.0013","9.9905","0.001","15.0431","0.0015","90","","93.064","0.004","90","","2065.3","0.4","293","2","293","2","","","","","","","synthesis by authors","7","P 1 21/c 1","-P 2ybc","14","","","","- C15 H15 F3 Fe2 N2 O6 S -","- C15 H15 F3 Fe2 N2 O6 S -","- C60 H60 F12 Fe8 N8 O24 S4 -","4","1","","Guennou-de Cadenet, Karine; Rumin, René; Pétillon, François Y.; Muir, Kenneth W.","Carbon−Fluorine Bond Cleavages and Organoiron Ring Transformations: Reaction of a Perfluorosulfanylvinyldiiron(I) Complex with Amines","Organometallics","2000","19","10","1912","","10.1021/om000003k","","","0.71073","MoKα","","0.0617","0.0388","","0.112","0.1007","","","","1.01","1.103","1.103","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077464","10.1874","0.0023","29.2144","0.0016","13.2192","0.0012","90","","104.392","0.011","90","","3810.8","1","293","2","293","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C29.5 H47 B9 Cl I N O P Ru -","- C29.5 H47 B9 Cl I N O P Ru -","- C118 H188 B36 Cl4 I4 N4 O4 P4 Ru4 -","4","1","","Du, Shaowu; Ellis, Dianne D.; Jelliss, Paul A.; Kautz, Jason A.; Malget, John M.; Stone, F. Gordon A.","Studies with the Ruthenacarborane Complex [Ru(CO)(PPh3)(THF)(η5-7,8-C2B9H11)]: Reactions with Terminal Alkynes†","Organometallics","2000","19","10","1983","","10.1021/om000018i","","","0.71073","MoKα","","0.0606","0.0388","","","0.0786","0.0891","","","1.068","","","1.077","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4077465","9.4769","0.0016","10.7559","0.0012","16.4336","0.0018","109.085","0.01","94.81","0.013","107.214","0.012","1481.6","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C29 H32 B9 O P Ru -","- C29 H32 B9 O P Ru -","- C58 H64 B18 O2 P2 Ru2 -","2","1","","Du, Shaowu; Ellis, Dianne D.; Jelliss, Paul A.; Kautz, Jason A.; Malget, John M.; Stone, F. Gordon A.","Studies with the Ruthenacarborane Complex [Ru(CO)(PPh3)(THF)(η5-7,8-C2B9H11)]: Reactions with Terminal Alkynes†","Organometallics","2000","19","10","1983","","10.1021/om000018i","","","0.71073","MoKα","","0.0362","0.03","","","0.0766","0.0799","","","","","","1.092","","","","has coordinates","178663","2020-10-21","18:00:00",""
"4077466","10.5524","0.0014","21.874","0.003","16.108","0.0011","90","","102.821","0.008","90","","3625.4","0.7","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C29 H39 B9 Cl2 N O P Ru -","- C29 H39 B9 Cl2 N O P Ru -","- C116 H156 B36 Cl8 N4 O4 P4 Ru4 -","4","1","","Du, Shaowu; Ellis, Dianne D.; Jelliss, Paul A.; Kautz, Jason A.; Malget, John M.; Stone, F. Gordon A.","Studies with the Ruthenacarborane Complex [Ru(CO)(PPh3)(THF)(η5-7,8-C2B9H11)]: Reactions with Terminal Alkynes†","Organometallics","2000","19","10","1983","","10.1021/om000018i","","","0.71073","MoKα","","0.0572","0.0353","","","0.0736","0.089","","","","","","1.087","","","","has coordinates,has disorder","178663","2020-10-21","18:00:00",""
"4077467","15.1493","0.0011","19.5483","0.0016","24.609","0.002","90","","90","","90","","7287.8","1","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C33 H46 B9 O P Ru -","- C33 H46 B9 O P Ru -","- C264 H368 B72 O8 P8 Ru8 -","8","1","","Du, Shaowu; Ellis, Dianne D.; Jelliss, Paul A.; Kautz, Jason A.; Malget, John M.; Stone, F. Gordon A.","Studies with the Ruthenacarborane Complex [Ru(CO)(PPh3)(THF)(η5-7,8-C2B9H11)]: Reactions with Terminal Alkynes†","Organometallics","2000","19","10","1983","","10.1021/om000018i","","","0.71073","MoKα","","0.1636","0.0651","","","0.0951","0.13","","","","","","1.022","","","","has coordinates,has disorder","178663","2020-10-21","18:00:00",""
"4077468","9.4366","0.0018","13.2239","0.0011","22.802","0.003","83.046","0.008","79.024","0.014","70.639","0.011","2630.2","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C23 H28 B9 O P Ru -","- C23 H28 B9 O P Ru -","- C92 H112 B36 O4 P4 Ru4 -","4","2","","Du, Shaowu; Ellis, Dianne D.; Jelliss, Paul A.; Kautz, Jason A.; Malget, John M.; Stone, F. Gordon A.","Studies with the Ruthenacarborane Complex [Ru(CO)(PPh3)(THF)(η5-7,8-C2B9H11)]: Reactions with Terminal Alkynes†","Organometallics","2000","19","10","1983","","10.1021/om000018i","","","0.71073","MoKα","","0.0361","0.026","","","0.0598","0.0691","","","","","","1.075","","","","has coordinates","178663","2020-10-21","18:00:00",""
"4077469","12.32","0.003","37.838","0.01","10.216","0.003","90","","90","","90","","4762","2","97","","97","","","","","","","","","4","P c a b","-P 2bc 2ac","61","","","","- C27 H33 O3 P -","- C27 H33 O3 P -","- C216 H264 O24 P8 -","8","1","","Romain, Jeff K.; Ribblett, Jason W.; Byrn, Robert W.; Snyder, Richard D.; Storhoff, Bruce N.; Huffman, John C.","Synthesis and Properties of Phenyl Phosphines with Meta-Positioned Methyl Groups and the X-ray Structure of Tris(3,5-dimethyl-4-methoxyphenyl)phosphine","Organometallics","2000","19","10","2047","","10.1021/om000019a","","","0.71069","MoKα","","","0.0523","","","","0.0413","","","","","","1.4652","","","","has coordinates,has disorder","201982","2020-10-21","18:00:00",""
"4077470","10.7962","0.0019","10.943","0.003","13.959","0.003","107.392","0.015","95.6","0.02","100.476","0.019","1527.1","0.6","163","2","163","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H33 B10 Mo O4 P -","- C26 H33 B10 Mo O4 P -","- C52 H66 B20 Mo2 O8 P2 -","2","1","","Ellis, Dianne D.; Franken, Andreas; Jelliss, Paul A.; Stone, F. Gordon A.; Yu, Pui-Yin","Synthesis and Reactivity of Monocarbollide Carbonyl Complexes of Iron and Molybdenum with Icosahedral Frameworks†","Organometallics","2000","19","10","1993","","10.1021/om000033n","","","0.71073","MoKα","","0.0269","0.0221","","","0.0568","0.0576","","","","","","0.962","","","","has coordinates","178663","2020-10-21","18:00:00",""
"4077471","17.5961","0.0014","16.6039","0.0013","16.8279","0.0013","90","","102.73","0.02","90","","4795.7","0.8","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 H18 B10 Fe O4 -","- C8 H18 B10 Fe O4 -","- C96 H216 B120 Fe12 O48 -","12","3","","Ellis, Dianne D.; Franken, Andreas; Jelliss, Paul A.; Stone, F. Gordon A.; Yu, Pui-Yin","Synthesis and Reactivity of Monocarbollide Carbonyl Complexes of Iron and Molybdenum with Icosahedral Frameworks†","Organometallics","2000","19","10","1993","","10.1021/om000033n","","","0.71073","MoKα","","0.0605","0.0389","","","0.094","0.0997","","","","","","0.948","","","","has coordinates","178663","2020-10-21","18:00:00",""
"4077473","14.212","0.002","11.9479","0.0012","16.337","0.002","90","","96.911","0.012","90","","2753.9","0.6","466","2","466","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C28 H20 O8 Ru3 -","- C28 H20 O8 Ru3 -","- C112 H80 O32 Ru12 -","4","1","","Charmant, Jonathan P. H.; Davies, Guy; King, Philip J.; Wigginton, James R.; Sappa, E.","Reactivity of a Triruthenium Acetylide Complex toward Alkynes and the Silica-Mediated Dehydration of Cluster-Bound Alkynols: X-ray Crystal Structures of the Novel Butadienyl Species [Ru3(CO)8{μ3-η8-C(But)CC(Ph)C(H)Ph}] and the Unusual Complex [Ru3(CO)5(μ-CO){μ3-η5-CC(But)- OC(Ph)2CCH}{μ3-η6-CHC(CPh2OH)COC(CPh2)CH}]","Organometallics","2000","19","12","2330","","10.1021/om000048l","","","0.71073","MoKα","","0.0276","0.0252","","","0.0664","0.068","","","","","","1.178","","","","has coordinates","178663","2020-10-21","18:00:00",""
"4077474","9.8161","0.0017","12.972","0.003","19.602","0.003","81.76","0.03","78.649","0.018","87.883","0.018","2421.8","0.8","193","2","193","2","","","","","","","","4","P -1","-P 1","2","","","","- C55 H43 O9.5 Ru3 -","- C55 H42 O9.5 Ru3 -","- C110 H84 O19 Ru6 -","2","1","","Charmant, Jonathan P. H.; Davies, Guy; King, Philip J.; Wigginton, James R.; Sappa, E.","Reactivity of a Triruthenium Acetylide Complex toward Alkynes and the Silica-Mediated Dehydration of Cluster-Bound Alkynols: X-ray Crystal Structures of the Novel Butadienyl Species [Ru3(CO)8{μ3-η8-C(But)CC(Ph)C(H)Ph}] and the Unusual Complex [Ru3(CO)5(μ-CO){μ3-η5-CC(But)- OC(Ph)2CCH}{μ3-η6-CHC(CPh2OH)COC(CPh2)CH}]","Organometallics","2000","19","12","2330","","10.1021/om000048l","","","0.71073","MoKα","","0.0699","0.0441","","","0.1029","0.1371","","","","","","1.051","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077475","10.5781","0.0019","15.541","0.003","17.914","0.005","100.436","0.01","96","0.02","108.794","0.015","2699.5","1.1","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C59 H46 Cl2 O9 Ru3 -","- C59 H46 Cl2 O9 Ru3 -","- C118 H92 Cl4 O18 Ru6 -","2","1","","Charmant, Jonathan P. H.; Davies, Guy; King, Philip J.; Wigginton, James R.; Sappa, E.","Reactivity of a Triruthenium Acetylide Complex toward Alkynes and the Silica-Mediated Dehydration of Cluster-Bound Alkynols: X-ray Crystal Structures of the Novel Butadienyl Species [Ru3(CO)8{μ3-η8-C(But)CC(Ph)C(H)Ph}] and the Unusual Complex [Ru3(CO)5(μ-CO){μ3-η5-CC(But)- OC(Ph)2CCH}{μ3-η6-CHC(CPh2OH)COC(CPh2)CH}]","Organometallics","2000","19","12","2330","","10.1021/om000048l","","","0.71073","MoKα","","0.0797","0.038","","","0.0544","0.0628","","","","","","0.921","","","","has coordinates","178663","2020-10-21","18:00:00",""
"4077476","12.546","0.005","18.212","0.004","12.838","0.008","90","","118.11","0.05","90","","2587","2","160","2","160","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C38 H72 O4 P2 Si4 Yb -","- C38 H72 O4 P2 Si4 Yb -","- C76 H144 O8 P4 Si8 Yb2 -","2","0.5","","Clegg, William; Izod, Keith; Liddle, Stephen T.; O'Shaughness, Paul; Sheffield, Joanne M.","Synthesis and Structural Characterization of the First Lanthanide(II) Cuboidal Cluster. Unexpected C−O Activation by an Unchanged Ytterbium(II) Center","Organometallics","2000","19","11","2090","","10.1021/om000057u","","","0.71073","MoKα","","0.0918","0.0693","","","0.1822","0.1892","","","","","","1.001","","","","has coordinates,has disorder","178663","2020-10-21","18:00:00",""
"4077477","20.323","0.004","20.323","0.004","12.743","0.003","90","","90","","90","","5263.2","1.9","160","2","160","2","","","","","","","","6","I -4","I -4","82","","","","- C84 H164 O12 P4 Si8 Yb4 -","- C68 H124 O8 P4 Si8 Yb4 -","- C136 H248 O16 P8 Si16 Yb8 -","2","0.25","","Clegg, William; Izod, Keith; Liddle, Stephen T.; O'Shaughness, Paul; Sheffield, Joanne M.","Synthesis and Structural Characterization of the First Lanthanide(II) Cuboidal Cluster. Unexpected C−O Activation by an Unchanged Ytterbium(II) Center","Organometallics","2000","19","11","2090","","10.1021/om000057u","","","0.71073","MoKα","","0.0257","0.0233","","","0.0534","0.0544","","","","","","1.022","","","","has coordinates","178663","2020-10-21","18:00:00",""
"4077478","10.5525","0.0007","10.8527","0.0009","15.0268","0.0011","95.024","0.003","105.047","0.004","111.37","0.004","1515.6","0.2","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","Bis(dicyclohexylamino)phosphoranimin-N-trimethylalane","","- C27 H55 Al N3 P -","- C27 H55 Al N3 P -","- C54 H110 Al2 N6 P2 -","2","1","","Schulz, S.; Raab, M.; Nieger, M.; Niecke, E.","Syntheses and X-ray Structures of Novel Main Group Bis(dialkylamino)phosphinimides†","Organometallics","2000","19","13","2616","","10.1021/om000059e","","","0.71073","MoKα","","0.0649","0.041","","","0.097","0.1032","","","","","","0.953","","","","has coordinates","178663","2020-10-21","18:00:00",""
"4077479","11.7878","0.0002","35.4013","0.001","18.3712","0.0004","90","","91.813","0.002","90","","7662.5","0.3","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(dicyclohexylamino)phosphoranimin-N-tris(tert.butyl)alane","","- C36 H73 Al N3 P -","- C36 H73 Al N3 P -","- C288 H584 Al8 N24 P8 -","8","2","","Schulz, S.; Raab, M.; Nieger, M.; Niecke, E.","Syntheses and X-ray Structures of Novel Main Group Bis(dialkylamino)phosphinimides†","Organometallics","2000","19","13","2616","","10.1021/om000059e","","","0.71073","MoKα","","0.078","0.0497","","","0.1293","0.1386","","","","","","1.056","","","","has coordinates","178663","2020-10-21","18:00:00",""
"4077480","9.0387","0.0002","11.3829","0.0004","14.5238","0.0005","97.738","0.002","106.838","0.002","101.366","0.002","1372.61","0.08","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C52 H102 Al2 N6 P2 -","- C52 H102 Al2 N6 P2 -","- C52 H102 Al2 N6 P2 -","1","0.5","","Schulz, S.; Raab, M.; Nieger, M.; Niecke, E.","Syntheses and X-ray Structures of Novel Main Group Bis(dialkylamino)phosphinimides†","Organometallics","2000","19","13","2616","","10.1021/om000059e","","","0.71073","MoKα","","0.0489","0.0366","","","0.0921","0.0963","","","","","","1.077","","","","has coordinates,has disorder","178663","2020-10-21","18:00:00",""
"4077481","9.6873","0.0006","12.82","0.0009","14.2885","0.0012","98.725","0.004","105.978","0.004","106.748","0.004","1581.3","0.2","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C60 H120 Al2 N6 O P2 -","- C60 H120 Al2 N6 O P2 -","- C60 H120 Al2 N6 O P2 -","1","0.5","","Schulz, S.; Raab, M.; Nieger, M.; Niecke, E.","Syntheses and X-ray Structures of Novel Main Group Bis(dialkylamino)phosphinimides†","Organometallics","2000","19","13","2616","","10.1021/om000059e","","","0.71073","MoKα","","0.066","0.0471","","","0.1275","0.1351","","","","","","1.071","","","","has coordinates,has disorder","178663","2020-10-21","18:00:00",""
"4077482","5.273","0.001","7.62","0.002","10.972","0.002","83.21","0.01","89","0.02","82.02","0.02","433.53","0.16","173","2","173","2","","","","","","","","4","P -1","-P 1","2","[CuCl(coct)]2","bis(chloro-cyclooctyne-copper)","","- C16 H24 Cl2 Cu2 -","- C16 H24 Cl2 Cu2 -","- C16 H24 Cl2 Cu2 -","1","0.5","","Gröger, Gunther; Behrens, Ulrich; Olbrich, Falk","Monomeric and Dimeric Cyclooctyne-Stabilized Complexes of Copper(I)1","Organometallics","2000","19","17","3354","","10.1021/om000079g","","","0.71073","MoKα","","0.0305","0.0284","","","0.0772","0.0786","","","","","","1.088","","","","has coordinates","178663","2020-10-21","18:00:00",""
"4077483","4.789","0.002","7.837","0.001","23.697","0.005","90","","92.52","0.03","90","","888.5","0.4","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","[CuBr(coct)]2","bis(bromo-cyclooctyne-copper)","","- C16 H24 Br2 Cu2 -","- C16 H24 Br2 Cu2 -","- C32 H48 Br4 Cu4 -","2","0.5","","Gröger, Gunther; Behrens, Ulrich; Olbrich, Falk","Monomeric and Dimeric Cyclooctyne-Stabilized Complexes of Copper(I)1","Organometallics","2000","19","17","3354","","10.1021/om000079g","","","0.71073","MoKα","","0.0493","0.0317","","","0.0695","0.0762","","","","","","1.034","","","","has coordinates,has disorder","178663","2020-10-21","18:00:00",""
"4077484","4.981","0.003","9.192","0.004","10.763","0.006","85.39","0.04","80.17","0.06","81.45","0.05","479.4","0.5","173","2","173","2","","","","","","","","4","P -1","-P 1","2","[CuI(coct)]2","bis(iodo-cyclooctyne-copper)","","- C16 H24 Cu2 I2 -","- C16 H24 Cu2 I2 -","- C16 H24 Cu2 I2 -","1","0.5","","Gröger, Gunther; Behrens, Ulrich; Olbrich, Falk","Monomeric and Dimeric Cyclooctyne-Stabilized Complexes of Copper(I)1","Organometallics","2000","19","17","3354","","10.1021/om000079g","","","0.71073","MoKα","","0.0633","0.0596","","","0.1524","0.1564","","","","","","1.076","","","","has coordinates,has disorder","178663","2020-10-21","18:00:00",""
"4077485","13.1012","0.0002","15.9906","0.0003","15.1661","0.0001","90","","106.166","0.001","90","","3051.61","0.08","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","[CuCl(coct)2]","chloro-bis(cyclooctyne)copper","","- C16 H24 Cl Cu -","- C16 H24 Cl Cu -","- C128 H192 Cl8 Cu8 -","8","2","","Gröger, Gunther; Behrens, Ulrich; Olbrich, Falk","Monomeric and Dimeric Cyclooctyne-Stabilized Complexes of Copper(I)1","Organometallics","2000","19","17","3354","","10.1021/om000079g","","","0.71073","MoKα","","0.0528","0.036","","","0.0743","0.0813","","","","","","1.039","","","","has coordinates,has disorder","178663","2020-10-21","18:00:00",""
"4077486","14.79","0.009","9.315","0.007","22.093","0.015","90","","90","","90","","3044","4","173","2","173","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","[CuBr(coct)2]","bromo-bis(cyclooctyne)copper","","- C16 H24 Br Cu -","- C16 H24 Br Cu -","- C128 H192 Br8 Cu8 -","8","1","","Gröger, Gunther; Behrens, Ulrich; Olbrich, Falk","Monomeric and Dimeric Cyclooctyne-Stabilized Complexes of Copper(I)1","Organometallics","2000","19","17","3354","","10.1021/om000079g","","","1.54178","CuKα","","0.0971","0.0483","","","0.1201","0.1416","","","","","","0.998","","","","has coordinates","178663","2020-10-21","18:00:00",""
"4077487","15.109","0.0001","9.3298","0.0001","22.6794","0.0002","90","","90","","90","","3196.98","0.05","173","2","173","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","[CuI(coct)2]","bis(cyclooctyne)iodo-copper","","- C16 H24 Cu I -","- C16 H24 Cu I -","- C128 H192 Cu8 I8 -","8","1","","Gröger, Gunther; Behrens, Ulrich; Olbrich, Falk","Monomeric and Dimeric Cyclooctyne-Stabilized Complexes of Copper(I)1","Organometallics","2000","19","17","3354","","10.1021/om000079g","","","0.71073","MoKα","","0.0406","0.031","","","0.069","0.0723","","","","","","0.975","","","","has coordinates","178663","2020-10-21","18:00:00",""
"4077488","13.405","0.003","11.605","0.002","14.831","0.003","90","","110.06","0.03","90","","2167.2","0.9","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[Cu2Br2(coct)(tmtch)]n","dibromo(cyclooctyne)(3,3,6,6-tetramethyl-1-thia-cycloheptyne)dicopper polymer","","- C18 H28 Br2 Cu2 S -","- C18 H28 Br2 Cu2 S -","- C72 H112 Br8 Cu8 S4 -","4","1","","Gröger, Gunther; Behrens, Ulrich; Olbrich, Falk","Monomeric and Dimeric Cyclooctyne-Stabilized Complexes of Copper(I)1","Organometallics","2000","19","17","3354","","10.1021/om000079g","","","0.71073","MoKα","","0.091","0.0466","","","0.1035","0.1183","","","","","","0.935","","","","has coordinates","178663","2020-10-21","18:00:00",""
"4077489","16.319","0.003","49.65","0.01","7.487","0.001","90","","90","","90","","6066.3","1.8","183","2","183","2","","","","","","","synthesis","3","F d d 2","F 2 -2d","43","","","","- C34 H44 N2 -","- C34 H44 N2 -","- C272 H352 N16 -","8","0.5","","Nückel, Stefan; Burger, Peter","Transition Metal Complexes with Sterically Demanding Ligands. 2.1Meisenheimer Complex Formation and Deprotonation Reactions of a Sterically Demanding Aromatic Diimine†","Organometallics","2000","19","17","3305","","10.1021/om000084k","","","0.71073","MoKα","","0.0941","0.0499","","0.0909","0.0823","","","","0.992","1.241","1.241","","","","","has coordinates","178663","2020-10-21","18:00:00",""
"4077490","9.163","0.001","10.253","0.001","23.038","0.003","88.71","0.01","80.04","0.01","81.62","0.01","2109","0.4","193","2","193","2","","","","","","","synthesis","4","P -1","-P 1","2","","","","- C44 H69 Li N4 -","- C44 H69 Li N4 -","- C88 H138 Li2 N8 -","2","1","","Nückel, Stefan; Burger, Peter","Transition Metal Complexes with Sterically Demanding Ligands. 2.1Meisenheimer Complex Formation and Deprotonation Reactions of a Sterically Demanding Aromatic Diimine†","Organometallics","2000","19","17","3305","","10.1021/om000084k","","","0.71073","MoKα","","0.0926","0.0557","","0.1734","0.1376","","","","1.034","1.237","1.237","","","","","has coordinates","178663","2020-10-21","18:00:00",""
"4077491","12.979","0.001","15.703","0.001","22.942","0.002","90","","94.61","0.01","90","","4660.7","0.6","183","2","183","2","","","","","","","synthesis","5","P 1 21/c 1","-P 2ybc","14","","","","- C48 H77 Li2 N2 O1.5 -","- C48 H72 Li2 N2 O1.5 -","- C192 H288 Li8 N8 O6 -","4","1","","Nückel, Stefan; Burger, Peter","Transition Metal Complexes with Sterically Demanding Ligands. 2.1Meisenheimer Complex Formation and Deprotonation Reactions of a Sterically Demanding Aromatic Diimine†","Organometallics","2000","19","17","3305","","10.1021/om000084k","","","0.71073","MoKα","","0.1319","0.0429","","0.0719","0.06","","","","0.644","1.029","1.029","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077492","14.356","0.001","14.888","0.001","19.76","0.002","90","","99","0.01","90","","4171.4","0.6","193","2","193","2","","","","","","","synthesis","5","I 1 2/a 1","-I 2ya","15","","","","- C42 H62 Li2 N2 O4 -","- C42 H62 Li2 N2 O4 -","- C168 H248 Li8 N8 O16 -","4","0.5","","Nückel, Stefan; Burger, Peter","Transition Metal Complexes with Sterically Demanding Ligands. 2.1Meisenheimer Complex Formation and Deprotonation Reactions of a Sterically Demanding Aromatic Diimine†","Organometallics","2000","19","17","3305","","10.1021/om000084k","","","0.71073","MoKα","","0.0895","0.0631","","0.1657","0.1551","","","","1.068","1.268","1.268","","","","","has coordinates,has disorder","178663","2020-10-21","18:00:00",""
"4077493","12.762","0.014","16.3","0.02","24.71","0.09","90","","90","","90","","5140","2","293","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C42 H67 Cl3 N4 O4 P2 Ru -","- C42 H67 Cl3 N4 O4 P2 Ru -","- C168 H268 Cl12 N16 O16 P8 Ru4 -","4","1","","Mosquera, Marta E. G.; Ruiz, Javier; Riera, Víctor; Garcia-Granda, Santiago; Salvadó, Miguel A.","Complexes of Ruthenium(II) with Unsymmetrical Diphosphines and Diphosphinomethanides. A Way to Synthesize Chiral Metallodiphosphines","Organometallics","2000","19","25","5533","","10.1021/om000097y","","","0.71073","MoKα","","0.0856","0.0495","","","0.1288","0.1335","","","","","","1.09","","","","has coordinates","178663","2020-10-21","18:00:00",""
"4077494","9.7555","0.0015","20.737","0.003","10.4","0.002","90","","107.837","0.001","90","","2002.8","0.6","293","2","293","2","","","","","","","","7","P 1 21 1","P 2yb","4","Dichloro{1-{(R)-1-[(S)-2-(diphenylphosphino-(kP)ferrocenyl]ethyl}-3-phenyl-5-methyl-1H-pyrazole-(kN}palladium (2)","","","- C36 H34 Cl7 Fe N2 P Pd -","- C36 H34 Cl7 Fe N2 P Pd -","- C72 H68 Cl14 Fe2 N4 P2 Pd2 -","2","1","","Woo, Tom K.; Pioda, Giorgio; Rothlisberger, Ursula; Togni, Antonio","Chiral Palladium(II)−Bis(trichlorosilyl) Complexes. Synthesis, Structure, and Combined QM/MM Computational Studies","Organometallics","2000","19","11","2144","","10.1021/om000130g","","","0.71073","MoKα","","0.0808","0.0642","","0.1936","0.1791","","","","1.007","1.063","1.063","","","","","has coordinates","178663","2020-10-21","18:00:00",""
"4077495","17.966","0.012","17.966","0.012","10.785","0.007","90","","90","","120","","3015","3","293","2","293","2","","","","","","","","8","P 32","P 32","145","","Bis(trichlorosilyl)-{1-{(R)-1-[(S)-2-(diphenylphosphino-kP)ferrocenyl]ethyl}- 3-phenyl-5-methyl-1H-pyrazole-kN}palladium (5)","","- C35 H33 Cl8 Fe N2 P Pd Si2 -","- C34.3 H31 Cl6.6 Fe N2 P Pd Si2 -","- C102.9 H93 Cl19.8 Fe3 N6 P3 Pd3 Si6 -","3","1","","Woo, Tom K.; Pioda, Giorgio; Rothlisberger, Ursula; Togni, Antonio","Chiral Palladium(II)−Bis(trichlorosilyl) Complexes. Synthesis, Structure, and Combined QM/MM Computational Studies","Organometallics","2000","19","11","2144","","10.1021/om000130g","","","0.71073","MoKα","","0.0489","0.0385","","","0.0901","0.1042","","","","","","1.091","","","","has coordinates","178663","2020-10-21","18:00:00",""
"4077496","10.551","0.002","16.746","0.003","11.634","0.002","90","","105.28","0.03","90","","1982.9","0.7","293","2","293","2","","","","","","","","8","P 1 21 1","P 2yb","4","","Bis(trichlorosilyl)-{1-{(R)-1-[(S)-2-(diphenylphosphino-(P)ferrocenyl]ethyl}- 3-(2,4,6-trimethylphenyl)-1H-pyrazole-(N}palladium (6)","","- C36 H35 Cl6 Fe N2 P Pd Si2 -","- C36 H35 Cl6 Fe N2 P Pd Si2 -","- C72 H70 Cl12 Fe2 N4 P2 Pd2 Si4 -","2","1","","Woo, Tom K.; Pioda, Giorgio; Rothlisberger, Ursula; Togni, Antonio","Chiral Palladium(II)−Bis(trichlorosilyl) Complexes. Synthesis, Structure, and Combined QM/MM Computational Studies","Organometallics","2000","19","11","2144","","10.1021/om000130g","","","0.71073","MoKα","","0.0767","0.0535","","0.1431","0.1296","","","","1.007","1.055","1.055","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077497","12.648","0.003","15.678","0.003","11.565","0.003","109.373","0.019","110.63","0.02","90.69","0.02","2003","0.9","170.2","","170.2","","","","","","","","","5","P -1","-P 1","2","","","","- C22 H12 B F10 Ti -","- C24 H12 B F10 Ti -","- C96 H48 B4 F40 Ti4 -","4","2","","Chase, Preston A.; Piers, Warren E.; Parvez, Masood","Reactions of Bis(pentafluorophenyl)borane with Titanocene Dialkyls: Synthesis and Structure of Cp2Ti[η2-H2B(C6F5)2]","Organometallics","2000","19","10","2040","","10.1021/om0001319","","","0.7107","MoKα","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077498","12.5653","0.0012","17.516","0.002","17.705","0.002","68.232","0.01","80.442","0.009","81.676","0.01","3553.9","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C73 H42 Cl2 F20 P4 Pt4 -","- C73 H42 Cl2 F20 P4 Pt4 -","- C146 H84 Cl4 F40 P8 Pt8 -","2","1","","Alonso, Ester; Forniés, Juan; Fortuño, Consuelo; Martín, Antonio; Orpen, A. Guy","Polynuclear Homo- or Heterometallic Palladium(II)−Platinum(II) Pentafluorophenyl Complexes Containing Bridging Diphenylphosphido Ligands. 8.†Syntheses and Reactivity of the Tetranuclear [Pt4(μ2-PPh2)3{μ3-PPh(1,2-η2-Ph)-κ3P}(C6F5)4] Cluster","Organometallics","2000","19","14","2690","","10.1021/om000140h","","","0.71073","MoKα","","0.0389","0.0347","","0.1038","0.0981","","","","1.753","1.723","1.723","","","","","has coordinates,has disorder","178663","2020-10-21","18:00:00",""
"4077499","14.129","0.009","15.133","0.006","21.407","0.01","86.17","0.04","75.52","0.05","83.13","0.05","4397","4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C88 H60 F20 N2 O2 P4 Pt4 -","- C88 H48 F20 N2 O2 P4 Pt4 -","- C176 H96 F40 N4 O4 P8 Pt8 -","2","1","","Alonso, Ester; Forniés, Juan; Fortuño, Consuelo; Martín, Antonio; Orpen, A. Guy","Polynuclear Homo- or Heterometallic Palladium(II)−Platinum(II) Pentafluorophenyl Complexes Containing Bridging Diphenylphosphido Ligands. 8.†Syntheses and Reactivity of the Tetranuclear [Pt4(μ2-PPh2)3{μ3-PPh(1,2-η2-Ph)-κ3P}(C6F5)4] Cluster","Organometallics","2000","19","14","2690","","10.1021/om000140h","","","0.71073","MoKα","","0.0701","0.0418","","0.1347","0.1126","","","","0.914","0.9","0.9","","","","","has coordinates","178663","2020-10-21","18:00:00",""
"4077500","10.892","0.0003","11.861","0.0003","12.778","0.0003","73.858","0.0014","77.346","0.0015","87.235","0.0013","1547.05","0.07","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C96 H132 Ag6 N2 Pt2 -","- C58 H80 Ag4 N2 Pt2 -","- C58 H80 Ag4 N2 Pt2 -","1","0.5","","Ara, Irene; Forniés, Juan; Gómez, Julio; Lalinde, Elena; Moreno, M. Teresa","Versatile Behavior of [Pt2Ag4(C⋮C-t-Bu)8]: Synthesis, Structures, and Properties of [{Pt2Ag4(C⋮C-t-Bu)8}{Ag(bipy)}]4+and an Unprecedented Chain Polymeric Cocrystallization Adduct with a 2,2‘-bipy Ligand","Organometallics","2000","19","16","3137","","10.1021/om0001570","","","0.7107","MoKα","","0.0662","0.0534","","","0.1407","0.1579","","","","","","1.214","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077501","14.929","0.001","22.985","0.003","29.596","0.003","90","","91.72","0.01","90","","10151.1","1.8","200","2","200","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C88 H104 Ag8 Cl4 N8 O16 Pt2 -","- C88 H86 Ag8 Cl4 N8 O16 Pt2 -","- C352 H344 Ag32 Cl16 N32 O64 Pt8 -","4","0.5","","Ara, Irene; Forniés, Juan; Gómez, Julio; Lalinde, Elena; Moreno, M. Teresa","Versatile Behavior of [Pt2Ag4(C⋮C-t-Bu)8]: Synthesis, Structures, and Properties of [{Pt2Ag4(C⋮C-t-Bu)8}{Ag(bipy)}]4+and an Unprecedented Chain Polymeric Cocrystallization Adduct with a 2,2‘-bipy Ligand","Organometallics","2000","19","16","3137","","10.1021/om0001570","","","0.71073","MoKα","","0.1091","0.0521","","0.1125","0.0925","","","","1.025","1.13","1.13","","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077502","10.4367","0.0011","20.164","0.002","10.573","0.0009","90","","100.243","0.006","90","","2189.6","0.4","193","2","193","2","","","","","","","","7","P 1 21/m 1","-P 2yb","11","","","","- C42 H53 Cl2 Hf N3 P2 Si2 -","- C42 H53 Cl2 Hf N3 P2 Si2 -","- C84 H106 Cl4 Hf2 N6 P4 Si4 -","2","0.5","","Kamalesh Babu, Ruppa P.; McDonald, Robert; Cavell, Ronald G.","Nucleophilic Reactivity of the Multiply Bonded Carbon Center in Group 4−Pincer Bis(iminophosphorano)methanediide Complexes","Organometallics","2000","19","18","3462","","10.1021/om000181d","","","0.71073","MoKa","","0.0411","0.0339","","0.0834","0.0798","","","","1.039","1.063","1.063","","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077503","22.7155","0.0015","14.2639","0.0009","12.4956","0.0008","90","","90","","90","","4048.7","0.5","193","2","193","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C38 H47 Cl2 Hf N3 P2 Si2 -","- C38 H47 Cl2 Hf N3 P2 Si2 -","- C152 H188 Cl8 Hf4 N12 P8 Si8 -","4","1","","Kamalesh Babu, Ruppa P.; McDonald, Robert; Cavell, Ronald G.","Nucleophilic Reactivity of the Multiply Bonded Carbon Center in Group 4−Pincer Bis(iminophosphorano)methanediide Complexes","Organometallics","2000","19","18","3462","","10.1021/om000181d","","","0.71073","MoKα","","0.0528","0.0354","","","0.0727","0.0774","","","","","","0.941","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077504","11.5636","0.0008","18.4194","0.0012","28.0498","0.0019","90","","94.0569","0.0013","90","","5959.5","0.7","193","2","193","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C58.5 H80 Cl2 N4 O P2 Si2 Zr -","- C58.5 H76 Cl2 N4 O P2 Si2 Zr -","- C234 H304 Cl8 N16 O4 P8 Si8 Zr4 -","4","1","","Kamalesh Babu, Ruppa P.; McDonald, Robert; Cavell, Ronald G.","Nucleophilic Reactivity of the Multiply Bonded Carbon Center in Group 4−Pincer Bis(iminophosphorano)methanediide Complexes","Organometallics","2000","19","18","3462","","10.1021/om000181d","","","0.71073","MoKα","","0.1015","0.0585","","","0.1516","0.1657","","","","","","1.028","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077505","14.404","0.004","12.704","0.004","29.271","0.006","90","","92.97","0.02","90","","5349","3","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C99 H162 Ce2 K O6 Si6 -","- C97.344 H150.688 Ce2 K O6 Si6 -","- C194.688 H301.376 Ce4 K2 O12 Si12 -","2","0.5","","Gun'ko, Yurii K.; Hitchcock, Peter B.; Lappert, Michael F.","Nonclassical Organolanthanoid Metal Chemistry: [K([18]-crown-6)(η2-PhMe)2]X (X = [(LnCpt3)2(μ-H)], [(LnCp‘ ‘2)2(μ-η6:η6-PhMe)]) from [LnCpx3], K, and [18]-crown-6 in Toluene (Ln = La, Ce; Cpt= η5-C5H4SiMe2But; Cp‘ ‘ = η5-C5H3(SiMe3)2-1,3)","Organometallics","2000","19","15","2832","","10.1021/om0001873","","","0.71073","MoKα","","0.0712","0.0462","","0.1153","0.1019","","","","1.016","1.043","1.043","","","","","has coordinates,has disorder","178664","2020-10-21","18:00:00",""
"4077506","17.88","0.005","11.301","0.005","16.378","0.005","90","0.005","90","0.005","90","0.005","3309","2","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C16 H18 Cl N3 O Pd -","- C16 H18 Cl N3 O Pd -","- C128 H144 Cl8 N24 O8 Pd8 -","8","1","","Aresta, Michele; Giannoccaro, Potenzo; Tommasi, Immacolata; Dibenedetto, Angela; Manotti Lanfredi, Anna Maria; Ugozzoli, Franco","Synthesis and Solid State and Solution Characterization of Mono- and Di-(η1-C) Carbamoyl−Palladium Complexes. New Efficient Palladium-Catalyzed Routes to Carbamoyl Chlorides: Key Intermediates to Isocyanates, Carbamic Esters, and Ureas","Organometallics","2000","19","19","3879","","10.1021/om000198w","","","0.71069","MoKα","","0.0809","0.0437","","0.1248","0.1139","","","","0.896","1.061","1.061","","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077507","16.089","0.005","16.576","0.005","8.216","0.005","90","0.005","90","0.005","90","0.005","2191.1","1.6","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C22 H28 N4 O2 Pd -","- C22 H28 N4 O2 Pd -","- C88 H112 N16 O8 Pd4 -","4","1","","Aresta, Michele; Giannoccaro, Potenzo; Tommasi, Immacolata; Dibenedetto, Angela; Manotti Lanfredi, Anna Maria; Ugozzoli, Franco","Synthesis and Solid State and Solution Characterization of Mono- and Di-(η1-C) Carbamoyl−Palladium Complexes. New Efficient Palladium-Catalyzed Routes to Carbamoyl Chlorides: Key Intermediates to Isocyanates, Carbamic Esters, and Ureas","Organometallics","2000","19","19","3879","","10.1021/om000198w","","","0.71069","MoKα","","0.1246","0.0661","","0.1797","0.1586","","","","0.85","1.206","1.206","","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077508","9.3683","0.0009","9.5511","0.0009","15.6898","0.0015","75.976","0.002","80.678","0.002","71.735","0.002","1287.8","0.2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H6 Fe4 O12 S4 -","- C15 H6 Fe4 O12 S4 -","- C30 H12 Fe8 O24 S8 -","2","1","","Song, Li-Cheng; Hu, Qing-Mei; Fan, Hong-Tao; Sun, Bao-Wei; Tang, Ming-Yi; Chen, Yu; Sun, Yi; Sun, Cui-Xiang; Wu, Qiang-Jin","Synthesis and Characterization of Double- and Triple-Butterfly Fe/S Cluster Complexes Obtained from the Novel Butterfly Cluster Anions {(μ-RS)(μ-CO)[Fe2(CO)6]2(μ4-S)}-and (μ-RS)(μ-S-)[Fe2(CO)6]3(μ4-S)2. Crystal Structures of (μ-MeS)(μ-PhNHCS)[Fe2(CO)6]2(μ4-S), (μ-MeS)(μ-MeSCS)[Fe2(CO)6]2(μ4-S), and (μ-PhCH2S)2[Fe2(CO)6]3(μ4-S)2","Organometallics","2000","19","19","3909","","10.1021/om0002071","","","0.71073","MoKα","","0.0495","0.0342","","","0.0788","0.0858","","","","","","0.985","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077509","15.371","0.003","11.934","0.003","19.36","0.005","90","","90","0.01","90","","3551.4","1.5","200","0.2","200","0.2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C28 H63 B F4 O4 Os2 P2 -","- C28 H47 B F4 O4 Os2 P2 -","- C112 H188 B4 F16 O16 Os8 P8 -","4","1","","Esteruelas, Miguel A.; García-Yebra, Cristina; Oliván, Montserrat; Oñate, Enrique","Reaction of a Cationic Osmium(IV) Dihydride with Ethylene: Formation and Structure of the Novel Tetraethylene Dimer Complex [{(PiPr3)(η2-C2H4)2Os}2(μ-OH)2(μ-O2CCH3)]BF4","Organometallics","2000","19","16","3260","3262","10.1021/om000214p","","","0.71069","MoKα","","0.0858","0.0488","","","0.1023","0.1162","","","","","","1.02","","","","has coordinates","180536","2020-10-21","18:00:00",""
"4077510","21.787","0.004","8.178","0.002","32.205","0.006","90","","97.23","0.03","90","","5692","2","153","2","153","2","","","","","","","","7","I 1 2/a 1","-I 2ya","15","","","","- C26 H27 Br3 Hg1.5 O2 P Pt -","- C26 H27 Br3 Hg1.5 O2 P Pt -","- C208 H216 Br24 Hg12 O16 P8 Pt8 -","8","1","","Ara, Irene; Falvello, Larry R.; Forniés, Juan; Sicilia, Violeta; Villarroya, Pablo","Reactivity of [M(C∧P)(acac-O,O‘)] [M = Pt, Pd; C∧P = CH2-C6H4-P(o-tolyl)2-κC,P; acac = 2,4-pentanedionato] toward HgX2(X = Br, I, CH3COO, CF3COO). New Polynuclear Complexes Containing Pt−Hg Bonds. Molecular Structures of [{Pt(C∧P)(acac-O,O‘)- HgBr(μ-Br)}2(μ-HgBr2)], an Unprecedented Square-Planar Bromomercurate Complex, and [{Pt(C∧P)(μ-O2CCH3)2Hg(μ3-acac2‒κC3,O)Hg(O2CCH3-κO)}· CHCl3]2, the First Complex Containing Asymmetric Dimercurated Acetylacetone","Organometallics","2000","19","16","3091","","10.1021/om000223y","","","0.71073","MoKα","","0.1058","0.0494","","0.1388","0.1157","","","","1.021","1.118","1.118","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077511","10.488","0.001","13.158","0.002","15.821","0.002","77.15","0.01","75.74","0.01","68.39","0.01","1946.2","0.5","200","2","200","2","","","","","","","","7","P -1","-P 1","2","","","","- C33 H36 Cl3 Hg2 O8 P Pt -","- C33 H36 Cl3 Hg2 O8 P Pt -","- C66 H72 Cl6 Hg4 O16 P2 Pt2 -","2","1","","Ara, Irene; Falvello, Larry R.; Forniés, Juan; Sicilia, Violeta; Villarroya, Pablo","Reactivity of [M(C∧P)(acac-O,O‘)] [M = Pt, Pd; C∧P = CH2-C6H4-P(o-tolyl)2-κC,P; acac = 2,4-pentanedionato] toward HgX2(X = Br, I, CH3COO, CF3COO). New Polynuclear Complexes Containing Pt−Hg Bonds. Molecular Structures of [{Pt(C∧P)(acac-O,O‘)- HgBr(μ-Br)}2(μ-HgBr2)], an Unprecedented Square-Planar Bromomercurate Complex, and [{Pt(C∧P)(μ-O2CCH3)2Hg(μ3-acac2‒κC3,O)Hg(O2CCH3-κO)}· CHCl3]2, the First Complex Containing Asymmetric Dimercurated Acetylacetone","Organometallics","2000","19","16","3091","","10.1021/om000223y","","","0.71073","MoKα","","0.0681","0.0425","","0.1011","0.0907","","","","1.04","1.094","1.094","","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077512","8.9595","0.0002","17.7941","0.0006","12.1757","0.0004","90","","103.688","0.002","90","","1886","0.1","150","1","150","1","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C42 H46 N2 P2 Ru -","- C42 H46 N2 P2 Ru -","- C84 H92 N4 P4 Ru2 -","2","1","","Abdur-Rashid, Kamaluddin; Lough, Alan J.; Morris, Robert H.","Ruthenium Dihydride RuH2(PPh3)2((R,R)-cyclohexyldiamine) and Ruthenium Monohydride RuHCl(PPh3)2((R,R)-cyclohexyldiamine): Active Catalyst and Catalyst Precursor for the Hydrogenation of Ketones and Imines","Organometallics","2000","19","14","2655","","10.1021/om000231e","","","0.71073","MoKα","","0.0455","0.0369","","","0.0648","0.0677","","","","","","1.041","","","","has coordinates","209531","2020-10-21","18:00:00",""
"4077513","9.6698","0.0013","24.129","0.003","10.2718","0.0014","90","","90.724","0.002","90","","2396.5","0.5","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","bis[(m-1,2:5,6-di-O-isopropylidene-D-mannitolate)bis(2-propoxo)titanium(IV)]","","- C36 H68 O16 Ti2 -","- C36 H66 O16 Ti2 -","- C72 H132 O32 Ti4 -","2","1","","You, Jing-Song; Shao, Ming-Yuan; Gau, Han-Mou","Enantioselective Addition of Diethylzinc to Aldehydes Catalyzed by Titanium(IV) Complexes of Diol Derivatives ofd-Mannitol and the Spectroscopic Study of the Catalytic System","Organometallics","2000","19","17","3368","","10.1021/om000265m","","","0.71073","MoKα","","0.0776","0.048","","","0.1111","0.1236","","","","","","1.094","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077514","13.584","0.003","13.527","0.003","17.136","0.003","90","","109.18","0.03","90","","2974","1.2","293","2","293","2","","","","","","","","5","P 1 n 1","P -2yac","7","","","","- C26 H42 F6 Fe P4 -","- C26 H42 F6 Fe P4 -","- C104 H168 F24 Fe4 P16 -","4","2","","Edwards, Peter G.; Whatton, Mark L.; Haigh, Robert","A New Nine-Membered Triphosphorus Macrocycle","Organometallics","2000","19","14","2652","","10.1021/om0002879","","","0.71073","MoKα","","0.0652","0.0598","","","0.1623","0.1737","","","","","","1.091","","","","has coordinates,has disorder","178664","2020-10-21","18:00:00",""
"4077515","12.9208","0.0013","20.381","0.002","16.6709","0.0016","90","","104.406","0.002","90","","4252.1","0.7","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C42.5 H42 Cl4 Os P2 -","- C42.5 H41 Cl4 Os P2 -","- C170 H164 Cl16 Os4 P8 -","4","1","","Wen, Ting Bin; Yang, Sheng-Yong; Zhou, Zhong Yuan; Lin, Zhenyang; Lau, Chak-Po; Jia, Guochen","Unexpected Formation of Osmium Carbyne and Vinylidene Complexes from the Reaction of OsCl2(PPh3)3with HC⋮CCMe3","Organometallics","2000","19","19","3757","","10.1021/om000306e","","","0.71073","MoKα","","0.054","0.0358","","","0.0848","0.0915","","","","","","0.96","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077516","12.3785","0.0013","13.8032","0.0014","17.2639","0.0017","78.28","0.002","70.488","0.002","65.374","0.002","2520.4","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C54 H59 Cl Os P2 -","- C54 H59 Cl Os P2 -","- C108 H118 Cl2 Os2 P4 -","2","1","","Wen, Ting Bin; Yang, Sheng-Yong; Zhou, Zhong Yuan; Lin, Zhenyang; Lau, Chak-Po; Jia, Guochen","Unexpected Formation of Osmium Carbyne and Vinylidene Complexes from the Reaction of OsCl2(PPh3)3with HC⋮CCMe3","Organometallics","2000","19","19","3757","","10.1021/om000306e","","","0.71073","MoKα","","0.0676","0.0466","","","0.1049","0.1163","","","","","","0.959","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077517","13.154","0.008","15.008","0.003","29.868","0.006","90","0.005","90.84","0.05","90","0.005","5896","4","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C58 H59 F3 N5 O7 P3 Ru S2 -","- C58 H51 F3 N5 O7 P3 Ru S2 -","- C232 H204 F12 N20 O28 P12 Ru4 S8 -","4","1","","Bianchini, Claudio; Dal Santo, Vladimiro; Meli, Andrea; Oberhauser, Werner; Psaro, Rinaldo; Vizza, Francesco","Preparation, Characterization, and Performance of the Supported Hydrogen-Bonded Ruthenium Catalyst [(sulphos)Ru(NCMe)3](OSO2CF3)/SiO2. Comparisons with Analogous Homogeneous and Aqueous-Biphase Catalytic Systems in the Hydrogenation of Benzylideneacetone and Benzonitrile","Organometallics","2000","19","13","2433","","10.1021/om000309r","","","0.71069","MoKα","","0.1347","0.0683","","0.2152","0.1755","","","","1.037","1.077","1.077","","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077518","12.131","0.003","12.19","0.003","15.223","0.002","95.11","0.002","105.91","0.002","116.59","0.003","1876.3","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C44 H43 Fe N O2 P2 -","- C44 H43 Fe N O2 P2 -","- C88 H86 Fe2 N2 O4 P4 -","2","1","","Denis, Raphaël; Toupet, Loïc; Paul, Frédéric; Lapinte, Claude","Electron-Rich Piano-Stool Iron σ-Acetylides Bearing a Functional Aryl Group. Synthesis and Characterization of Iron(II) and Iron(III) Complexes†","Organometallics","2000","19","21","4240","","10.1021/om000325o","","","0.71069","MoKα","","0.065","0.0381","","","0.0988","0.108","","","","","","1.036","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077519","13.806","0.002","22.282","0.002","14.392","0.001","90","","107.316","0.01","90","","4226.7","0.8","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C49 H56 Fe P2 -","- C49 H44 Fe P2 -","- C196 H176 Fe4 P8 -","4","1","","Denis, Raphaël; Toupet, Loïc; Paul, Frédéric; Lapinte, Claude","Electron-Rich Piano-Stool Iron σ-Acetylides Bearing a Functional Aryl Group. Synthesis and Characterization of Iron(II) and Iron(III) Complexes†","Organometallics","2000","19","21","4240","","10.1021/om000325o","","","0.71069","MoKα","","0.1271","0.053","","","0.1287","0.1529","","","","","","1.006","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077520","10.636","0.001","7.635","0.001","11.912","0.001","90","","111.454","0.006","90","","900.3","0.17","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H22 Cl2 Mo2 -","- C18 H22 Cl2 Mo2 -","- C36 H44 Cl4 Mo4 -","2","0.5","","Le Grognec, Erwan; Poli, Rinaldo; Richard, Philippe","Dialkyl(butadiene)cyclopentadienylmolybdenum(III) Complexes. Synthesis, Characterization, and Reactivity","Organometallics","2000","19","19","3842","","10.1021/om000329t","","","0.71073","MoKα","","0.0528","0.0463","","0.1404","0.1349","","","","1.119","1.136","1.136","","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077521","15.092","0.001","7.458","0.001","22.186","0.002","90","","91.248","0.008","90","","2496.6","0.4","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C13 H21 Mo -","- C13 H21 Mo -","- C104 H168 Mo8 -","8","2","","Le Grognec, Erwan; Poli, Rinaldo; Richard, Philippe","Dialkyl(butadiene)cyclopentadienylmolybdenum(III) Complexes. Synthesis, Characterization, and Reactivity","Organometallics","2000","19","19","3842","","10.1021/om000329t","","","0.71073","MoKα","","0.0329","0.0276","","0.0747","0.0727","","","","1.063","1.101","1.101","","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077522","14.566","0.001","14.717","0.001","16.7","0.001","90","","90","","90","","3579.9","0.4","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C15 H15 F6 Mo O4 -","- C15 H15 F6 Mo O4 -","- C120 H120 F48 Mo8 O32 -","8","1","","Le Grognec, Erwan; Poli, Rinaldo; Richard, Philippe","Dialkyl(butadiene)cyclopentadienylmolybdenum(III) Complexes. Synthesis, Characterization, and Reactivity","Organometallics","2000","19","19","3842","","10.1021/om000329t","","","0.71073","MoKα","","0.0652","0.0416","","0.1296","0.1132","","","","1.033","1.054","1.054","","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077523","8.703","0.0002","19.521","0.0003","12.441","0.0003","90","","90","","90","","2113.62","0.08","293","2","110","2","","","","","","","","5","P b c m","-P 2c 2b","57","","","","- C11 H15 Br0.77 Cl0.23 Mo -","- C11 H15 Br0.774 Cl0.226 Mo -","- C88 H120 Br6.192 Cl1.808 Mo8 -","8","1","","Le Grognec, Erwan; Poli, Rinaldo; Richard, Philippe","Dialkyl(butadiene)cyclopentadienylmolybdenum(III) Complexes. Synthesis, Characterization, and Reactivity","Organometallics","2000","19","19","3842","","10.1021/om000329t","","","0.71073","MoKα","","0.0368","0.029","","","0.0641","0.0671","","","","","","1.079","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077524","11.95","0.001","12.387","0.001","19.381","0.001","90","","90","","90","","2868.9","0.4","293","2","293","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C16 H47 Al N4 Si4 -","- C16 H47 Al N4 Si4 -","- C64 H188 Al4 N16 Si16 -","4","0.5","","Uhl, Werner; Molter, Jens; Neumüller, Bernhard","tert-Butylaluminum Bis[1,2-bis(trimethylsilyl)hydrazide]: The First Alkylaluminum Dihydrazide","Organometallics","2000","19","21","4422","","10.1021/om000330s","","","0.71073","MoKα","","0.0737","0.0567","","","0.1463","0.1585","","","","","","1.161","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077525","15.387","0.002","18.193","0.002","17.997","0.002","90","","103.34","0.02","90","","4902.1","1.1","190","1","190","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H15 As O10 W2 -","- C20 H15 As O10 W2 -","- C160 H120 As8 O80 W16 -","8","2","","Johnson, Brian P.; Schiffer, Michael; Scheer, Manfred","Novel Approach to Intermediates Containing a Tungsten−Arsenic Triple Bond†","Organometallics","2000","19","17","3404","","10.1021/om0003436","","","0.71073","MoKα","","0.0917","0.052","","","0.1138","0.1251","","","","","","0.886","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077526","8.545","0.0017","13.506","0.003","13.253","0.003","90","","90","","90","","1529.5","0.6","210","2","210","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C12 H15 As3 O2 W -","- C12 H15 As3 O2 W -","- C48 H60 As12 O8 W4 -","4","0.5","","Johnson, Brian P.; Schiffer, Michael; Scheer, Manfred","Novel Approach to Intermediates Containing a Tungsten−Arsenic Triple Bond†","Organometallics","2000","19","17","3404","","10.1021/om0003436","","","0.71073","MoKα","","0.0298","0.0269","","","0.0691","0.0706","","","","","","1.102","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077527","10.18","0.002","16.34","0.003","19.866","0.004","90","","97.73","0.03","90","","3274.5","1.1","200","1","200","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H30 As4 O6 W4 -","- C26 H30 As4 O6 W4 -","- C104 H120 As16 O24 W16 -","4","1","","Johnson, Brian P.; Schiffer, Michael; Scheer, Manfred","Novel Approach to Intermediates Containing a Tungsten−Arsenic Triple Bond†","Organometallics","2000","19","17","3404","","10.1021/om0003436","","","0.71073","MoKα","","0.055","0.0389","","","0.0945","0.1046","","","","","","0.954","","","","has coordinates,has disorder","178664","2020-10-21","18:00:00",""
"4077528","17.402","0.004","14.307","0.003","18.855","0.004","90","","116.15","0.03","90","","4213.8","1.9","200","1","200","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34.5 H34 As4 O11 W5 -","- C35 H34 As4 O11 W5 -","- C140 H136 As16 O44 W20 -","4","1","","Johnson, Brian P.; Schiffer, Michael; Scheer, Manfred","Novel Approach to Intermediates Containing a Tungsten−Arsenic Triple Bond†","Organometallics","2000","19","17","3404","","10.1021/om0003436","","","0.71073","MoKα","","0.0573","0.0448","","","0.1213","0.1339","","","","","","1.039","","","","has coordinates,has disorder","192342","2020-10-21","18:00:00",""
"4077529","8.742","","23.683","","10.049","","90","","106.87","","90","","1990.98","","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C10 H21 F3 O6 Os P2 S -","- C10 H21 F3 O6 Os P2 S -","- C40 H84 F12 O24 Os4 P8 S4 -","4","1","","Bellachioma, Gianfranco; Cardaci, Giuseppe; Macchioni, Alceo; Valentini, Francesco; Zuccaccia, Cristiano; Foresti, Elisabetta; Sabatino, Piera","Cationic Osmium(II) Acetyl Complexes Bearing Pyrazolylmethane Ligands: Intramolecular and Interionic Structure and Isolation of an Intermediate Containing the “Os−I−Ag” Moiety","Organometallics","2000","19","21","4320","","10.1021/om000344y","","","0.71069","MoKα","","0.0659","0.0405","","","0.1003","0.1069","","","","","","1.354","","","","has coordinates,has disorder","178664","2020-10-21","18:00:00",""
"4077530","27.088","0.004","9.909","0.001","14.865","0.002","90","","102.82","0.02","90","","3890.5","0.9","100","2","100","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C21 H21 Mo N O5 -","- C21 H16 Mo N O5 -","- C168 H128 Mo8 N8 O40 -","8","2","","van Staveren, Dave R.; Weyhermüller, Thomas; Metzler-Nolte, Nils","The Mo(η-allyl)(CO)2Moiety as a Robust Marker Group in Bioorganometallic Chemistry. Unusual Crystal Structure of the Phenylalanine Derivative Mo(C5H4-CO-Phe-OMe)(η-allyl)(CO)2","Organometallics","2000","19","18","3730","","10.1021/om0003483","","","0.71073","MoKα","","0.0874","0.0606","","0.1592","0.1413","","","","0.999","1.087","1.087","","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077531","20.4587","0.0017","20.4587","0.0017","12.6985","0.0015","90","","90","","90","","5315.1","0.9","160","2","160","2","","","","","","","","6","I -4","I -4","82","","","","- C84 H156 Ca4 O12 P4 Si8 -","- C68 H124 Ca4 O8 P4 Si8 -","- C136 H248 Ca8 O16 P8 Si16 -","2","0.25","","Izod, Keith; Clegg, William; Liddle, Stephen T.","Parallels between the Chemistry of Calcium(II) and Ytterbium(II). Synthesis and Crystal Structure of a Calcium Alkoxo-Phosphide Cuboidal Complex","Organometallics","2000","19","18","3640","","10.1021/om000357b","","","0.71073","MoKα","","0.044","0.032","","","0.06","0.0626","","","","","","0.962","","","","has coordinates,has disorder","178664","2020-10-21","18:00:00",""
"4077532","9.2707","0.0002","12.818","0.0002","13.9085","0.0001","112.734","0.001","94.479","0.001","110.266","0.001","1386.43","0.04","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H23 F9 N4 O6 Pt -","- C22 H23 F9 N4 O6 Pt -","- C44 H46 F18 N8 O12 Pt2 -","2","1","","Baar, Cliff R.; Jennings, Michael C.; Vittal, Jagadese J.; Puddephatt, Richard J.","Activation of Imines by Platinum(II) To Give Aminoalkyl Complexes: Scope and Limitations of the Reaction","Organometallics","2000","19","20","4150","","10.1021/om000401n","","","0.71073","MoKα","","0.0511","0.0385","","","0.0841","0.088","","","","","","1.043","","","","has coordinates,has disorder","178664","2020-10-21","18:00:00",""
"4077533","9.3415","0.0002","10.5506","0.0002","22.3484","0.0002","90","","97.89","0.001","90","","2181.77","0.07","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C17 H25 Cl3 N4 O Pt -","- C17 H22 Cl3 N4 O Pt -","- C68 H88 Cl12 N16 O4 Pt4 -","4","1","","Baar, Cliff R.; Jennings, Michael C.; Vittal, Jagadese J.; Puddephatt, Richard J.","Activation of Imines by Platinum(II) To Give Aminoalkyl Complexes: Scope and Limitations of the Reaction","Organometallics","2000","19","20","4150","","10.1021/om000401n","","","0.71073","MoKα","","0.0663","0.0422","","","0.0759","0.0831","","","","","","1.108","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077534","21.7762","0.0018","12.9791","0.0008","19.4521","0.0015","90","","115.272","0.003","90","","4971.7","0.7","200","2","200","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C26 H25 F3 N4 O2 Pt -","- C26 H25 F3 N4 O2 Pt -","- C208 H200 F24 N32 O16 Pt8 -","8","1","","Baar, Cliff R.; Jennings, Michael C.; Vittal, Jagadese J.; Puddephatt, Richard J.","Activation of Imines by Platinum(II) To Give Aminoalkyl Complexes: Scope and Limitations of the Reaction","Organometallics","2000","19","20","4150","","10.1021/om000401n","","","0.71073","MoKα","","0.0662","0.0337","","","0.0612","0.0678","","","","","","0.964","","","","has coordinates,has disorder","178664","2020-10-21","18:00:00",""
"4077535","9.0613","0.0003","21.64","0.001","11.0531","0.0005","90","","98.409","0.003","90","","2144.06","0.16","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H28 Cl2 N4 O Pt -","- C18 H28 Cl2 N4 O Pt -","- C72 H112 Cl8 N16 O4 Pt4 -","4","1","","Baar, Cliff R.; Jennings, Michael C.; Vittal, Jagadese J.; Puddephatt, Richard J.","Activation of Imines by Platinum(II) To Give Aminoalkyl Complexes: Scope and Limitations of the Reaction","Organometallics","2000","19","20","4150","","10.1021/om000401n","","","0.71073","MoKα","","0.0505","0.038","","","0.093","0.1012","","","","","","1.072","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077536","7.3909","0.0006","10.357","0.0008","11.6657","0.0004","88.13","0.001","77.995","0.001","88.089","0.001","872.66","0.1","125.2","","125.2","","","","","","","","","4","P -1","-P 1","2","","","","- C10 H12 Fe N2 -","- C10 H12 Fe N2 -","- C40 H48 Fe4 N8 -","4","2","","Shafir, Alexandr; Power, Maurice P.; Whitener, Glenn D.; Arnold, John","Synthesis, Structure, and Properties of 1,1‘-Diamino- and 1,1‘-Diazidoferrocene","Organometallics","2000","19","19","3978","","10.1021/om0004085","","","0.7107","MoKα","","","0.0331","","","0.0386","","","","","1.848","1.848","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077537","9.0587","0.0002","9.0587","0.0002","50.2953","0.0008","90","0.001","90","0.001","90","0.001","4127.23","0.14","161.2","","161.2","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C10 H8 Fe N6 -","- C10 H8 Fe N6 -","- C160 H128 Fe16 N96 -","16","2","","Shafir, Alexandr; Power, Maurice P.; Whitener, Glenn D.; Arnold, John","Synthesis, Structure, and Properties of 1,1‘-Diamino- and 1,1‘-Diazidoferrocene","Organometallics","2000","19","19","3978","","10.1021/om0004085","","","0.7107","MoKalpha","","","0.0354","","","0.045","","","","","1.022","1.022","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077538","23.472","0.005","11.12","0.003","20.593","0.006","90","","106.98","0.02","90","","5141","2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C23 H11 N O10 Os3 -","- C23 H11 N O10 Os3 -","- C184 H88 N8 O80 Os24 -","8","1","","Cabeza, Javier A.; del Río, Ignacio; Grepioni, Fabrizia; Riera, Víctor","Approaches to Triosmium Carbonyl Cluster Compounds Derived from Benzophenone Imine. Characterization of Terminal Imino, Bridging Amido, and Orthometalated Imino Derivatives","Organometallics","2000","19","22","4643","","10.1021/om0004139","","","0.71073","MoKα","","0.065","0.053","","","0.1406","0.1489","","","","","","0.989","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077539","11.029","0.001","12.278","0.001","15.922","0.002","101.681","0.004","106.035","0.003","94.08","0.004","2010.7","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C41 H28 N2 O9 Os3 -","- C41 H28 N2 O9 Os3 -","- C82 H56 N4 O18 Os6 -","2","1","","Cabeza, Javier A.; del Río, Ignacio; Grepioni, Fabrizia; Riera, Víctor","Approaches to Triosmium Carbonyl Cluster Compounds Derived from Benzophenone Imine. Characterization of Terminal Imino, Bridging Amido, and Orthometalated Imino Derivatives","Organometallics","2000","19","22","4643","","10.1021/om0004139","","","0.71073","MoKα","","0.1284","0.0505","","","0.0982","0.1147","","","","","","0.807","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077540","13","0.01","12.548","0.007","16.36","0.01","90","","108.97","0.08","90","","2524","3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C23 H11 N O10 Os3 -","- C23 H11 N O10 Os3 -","- C92 H44 N4 O40 Os12 -","4","1","","Cabeza, Javier A.; del Río, Ignacio; Grepioni, Fabrizia; Riera, Víctor","Approaches to Triosmium Carbonyl Cluster Compounds Derived from Benzophenone Imine. Characterization of Terminal Imino, Bridging Amido, and Orthometalated Imino Derivatives","Organometallics","2000","19","22","4643","","10.1021/om0004139","","","0.71073","MoKα","","0.0486","0.0349","","","0.0876","0.0931","","","","","","1.018","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077541","7.6496","0.0012","14.278","0.003","9.039","0.002","90","","90","","90","","987.2","0.3","153","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","bis(η^2^-ethene)(2,4-pentanedionato)rhodium(I)","","- C9 H15 O2 Rh -","- C9 H15 O2 Rh -","- C36 H60 O8 Rh4 -","4","0.5","","Bühl, Michael; Håkansson, Mikael; Mahmoudkhani, Amir H.; Öhrström, Lars","X-ray Structures and DFT Calculations on Rhodium−Olefin Complexes: Comments on the103Rh NMR Shift−Stability Correlation","Organometallics","2000","19","26","5589","","10.1021/om000419y","","","0.71073","MoKα","","0.0517","0.0253","","0.0991","0.0733","","","","0.74","0.646","0.646","","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077542","16.9179","0.0003","8.2015","0.00001","8.5513","0.0002","90","","90","","90","","1186.51","0.03","183","2","183","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","bis(η^2^-ethene)(1,1,1,5,5,5-hexafluoro-2,4-pentanedionato)rhodium(I)","","- C9 H9 F6 O2 Rh -","- C9 H9 F6 O2 Rh -","- C36 H36 F24 O8 Rh4 -","4","0.5","","Bühl, Michael; Håkansson, Mikael; Mahmoudkhani, Amir H.; Öhrström, Lars","X-ray Structures and DFT Calculations on Rhodium−Olefin Complexes: Comments on the103Rh NMR Shift−Stability Correlation","Organometallics","2000","19","26","5589","","10.1021/om000419y","","","0.71073","MoKα","","0.0704","0.0421","","","0.0773","0.0882","","","","","","1.045","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077543","9.244","0.001","15.079","0.002","19.991","0.002","90","","94.377","0.008","90","","2778.4","0.6","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C31 H31 Cl P2 Ru -","- C31 H31 Cl P2 Ru -","- C124 H124 Cl4 P8 Ru4 -","4","1","","Freeman, Samuel T. N.; Lemke, Frederick R.; Haar, Christopher M.; Nolan, Steven P.; Petersen, Jeffrey L.","Effect of Ancillary Ligation on the Relative Bond Disruption Enthalpies of Ru−H and Ru−Cl Bonds in Cp(PR3)2RuX (PR3= PMe3, PMe2Ph, PMePh2, PPh3; X = H, Cl)","Organometallics","2000","19","23","4828","","10.1021/om000420x","","","0.71073","MoKα","","0.047","0.0285","","0.0641","0.0569","","","","1.039","1.078","1.078","","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077544","16.106","0.001","14.22","0.001","37.378","0.004","90","","90","","90","","8560.6","1.2","295","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C21 H27 Cl P2 Ru -","- C21 H27 Cl P2 Ru -","- C336 H432 Cl16 P32 Ru16 -","16","2","","Freeman, Samuel T. N.; Lemke, Frederick R.; Haar, Christopher M.; Nolan, Steven P.; Petersen, Jeffrey L.","Effect of Ancillary Ligation on the Relative Bond Disruption Enthalpies of Ru−H and Ru−Cl Bonds in Cp(PR3)2RuX (PR3= PMe3, PMe2Ph, PMePh2, PPh3; X = H, Cl)","Organometallics","2000","19","23","4828","","10.1021/om000420x","","","0.71073","MoKα","","0.1011","0.0456","","0.0927","0.0746","","","","1.001","1.077","1.077","","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077545","11.359","0.002","18.684","0.005","10.826","0.002","96.41","0.02","107.87","0.02","81.71","0.03","2158.4","0.8","296.2","","296.2","","","","","","","","","7","P -1","-P 1","2","","","","- C42 H32 Cl2 Fe2 O9 Os3 Pt -","- C42 H30 Cl2 Fe2 O9 Os3 Pt -","- C84 H60 Cl4 Fe4 O18 Os6 Pt2 -","2","1","","Adams, Richard D.; Qu, Bo","New Triosmium Complexes Containing a Partially Hydrogenated Bis(ferrocenyl)butadiyne Ligand. Their Structures and Electrochemical Responses","Organometallics","2000","19","20","4090","","10.1021/om000432i","","","0.7107","MoKα","","0.0391","0.0391","","0.0545","","0.0545","","","1.181","","","1.181","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077546","12.4923","0.0008","20.6369","0.001","10.0889","0.0012","90","","90","","90","","2600.9","0.4","293","2","293","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C28 H28 Cl2 Fe Pt S2 -","- C28 H28 Cl2 Fe Pt S2 -","- C112 H112 Cl8 Fe4 Pt4 S8 -","4","0.5","","Gibson, Vernon C.; Long, Nicholas J.; White, Andrew J. P.; Williams, Charlotte K.; Williams, David J.","Hang-gliding with Ferrocenes: Unusual Coordination Chemistry of 1,1‘-Bis(mesitylthio)ferrocene","Organometallics","2000","19","21","4425","","10.1021/om0004388","","","1.54178","CuKα","","0.0422","0.0328","","0.0789","0.0734","","","","1.064","1.087","1.087","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077547","15.518","0.002","23.182","0.004","10.2274","0.0015","90","","90","","90","","3679.2","1","293","2","293","2","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C34 H30 Br2 Fe O6 Re2 S2 -","- C34 H30 Br2 Fe O6 Re2 S2 -","- C136 H120 Br8 Fe4 O24 Re8 S8 -","4","0.5","","Gibson, Vernon C.; Long, Nicholas J.; White, Andrew J. P.; Williams, Charlotte K.; Williams, David J.","Hang-gliding with Ferrocenes: Unusual Coordination Chemistry of 1,1‘-Bis(mesitylthio)ferrocene","Organometallics","2000","19","21","4425","","10.1021/om0004388","","","0.71073","MoKα","","0.1096","0.0489","","0.1375","0.0717","","","","1.012","1.116","1.116","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077548","12.1874","0.0005","15.6037","0.0007","14.5968","0.0006","90","","94.317","0.001","90","","2768","0.2","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H39 N3 Si2 W -","- C27 H39 N3 Si2 W -","- C108 H156 N12 Si8 W4 -","4","1","","Mills, R. C.; Abboud, K. A.; Boncella, J. M.","Synthesis of d2Tungsten Arene Complexes and Their Reaction with Diphenylacetylene","Organometallics","2000","19","16","2953","","10.1021/om0004390","","","0.71073","MoKα","","0.0798","0.0371","","","0.0553","0.0642","","","","","","0.961","","","","has coordinates,has disorder","178664","2020-10-21","18:00:00",""
"4077549","18.4684","0.0008","20.4038","0.0009","20.9892","0.0009","90","","109.78","0.001","90","","7442.6","0.6","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C40 H45 N3 Si2 W -","- C40 H45 N3 Si2 W -","- C320 H360 N24 Si16 W8 -","8","2","","Mills, R. C.; Abboud, K. A.; Boncella, J. M.","Synthesis of d2Tungsten Arene Complexes and Their Reaction with Diphenylacetylene","Organometallics","2000","19","16","2953","","10.1021/om0004390","","","0.71073","MoKα","","0.0548","0.0328","","","0.0619","0.0708","","","","","","1.074","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077550","12.6683","0.0006","13.2799","0.0006","18.9746","0.0009","99.488","0.001","91.418","0.001","117.656","0.001","2770","0.2","193","","193","","","","","","","","","6","P -1","-P 1","2","","","","- C50 H41 B2 F24 N7 Pt -","- C50 H41 B2 F27 N7 Pt -","- C100 H82 B4 F54 N14 Pt2 -","2","1","","Reinartz, Stefan; White, Peter S.; Brookhart, Maurice; Templeton, Joseph L.","Acid-Assisted Reductive Elimination as a Route to Platinum(II) Products from Platinum(IV) Tris(pyrazolyl)borate Reagents","Organometallics","2000","19","19","3854","","10.1021/om000440z","","","0.71073","MolybdenumKα","","0.031","0.031","","0.038","0.038","","","","","1.31","1.31","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077551","12.8583","0.0006","12.9407","0.0006","18.6034","0.0008","76.164","0.001","86.584","0.001","75.713","0.001","2912.7","0.2","193","","193","","","","","","","","","7","P -1","-P 1","2","","","","- C53 H46 B2 F24 N6 O2 Pt -","- C53 H46 B2 F24 N6 O2 Pt -","- C106 H92 B4 F48 N12 O4 Pt2 -","2","1","","Reinartz, Stefan; White, Peter S.; Brookhart, Maurice; Templeton, Joseph L.","Acid-Assisted Reductive Elimination as a Route to Platinum(II) Products from Platinum(IV) Tris(pyrazolyl)borate Reagents","Organometallics","2000","19","19","3854","","10.1021/om000440z","","","0.71073","MolybdenumKα","","0.068","0.046","","0.052","0.05","","","","","1.21","1.21","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077552","14.3058","0.0007","14.8057","0.0007","16.2241","0.0007","89.352","0.001","69.624","0.001","87.03","0.001","3217","0.3","193","","193","","","","","","","","","8","P -1","-P 1","2","","","","- C57 H50 B2 Cl2 F24 N6 P Pt -","- C57 H50 B2 Cl2 F24 N6 P Pt -","- C114 H100 B4 Cl4 F48 N12 P2 Pt2 -","2","1","","Reinartz, Stefan; White, Peter S.; Brookhart, Maurice; Templeton, Joseph L.","Acid-Assisted Reductive Elimination as a Route to Platinum(II) Products from Platinum(IV) Tris(pyrazolyl)borate Reagents","Organometallics","2000","19","19","3854","","10.1021/om000440z","","","0.71073","MolybdenumKα","","0.042","0.034","","0.044","0.043","","","","","1.51","1.51","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077553","13.0249","0.0005","13.1185","0.0005","18.1205","0.0006","75.995","0.001","89.703","0.001","68.347","0.001","2780","0.18","193","","193","","","","","","","","","6","P -1","-P 1","2","","","","- C50 H42 B2 F24 N6 Pt -","- C50 H42 B2 F24 N6 Pt -","- C100 H84 B4 F48 N12 Pt2 -","2","1","","Reinartz, Stefan; White, Peter S.; Brookhart, Maurice; Templeton, Joseph L.","Acid-Assisted Reductive Elimination as a Route to Platinum(II) Products from Platinum(IV) Tris(pyrazolyl)borate Reagents","Organometallics","2000","19","19","3854","","10.1021/om000440z","","","0.71073","MolybdenumKα","","0.047","0.035","","0.041","0.04","","","","","1.92","1.92","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077554","13.0098","0.0007","27.2034","0.0014","19.7507","0.001","90","","93.723","0.001","90","","6975.2","0.6","193","","193","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C64 H60 B2 F24 N6 P2 Pt -","- C64 H60 B2 F30 N6 P2 Pt -","- C256 H240 B8 F120 N24 P8 Pt4 -","4","1","","Reinartz, Stefan; White, Peter S.; Brookhart, Maurice; Templeton, Joseph L.","Acid-Assisted Reductive Elimination as a Route to Platinum(II) Products from Platinum(IV) Tris(pyrazolyl)borate Reagents","Organometallics","2000","19","19","3854","","10.1021/om000440z","","","0.71073","MolybdenumKα","","0.048","0.038","","0.044","0.043","","","","","3.18","3.18","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077555","16.2303","0.0004","8.5099","0.0002","17.1741","0.0004","90","","111.752","0.001","90","","2203.16","0.09","193","","193","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H31 B N6 Pt S -","- C18 H31 B N6 Pt S -","- C72 H124 B4 N24 Pt4 S4 -","4","1","","Reinartz, Stefan; White, Peter S.; Brookhart, Maurice; Templeton, Joseph L.","Acid-Assisted Reductive Elimination as a Route to Platinum(II) Products from Platinum(IV) Tris(pyrazolyl)borate Reagents","Organometallics","2000","19","19","3854","","10.1021/om000440z","","","0.71073","MolybdenumKα","","0.032","0.028","","0.042","0.041","","","","","1.96","1.96","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077556","17.0866","0.0016","11.4896","0.0011","18.9224","0.0018","90","","114.909","0.002","90","","3369.3","0.6","160","2","160","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C29 H52 N2 Na O1.5 P Si2 -","- C29 H52 N2 Na O1.504 P Si2 -","- C116 H208 N8 Na4 O6.016 P4 Si8 -","4","1","","Hill, M. N. Stuart; Izod, Keith; O'Shaughness, Paul; Clegg, William","Synthesis, Structures, and Solution Dynamics of Functionalized Phosphinomethanide Complexes of the Alkali Metals","Organometallics","2000","19","22","4531","","10.1021/om000447g","","","0.71073","MoKα","","0.1016","0.0493","","","0.1047","0.1218","","","","","","0.922","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4077557","11.812","0.003","18.296","0.004","7.486","0.001","90","","90","","90","","1617.8","0.6","123","","123","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C16 H22 Cl N Zr -","- C16 H22 Cl N Zr -","- C64 H88 Cl4 N4 Zr4 -","4","1","","Armstrong, David R.; Henderson, Kenneth W.; Little, Ian; Jenny, Charles; Kennedy, Alan R.; McKeown, Arlene E.; Mulvey, Robert E.","Zirconocene Ketimides: Synthesis, Structural Characterization, Ethylene Polymerization Activity, and ab Initio Computational Studies","Organometallics","2000","19","21","4369","","10.1021/om000451s","","","0.7107","MoKalpha","","0.0378","0.0242","","0.0342","0.0317","","","","","1.137","1.137","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077558","11.2828","0.0016","25.283","0.003","17.109","0.003","90","","93.175","0.019","90","","4873.1","1.2","170","2","170","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C38 H60 B11 Cl4 N3 Pt Sn -","- C38 H60 B11 Cl4 N3 Pt Sn -","- C152 H240 B44 Cl16 N12 Pt4 Sn4 -","4","1","","Marx, Thiemo; Wesemann, Lars; Dehnen, Stefanie","A Zwitterionic Transition-Metal Complex: Platinum−closo-Borate Coordination Synthesis, Structure, and DFT Calculations","Organometallics","2000","19","22","4653","","10.1021/om000456p","","","0.71073","MoKα","","0.0637","0.0449","","","0.1068","0.1132","","","","","","0.986","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077559","16.3551","0.0001","10.9925","0.0001","17.7108","0.0001","90","","97.35","","90","","3157.95","0.04","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C38 H30 O2 Os P2 -","- C38 H30 O2 Os P2 -","- C152 H120 O8 Os4 P8 -","4","1","","Rickard, Clifton E. F.; Roper, Warren R.; Williamson, Alex; Wright, L. James","Reactions ofcisandtransBcat, Aryl Osmium Complexes (cat = 1,2-O2C6H4). Bis(Bcat) Complexes of Osmium and Ruthenium and a Structural Comparison ofcisandtransIsomers of Os(Bcat)I(CO)2(PPh3)2","Organometallics","2000","19","21","4344","","10.1021/om0004601","","","0.71073","MoKα","","0.0251","0.0222","","","0.0545","0.0565","","","","","","1.06","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077560","10.3198","0.0002","26.6368","0.0004","18.1347","0.0001","90","","102.171","0.001","90","","4872.93","0.12","203","2","203","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Carbonyl(p-tolylisocyanide)bis(catecolborate)bis(triphenylphosphine)osmium(II)","","- C57 H45 B2 N O5 Os P2 -","- C57 H45 B2 N O5 Os P2 -","- C228 H180 B8 N4 O20 Os4 P8 -","4","1","","Rickard, Clifton E. F.; Roper, Warren R.; Williamson, Alex; Wright, L. James","Reactions ofcisandtransBcat, Aryl Osmium Complexes (cat = 1,2-O2C6H4). Bis(Bcat) Complexes of Osmium and Ruthenium and a Structural Comparison ofcisandtransIsomers of Os(Bcat)I(CO)2(PPh3)2","Organometallics","2000","19","21","4344","","10.1021/om0004601","","","0.71073","MoKα","","0.0869","0.0481","","","0.0698","0.0836","","","","","","1.096","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077561","13.7644","0.0003","19.0556","0.0004","18.7402","0.0003","90","","94.342","0.001","90","","4901.24","0.17","203","2","203","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis(carbonyl)bis(catecolborate)bis(triphenylphosphine)ruthenium(II) Toluene solvate","","- C57 H46 B2 O6 P2 Ru -","- C57 H46 B2 O6 P2 Ru -","- C228 H184 B8 O24 P8 Ru4 -","4","1","","Rickard, Clifton E. F.; Roper, Warren R.; Williamson, Alex; Wright, L. James","Reactions ofcisandtransBcat, Aryl Osmium Complexes (cat = 1,2-O2C6H4). Bis(Bcat) Complexes of Osmium and Ruthenium and a Structural Comparison ofcisandtransIsomers of Os(Bcat)I(CO)2(PPh3)2","Organometallics","2000","19","21","4344","","10.1021/om0004601","","","0.71073","MoKα","","0.0693","0.04","","","0.0926","0.1104","","","","","","0.949","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077562","10.3153","0.0003","26.6868","0.0009","18.1026","0.0005","90","","102.177","0.001","90","","4871.2","0.3","203","2","203","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Carbonyl(p-tolylisocyanide)bis(catecolborate)bis(triphenylphosphine)ruthenium(II)","","- C57 H45 B2 N O5 P2 Ru -","- C57 H45 B2 N O5 P2 Ru -","- C228 H180 B8 N4 O20 P8 Ru4 -","4","1","","Rickard, Clifton E. F.; Roper, Warren R.; Williamson, Alex; Wright, L. James","Reactions ofcisandtransBcat, Aryl Osmium Complexes (cat = 1,2-O2C6H4). Bis(Bcat) Complexes of Osmium and Ruthenium and a Structural Comparison ofcisandtransIsomers of Os(Bcat)I(CO)2(PPh3)2","Organometallics","2000","19","21","4344","","10.1021/om0004601","","","0.71073","MoKα","","0.0737","0.0416","","","0.0678","0.0788","","","","","","1.072","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077563","12.0712","0.0001","17.2622","0.0001","34.6301","0.0001","90","","90","","90","","7216.06","0.08","200","2","200","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C40 H30 Cl4 O2 Os P2 -","- C40 H30 Cl4 O2 Os P2 -","- C320 H240 Cl32 O16 Os8 P16 -","8","1","","Rickard, Clifton E. F.; Roper, Warren R.; Williamson, Alex; Wright, L. James","Reactions ofcisandtransBcat, Aryl Osmium Complexes (cat = 1,2-O2C6H4). Bis(Bcat) Complexes of Osmium and Ruthenium and a Structural Comparison ofcisandtransIsomers of Os(Bcat)I(CO)2(PPh3)2","Organometallics","2000","19","21","4344","","10.1021/om0004601","","","0.71073","MoKα","","0.0468","0.0434","","","0.0902","0.0914","","","","","","1.393","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077564","17.5028","0.0002","13.2932","0.0001","19.4297","0.0002","90","","109.013","0.001","90","","4274.05","0.08","203","2","203","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","Iodobis(carbonyl)(catecolborate)bis(triphenylphosphine)osmium(II)","","- C45 H36 B Cl2 I O4 Os P2 -","- C45 H36 B Cl2 I O4 Os P2 -","- C180 H144 B4 Cl8 I4 O16 Os4 P8 -","4","1","","Rickard, Clifton E. F.; Roper, Warren R.; Williamson, Alex; Wright, L. James","Reactions ofcisandtransBcat, Aryl Osmium Complexes (cat = 1,2-O2C6H4). Bis(Bcat) Complexes of Osmium and Ruthenium and a Structural Comparison ofcisandtransIsomers of Os(Bcat)I(CO)2(PPh3)2","Organometallics","2000","19","21","4344","","10.1021/om0004601","","","0.71073","MoKα","","0.0228","0.0207","","","0.054","0.0553","","","","","","1.104","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077565","11.2964","0.0001","11.906","0.0001","31.3608","0.0003","90","","90","","90","","4217.87","0.07","203","2","203","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","Iodobis(carbonyl)(catecolborate)bis(triphenylphosphine)osmium(II) Dichloromethane solvate","","- C45 H36 B Cl2 I O4 Os P2 -","- C45 H36 B Cl2 I O4 Os P2 -","- C180 H144 B4 Cl8 I4 O16 Os4 P8 -","4","1","","Rickard, Clifton E. F.; Roper, Warren R.; Williamson, Alex; Wright, L. James","Reactions ofcisandtransBcat, Aryl Osmium Complexes (cat = 1,2-O2C6H4). Bis(Bcat) Complexes of Osmium and Ruthenium and a Structural Comparison ofcisandtransIsomers of Os(Bcat)I(CO)2(PPh3)2","Organometallics","2000","19","21","4344","","10.1021/om0004601","","","0.71073","MoKα","","0.0276","0.0249","","","0.0547","0.056","","","","","","1.015","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077566","13.4032","0.0013","9.9449","0.0013","18.9743","0.0019","90","","99.895","0.012","90","","2491.5","0.5","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H37 F6 P2 Rh -","- C22 H37 F6 P2 Rh -","- C88 H148 F24 P8 Rh4 -","4","1","","Werner, Helmut; Canepa, Giuseppe; Ilg, Kerstin; Wolf, Justin","Half-Sandwich Type Rhodium(I) Complexes with Arenes and Functionalized Arenes C6H5X(CH2)nPR2(R =iPr,tBu) as Nonchelating and Chelating Ligands","Organometallics","2000","19","23","4756","","10.1021/om0004646","","","0.71073","MoKα","","0.0465","0.0386","","","0.101","0.1052","","","","","","1.015","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077567","13.4365","0.0016","9.7565","0.0008","20.086","0.002","90","","104.023","0.014","90","","2554.7","0.5","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H39 F6 P2 Rh -","- C23 H39 F6 P2 Rh -","- C92 H156 F24 P8 Rh4 -","4","1","","Werner, Helmut; Canepa, Giuseppe; Ilg, Kerstin; Wolf, Justin","Half-Sandwich Type Rhodium(I) Complexes with Arenes and Functionalized Arenes C6H5X(CH2)nPR2(R =iPr,tBu) as Nonchelating and Chelating Ligands","Organometallics","2000","19","23","4756","","10.1021/om0004646","","","0.71073","MoKα","","0.0535","0.0413","","","0.1046","0.1105","","","","","","1.01","","","","has coordinates,has disorder","178664","2020-10-21","18:00:00",""
"4077568","8.7487","0.0017","17.578","0.004","13.27","0.003","90","","92.91","0.03","90","","2038.1","0.8","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17 H29 F6 P2 Rh -","- C17 H29 F6.006 P2 Rh -","- C68 H116 F24.024 P8 Rh4 -","4","1","","Werner, Helmut; Canepa, Giuseppe; Ilg, Kerstin; Wolf, Justin","Half-Sandwich Type Rhodium(I) Complexes with Arenes and Functionalized Arenes C6H5X(CH2)nPR2(R =iPr,tBu) as Nonchelating and Chelating Ligands","Organometallics","2000","19","23","4756","","10.1021/om0004646","","","0.71073","MoKα","","0.0761","0.0484","","","0.1027","0.1207","","","","","","0.997","","","","has coordinates,has disorder","178664","2020-10-21","18:00:00",""
"4077569","18.1505","0.0009","14.6079","0.0007","21.074","0.001","90","","101.339","0.001","90","","5478.5","0.5","203","2","203","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C49 H27 B F24 Mn O7 P -","- C49 H27 B F24 Mn O7 P -","- C196 H108 B4 F96 Mn4 O28 P4 -","4","1","","Fang, Xinggao; Scott, Brian L.; John, Kevin D.; Kubas, Gregory J.","Synthesis of and Small Molecule Coordination to Highly Electrophilic Cationic Manganese(I) and Rhenium(I) Carbonyl Complexes with Tied-Back Phosphites","Organometallics","2000","19","20","4141","","10.1021/om0004693","","","0.71073","MoKα","","0.0826","0.0602","","","0.1761","0.1948","","","","","","1.092","","","","has coordinates,has disorder","178664","2020-10-21","18:00:00",""
"4077570","12.9841","0.0009","14.2024","0.001","16.3209","0.0012","91.325","0.001","98.447","0.001","102.836","0.002","2897.8","0.4","203","2","203","2","","","","","","","","7","P -1","-P 1","2","","","","- C49 H40 B F24 O10 P2 Re -","- C49 H40 B F24 O10 P2 Re -","- C98 H80 B2 F48 O20 P4 Re2 -","2","1","","Fang, Xinggao; Scott, Brian L.; John, Kevin D.; Kubas, Gregory J.","Synthesis of and Small Molecule Coordination to Highly Electrophilic Cationic Manganese(I) and Rhenium(I) Carbonyl Complexes with Tied-Back Phosphites","Organometallics","2000","19","20","4141","","10.1021/om0004693","","","0.71073","MoKα","","0.0943","0.0644","","","0.1152","0.1246","","","","","","1.275","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077571","19.707","0.001","16.5848","0.0008","18.5384","0.001","90","","94.6","0.001","90","","6039.5","0.5","203","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C50 H31 B F24 O14 P2 Re2 -","- C50 H31 B F24 O14 P2 Re2 -","- C200 H124 B4 F96 O56 P8 Re8 -","4","0.5","","Fang, Xinggao; Scott, Brian L.; John, Kevin D.; Kubas, Gregory J.","Synthesis of and Small Molecule Coordination to Highly Electrophilic Cationic Manganese(I) and Rhenium(I) Carbonyl Complexes with Tied-Back Phosphites","Organometallics","2000","19","20","4141","","10.1021/om0004693","","","0.71073","MoKα","","0.0308","0.0277","","","0.0811","0.0834","","","","","","1.408","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077572","8.335","0.001","11.94","0.001","11.324","0.003","90","","110.43","0.01","90","","1056.1","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Compound 3","N',N'-Dimethylhydrazono-1-(1,3-dithiolane-2-yliden)propanone","","- C8 H12 N2 O S2 -","- C8 H12 N2 O S2 -","- C32 H48 N8 O4 S8 -","4","1","","Ortega-Jiménez, Fernando; Ortega-Alfaro, M. Carmen; López-Cortés, José G.; Gutiérrez-Pérez, René; Toscano, Rubén A.; Velasco-Ibarra, Luis; Peña-Cabrera, Eduardo; Alvarez-Toledano, Cecilio","Synthesis and Characterization of Novel Iron(0) Complexes Derived from α,β-Unsaturated-Ketone Analogues with β-Positioned Heteroatoms Containing Covalent and Coordination Bonds","Organometallics","2000","19","20","4127","","10.1021/om0004702","","","0.71073","MoKα","","0.0745","0.0491","","","0.1183","0.1346","","","","","","1.04","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4077573","7.416","0.002","10.182","0.003","11.486","0.004","75.62","0.02","87.7","0.02","80.13","0.02","827.7","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Compound 5","Tricarbonyl-η^4^-[4-phenyl-1-(1,3-dithiolane-2-yliden)-3(E)-butenone]iron(0)","","- C16 H12 Fe O4 S2 -","- C16 H12 Fe O4 S2 -","- C32 H24 Fe2 O8 S4 -","2","1","","Ortega-Jiménez, Fernando; Ortega-Alfaro, M. Carmen; López-Cortés, José G.; Gutiérrez-Pérez, René; Toscano, Rubén A.; Velasco-Ibarra, Luis; Peña-Cabrera, Eduardo; Alvarez-Toledano, Cecilio","Synthesis and Characterization of Novel Iron(0) Complexes Derived from α,β-Unsaturated-Ketone Analogues with β-Positioned Heteroatoms Containing Covalent and Coordination Bonds","Organometallics","2000","19","20","4127","","10.1021/om0004702","","","0.71073","MoKα","","0.0568","0.041","","","0.1001","0.1055","","","","","","0.923","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077574","8.411","0.001","17.236","0.002","14.038","0.003","90","","101.05","0.02","90","","1997.4","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Compound 6","Pentacarbonyl-μS,μC,σO,σS-[4-phenyl-1-(2-sulfanylethylthio)-3(E)-butenone] diiron(0)","","- C18 H12 Fe2 O6 S2 -","- C18 H12 Fe2 O6 S2 -","- C72 H48 Fe8 O24 S8 -","4","1","","Ortega-Jiménez, Fernando; Ortega-Alfaro, M. Carmen; López-Cortés, José G.; Gutiérrez-Pérez, René; Toscano, Rubén A.; Velasco-Ibarra, Luis; Peña-Cabrera, Eduardo; Alvarez-Toledano, Cecilio","Synthesis and Characterization of Novel Iron(0) Complexes Derived from α,β-Unsaturated-Ketone Analogues with β-Positioned Heteroatoms Containing Covalent and Coordination Bonds","Organometallics","2000","19","20","4127","","10.1021/om0004702","","","0.71073","MoKα","","0.0798","0.0443","","","0.1092","0.1254","","","","","","1.063","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077575","7.467","0.002","10.255","0.002","12.199","0.003","82.16","0.02","73.35","0.03","82.55","0.02","882.6","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","Compound 8","Tetracarbonyl-η^2^-[4-(2-Pyridyl)-1-(1,3-dithiolane-2-yliden)-3(E)- butenone]iron(0)","","- C16 H11 Fe N O5 S2 -","- C16 H11 Fe N O5 S2 -","- C32 H22 Fe2 N2 O10 S4 -","2","1","","Ortega-Jiménez, Fernando; Ortega-Alfaro, M. Carmen; López-Cortés, José G.; Gutiérrez-Pérez, René; Toscano, Rubén A.; Velasco-Ibarra, Luis; Peña-Cabrera, Eduardo; Alvarez-Toledano, Cecilio","Synthesis and Characterization of Novel Iron(0) Complexes Derived from α,β-Unsaturated-Ketone Analogues with β-Positioned Heteroatoms Containing Covalent and Coordination Bonds","Organometallics","2000","19","20","4127","","10.1021/om0004702","","","0.71073","MoKα","","0.0777","0.0531","","","0.1536","0.2018","","","","","","1.087","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077576","16.072","0.006","9.68","0.002","13.174","0.003","90","","107","0.02","90","","1960","1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Compound 9","Hexacarbonyl-μN,σO,σC-[N',N'-Dimethylhydrazono-1-(1,3-dithiolane-2-yliden) propanone]diiron(0)","","- C14 H12 Fe2 N2 O7 S2 -","- C14 H12 Fe2 N2 O7 S2 -","- C56 H48 Fe8 N8 O28 S8 -","4","1","","Ortega-Jiménez, Fernando; Ortega-Alfaro, M. Carmen; López-Cortés, José G.; Gutiérrez-Pérez, René; Toscano, Rubén A.; Velasco-Ibarra, Luis; Peña-Cabrera, Eduardo; Alvarez-Toledano, Cecilio","Synthesis and Characterization of Novel Iron(0) Complexes Derived from α,β-Unsaturated-Ketone Analogues with β-Positioned Heteroatoms Containing Covalent and Coordination Bonds","Organometallics","2000","19","20","4127","","10.1021/om0004702","","","0.71073","MoKα","","0.1191","0.0618","","","0.153","0.1868","","","","","","1.05","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077577","10.8302","0.0016","14.743","0.002","16.083","0.002","81.856","0.002","80.155","0.002","68.65","0.002","2347.7","0.6","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C61 H41 N P2 Pt -","- C61 H41 N P2 Pt -","- C122 H82 N2 P4 Pt2 -","2","1","","Bosch, Eric; Barnes, Charles L.","Synthesis and Crystallographic Characterization of a Novel Platinocycle","Organometallics","2000","19","25","5522","","10.1021/om0004904","","","0.7107","MoKα","","0.0341","0.0276","","","0.0788","0.0852","","","","","","0.691","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077578","44.482","0.004","12.8","0.001","26.56","0.002","90","","125.204","0.001","90","","12356.6","1.7","203","2","203","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C100 H152 Cl11 K4 N20 Nb6 O6 -","- C100 H152 Cl11 K4 N20 Nb6 O6 -","- C400 H608 Cl44 K16 N80 Nb24 O24 -","4","0.5","","Tayebani, Maryam; Conoci, Sabrina; Feghali, Khalil; Gambarotta, Sandro; Yap, Glenn P. A.","Tri- and Tetravalent and Mixed-Valence Niobium Complexes Supported by a Tripodal Tripyrrolylmethane Trianion","Organometallics","2000","19","22","4568","","10.1021/om000501t","","","0.71073","MoKα","","0.1389","0.0873","","","0.2237","0.2512","","","","","","1.084","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077579","12.688","0.002","12.908","0.002","12.607","0.002","90","","110.511","0.003","90","","1933.8","0.5","203","2","203","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H52 N6 Nb2 O4 -","- C42 H52 N6 Nb2 O4 -","- C84 H104 N12 Nb4 O8 -","2","0.5","","Tayebani, Maryam; Conoci, Sabrina; Feghali, Khalil; Gambarotta, Sandro; Yap, Glenn P. A.","Tri- and Tetravalent and Mixed-Valence Niobium Complexes Supported by a Tripodal Tripyrrolylmethane Trianion","Organometallics","2000","19","22","4568","","10.1021/om000501t","","","0.71073","MoKα","","0.1174","0.0609","","","0.1203","0.135","","","","","","1.02","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077580","10.562","0.002","12.247","0.003","12.799","0.003","117.166","0.003","90.288","0.004","96.559","0.004","1460.2","0.6","203","2","203","2","","","","","","","","6","P -1","-P 1","2","","","","- C58 H84 Li2 N6 Nb O8 -","- C58 H84 Li2 N6 Nb O8 -","- C58 H84 Li2 N6 Nb O8 -","1","0.5","","Tayebani, Maryam; Conoci, Sabrina; Feghali, Khalil; Gambarotta, Sandro; Yap, Glenn P. A.","Tri- and Tetravalent and Mixed-Valence Niobium Complexes Supported by a Tripodal Tripyrrolylmethane Trianion","Organometallics","2000","19","22","4568","","10.1021/om000501t","","","0.71073","MoKα","","0.1027","0.0709","","","0.1612","0.1748","","","","","","1.03","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077581","20.8592","0.0012","10.3433","0.0006","28.1509","0.0015","90","","90","","90","","6073.6","0.6","160","2","160","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C35 H23 Fe2 O6 P -","- C35 H23 Fe2 O6 P -","- C280 H184 Fe16 O48 P8 -","8","1","","Doherty, Simon; Hogarth, Graeme; Waugh, Mark; Clegg, William; Elsegood, Mark R. J.","Reactions of Alkynes with [Fe2(CO)6(μ-PPh2){μ-η1:η2α,β-(H)CαCβCγH2}]: Formation of Diphenylvinylphosphine-Functionalized Vinyl Carbenes via Carbon−Carbon and Carbon−Phosphorus Bond Formation and Hydrogen Migration⊥","Organometallics","2000","19","22","4557","","10.1021/om0005147","","","0.71073","MoKα","","0.0693","0.0415","","","0.074","0.0833","","","","","","1.046","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077582","12.5509","0.0006","15.3144","0.0008","15.9483","0.0008","109.143","0.002","99.88","0.002","104.577","0.002","2692.3","0.2","160","2","160","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H21 Fe2 O6 P -","- C30 H21 Fe2 O6 P -","- C120 H84 Fe8 O24 P4 -","4","2","","Doherty, Simon; Hogarth, Graeme; Waugh, Mark; Clegg, William; Elsegood, Mark R. J.","Reactions of Alkynes with [Fe2(CO)6(μ-PPh2){μ-η1:η2α,β-(H)CαCβCγH2}]: Formation of Diphenylvinylphosphine-Functionalized Vinyl Carbenes via Carbon−Carbon and Carbon−Phosphorus Bond Formation and Hydrogen Migration⊥","Organometallics","2000","19","22","4557","","10.1021/om0005147","","","0.71073","MoKα","","0.0405","0.0302","","","0.0721","0.0736","","","","","","0.984","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077583","15.3078","0.0019","9.56","0.0012","21.656","0.003","90","","91.133","0.003","90","","3168.6","0.7","160","2","160","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C37 H25 Fe2 O6 P -","- C37 H25 Fe2 O6 P -","- C148 H100 Fe8 O24 P4 -","4","1","","Doherty, Simon; Hogarth, Graeme; Waugh, Mark; Clegg, William; Elsegood, Mark R. J.","Reactions of Alkynes with [Fe2(CO)6(μ-PPh2){μ-η1:η2α,β-(H)CαCβCγH2}]: Formation of Diphenylvinylphosphine-Functionalized Vinyl Carbenes via Carbon−Carbon and Carbon−Phosphorus Bond Formation and Hydrogen Migration⊥","Organometallics","2000","19","22","4557","","10.1021/om0005147","","","0.689","synchrotron","","0.09","0.0526","","","0.1161","0.122","","","","","","0.89","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077584","14.1961","0.0013","16.1407","0.0015","17.4693","0.0017","90","","93.745","0.002","90","","3994.3","0.7","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H56 B10 Na2 O4 -","- C32 H56 B10 Na2 O4 -","- C128 H224 B40 Na8 O16 -","4","1","","Chui, Kwoli; Li, Hung-Wing; Xie, Zuowei","Synthesis and Structural Characterization ofcloso-exo,exo-nido, andpseudoclosoGroup 1 Carborane Compounds of the C2B10System","Organometallics","2000","19","25","5447","","10.1021/om000547m","","","0.71073","MoKα","","0.2361","0.0665","","","0.1887","0.2587","","","","","","0.795","","","","has coordinates,has disorder","178664","2020-10-21","18:00:00",""
"4077585","25.86","0.005","10.35","0.002","26.976","0.005","90","","110.3","0.03","90","","6772","3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C26 H44 B10 K2 O3 -","- C26 H44 B10 K2 O3 -","- C208 H352 B80 K16 O24 -","8","1","","Chui, Kwoli; Li, Hung-Wing; Xie, Zuowei","Synthesis and Structural Characterization ofcloso-exo,exo-nido, andpseudoclosoGroup 1 Carborane Compounds of the C2B10System","Organometallics","2000","19","25","5447","","10.1021/om000547m","","","0.71073","MoKα","","0.0902","0.0837","","","0.2253","0.2337","","","","","","1.077","","","","has coordinates,has disorder","178664","2020-10-21","18:00:00",""
"4077586","19.117","0.004","10.776","0.002","24.694","0.005","90","","95.19","0.03","90","","5066.2","1.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C40 H72 B10 K2 O12 -","- C40 H72 B10 K2 O12 -","- C160 H288 B40 K8 O48 -","4","1","","Chui, Kwoli; Li, Hung-Wing; Xie, Zuowei","Synthesis and Structural Characterization ofcloso-exo,exo-nido, andpseudoclosoGroup 1 Carborane Compounds of the C2B10System","Organometallics","2000","19","25","5447","","10.1021/om000547m","","","0.71073","MoKα","","0.1169","0.0997","","","0.2561","0.2758","","","","","","1.132","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077587","23.7934","0.0015","10.368","0.0006","18.3065","0.0011","90","","90","","90","","4516","0.5","293","2","293","2","","","","","","","","5","P m c 21","P 2c -2","26","","","","- C36 H65 B10 K O8 -","- C36 H49 B10 K O8 -","- C144 H196 B40 K4 O32 -","4","1","","Chui, Kwoli; Li, Hung-Wing; Xie, Zuowei","Synthesis and Structural Characterization ofcloso-exo,exo-nido, andpseudoclosoGroup 1 Carborane Compounds of the C2B10System","Organometallics","2000","19","25","5447","","10.1021/om000547m","","","0.71073","MoKα","","0.1759","0.0613","","","0.1425","0.1868","","","","","","0.856","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077588","21.524","0.002","11.0456","0.0011","16.746","0.0017","90","","90","","90","","3981.3","0.7","293","2","293","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C32 H55 B10 K O7 -","- C32 H53 B10 K O7 -","- C128 H212 B40 K4 O28 -","4","1","","Chui, Kwoli; Li, Hung-Wing; Xie, Zuowei","Synthesis and Structural Characterization ofcloso-exo,exo-nido, andpseudoclosoGroup 1 Carborane Compounds of the C2B10System","Organometallics","2000","19","25","5447","","10.1021/om000547m","","","0.71073","MoKα","","0.1151","0.0564","","","0.1283","0.1534","","","","","","0.84","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077589","8.866","0.003","8.874","0.003","28.597","0.005","89.08","0.02","89.35","0.02","60.67","0.02","1961.2","1.1","293","","293","","","","","","","","","5","P -1","-P 1","2","","","","- C13 H25 Cl2 N Si3 -","- C13 H25 Cl2 N Si3 -","- C52 H100 Cl8 N4 Si12 -","4","2","","van den Ancker, Tania R.; Raston, Colin L.; Skelton, Brian W.; White, Allan H.","Hypervalent Silicon via Intramolecular Coordination in a Four-Membered Ring in Complexes of Substituted Pyridyl Ligands","Organometallics","2000","19","22","4437","","10.1021/om0005497","","","0.71073","MoKα","","0.079","0.042","","0.047","","0.04","","","1.372","","","1.579","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4077590","19.155","0.007","9.868","0.001","12.412","0.012","90","","100.49","0.06","90","","2307","2","293","","293","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C19 H31 Cl N2 Si3 -","- C19 H31 Cl N2 Si3 -","- C76 H124 Cl4 N8 Si12 -","4","0.5","","van den Ancker, Tania R.; Raston, Colin L.; Skelton, Brian W.; White, Allan H.","Hypervalent Silicon via Intramolecular Coordination in a Four-Membered Ring in Complexes of Substituted Pyridyl Ligands","Organometallics","2000","19","22","4437","","10.1021/om0005497","","","0.71073","MoKα","","0.065","0.046","","0.052","","0.049","","","1.905","","","2.155","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4077591","19.131","0.007","9.883","0.003","12.444","0.008","90","","99.97","0.04","90","","2317.3","1.9","293","","293","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C20 H34 N2 Si3 -","- C20 H34 N2 Si3 -","- C80 H136 N8 Si12 -","4","0.5","","van den Ancker, Tania R.; Raston, Colin L.; Skelton, Brian W.; White, Allan H.","Hypervalent Silicon via Intramolecular Coordination in a Four-Membered Ring in Complexes of Substituted Pyridyl Ligands","Organometallics","2000","19","22","4437","","10.1021/om0005497","","","0.71073","MoKα","","0.072","0.047","","0.053","","0.05","","","1.756","","","2.052","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4077592","19.668","0.008","9.327","0.008","20.967","0.009","90","","106.42","0.03","90","","3689","4","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C39 H25 N O10 Ru3 -","- C39 H25 N O10 Ru3 -","- C156 H100 N4 O40 Ru12 -","4","1","","Cabeza, Javier A.; Grepioni, Fabrizia; Moreno, Marta; Riera, Víctor","Reactivity of Diynes with a 1-Azavinylidene-Bridged Triruthenium Carbonyl Cluster. Insertion Reactions of Diynes into Ru−H, Ru−C, and Ru−N Bonds","Organometallics","2000","19","25","5424","","10.1021/om0005506","","","0.71069","MoKα","","0.0847","0.0657","","","0.172","0.1934","","","","","","0.955","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077593","10.106","0.004","14.643","0.009","18.88","0.009","90","","90","","90","","2794","2","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C28 H17 N O9 Ru3 -","- C28 H17 N O9 Ru3 -","- C112 H68 N4 O36 Ru12 -","4","1","","Cabeza, Javier A.; Grepioni, Fabrizia; Moreno, Marta; Riera, Víctor","Reactivity of Diynes with a 1-Azavinylidene-Bridged Triruthenium Carbonyl Cluster. Insertion Reactions of Diynes into Ru−H, Ru−C, and Ru−N Bonds","Organometallics","2000","19","25","5424","","10.1021/om0005506","","","0.71069","MoKα","","0.0428","0.0367","","","0.093","0.0985","","","","","","1.369","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077594","15.759","0.009","10.818","0.006","20.824","0.009","90","","107.92","0.06","90","","3378","3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C37 H21 N O8 Ru3 -","- C37 H21 N O8 Ru3 -","- C148 H84 N4 O32 Ru12 -","4","1","","Cabeza, Javier A.; Grepioni, Fabrizia; Moreno, Marta; Riera, Víctor","Reactivity of Diynes with a 1-Azavinylidene-Bridged Triruthenium Carbonyl Cluster. Insertion Reactions of Diynes into Ru−H, Ru−C, and Ru−N Bonds","Organometallics","2000","19","25","5424","","10.1021/om0005506","","","0.71069","MoKα","","0.0763","0.0304","","","0.0754","0.0928","","","","","","0.929","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077595","12.445","0.003","13.029","0.004","13.946","0.005","76.2","0.03","72.28","0.02","87.23","0.02","2091.1","1.2","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H21 Cl0.3 N O9 Ru3 -","- C38 H21 Cl0.3 N O9 Ru3 -","- C76 H42 Cl0.6 N2 O18 Ru6 -","2","1","","Cabeza, Javier A.; Grepioni, Fabrizia; Moreno, Marta; Riera, Víctor","Reactivity of Diynes with a 1-Azavinylidene-Bridged Triruthenium Carbonyl Cluster. Insertion Reactions of Diynes into Ru−H, Ru−C, and Ru−N Bonds","Organometallics","2000","19","25","5424","","10.1021/om0005506","","","0.71069","MoKα","","0.1181","0.0538","","","0.1376","0.1672","","","","","","0.921","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077596","9.746","0.004","9.576","0.004","37.366","0.009","90","","92.98","0.02","90","","3483","2","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C36 H39 I N2 O4 P Rh -","- C37 H39 I N2 O3 P Rh -","- C148 H156 I4 N8 O12 P4 Rh4 -","4","1","","Pelagatti, Paolo; Bacchi, Alessia; Bobbio, Carla; Carcelli, Mauro; Costa, Mirco; Pelizzi, Corrado; Vivorio, Cristiano","Synthesis, Characterization, and Reactivity toward MeI of Carbonyl Rh(I) Complexes Containing a PNO Hydrazonic Ligand","Organometallics","2000","19","25","5440","","10.1021/om000562r","","","0.71069","MoKα","","0.1147","0.0491","","","0.1523","0.1893","","","","","","0.896","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077597","14.051","0.005","10.477","0.005","9.667","0.005","106.75","0.005","98.44","0.005","102.95","0.005","1293.6","1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C30.5 H23.5 N2 O2 P Rh -","- C30.5 H23.5 N2 O2 P Rh -","- C61 H47 N4 O4 P2 Rh2 -","2","1","","Pelagatti, Paolo; Bacchi, Alessia; Bobbio, Carla; Carcelli, Mauro; Costa, Mirco; Pelizzi, Corrado; Vivorio, Cristiano","Synthesis, Characterization, and Reactivity toward MeI of Carbonyl Rh(I) Complexes Containing a PNO Hydrazonic Ligand","Organometallics","2000","19","25","5440","","10.1021/om000562r","","","0.71069","MoKα","","0.1615","0.0798","","","0.2283","0.2648","","","","","","0.939","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077598","13.85","0.002","17.849","0.001","10.7815","0.0008","90","","94.392","0.007","90","","2657.5","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C23 H45 B2 P Ru2 -","- C23 H45 B2 P Ru2 -","- C92 H180 B8 P4 Ru8 -","4","1","","Pangan, Lourdes N.; Kawano, Yasuro; Shimoi, Mamoru","Syntheses and Structures of New Diruthenatetraborane Complexes Exhibiting Novel Modes of Coordination for a B2H5Fragment: Phosphine-Complexed [(Cp*Ru)2(μ-H)(∥-μ-η4-B2H5)(PR3)] (PR3= PMe3, PMe2Ph) and Phosphido-Bridgednido-[(Cp*Ru)2(μ-PMe2)(⊥-μ-η4-B2H5)]1","Organometallics","2000","19","26","5575","","10.1021/om000568g","","","0.71069","MoKα","","0.0425","0.0403","","0.0935","0.092","","","","1.025","1.027","1.027","","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077599","18.854","0.002","15.238","0.003","17.855","0.003","90","","101.265","0.014","90","","5030.9","1.4","268","","293","2","","","","","","","[{(Cp*Ru)2(mu-H)(PMe2Ph)(B2H5)]","5","C 1 2/c 1","-C 2yc","15","","(mu-hapto4-pentahydrodiboranyl)(mu-dimethylphosphido) bis(pentamethylcyclopentadienylruthenium)","","- C22 H41 B2 P Ru2 -","- C22 H41 B2 P Ru2 -","- C176 H328 B16 P8 Ru16 -","8","1","","Pangan, Lourdes N.; Kawano, Yasuro; Shimoi, Mamoru","Syntheses and Structures of New Diruthenatetraborane Complexes Exhibiting Novel Modes of Coordination for a B2H5Fragment: Phosphine-Complexed [(Cp*Ru)2(μ-H)(∥-μ-η4-B2H5)(PR3)] (PR3= PMe3, PMe2Ph) and Phosphido-Bridgednido-[(Cp*Ru)2(μ-PMe2)(⊥-μ-η4-B2H5)]1","Organometallics","2000","19","26","5575","","10.1021/om000568g","","","0.71069","MoKα","","0.0531","0.0518","","0.1666","0.1628","","","","0.237","0.233","0.233","","","","","has coordinates","178664","2020-10-21","18:00:00",""
"4077600","21.415","0.005","11.9136","0.0018","17.77","0.003","90","","90","","90","","4533.7","1.5","298","2","298","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C41 H64 N6 O Si2 Ti -","- C41 H56 N6 O Si2 Ti -","- C164 H224 N24 O4 Si8 Ti4 -","4","1","","Bashall, Allan; Collier, Philip E.; Gade, Lutz H.; McPartlin, Mary; Mountford, Philip; Pugh, Stephen M.; Radojevic, Sanja; Schubart, Martin; Scowen, Ian J.; Trösch, Dominique J. M.","C−C and C−N Coupling Reactions of an Imidotitanium Complex with Isocyanides","Organometallics","2000","19","23","4784","","10.1021/om0005710","","","0.71073","MoKα","","0.1681","0.0744","","","0.1486","0.1843","","","","","","0.97","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077601","10.0312","0.0018","11.4608","0.0014","15.465","0.002","94.333","0.008","108.378","0.013","111.976","0.011","1526.4","0.4","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H47 N7 Si2 Ti -","- C25 H47 N7 Si2 Ti -","- C50 H94 N14 Si4 Ti2 -","2","1","","Bashall, Allan; Collier, Philip E.; Gade, Lutz H.; McPartlin, Mary; Mountford, Philip; Pugh, Stephen M.; Radojevic, Sanja; Schubart, Martin; Scowen, Ian J.; Trösch, Dominique J. M.","C−C and C−N Coupling Reactions of an Imidotitanium Complex with Isocyanides","Organometallics","2000","19","23","4784","","10.1021/om0005710","","","0.71073","MoKα","","0.0723","0.0436","","","0.0921","0.1083","","","","","","1.033","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077602","20.955","0.003","12.4835","0.0019","39.685","0.005","90","","102.34","0.01","90","","10141","3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C51 H69 N7 Si2 Ti -","- C51 H69 N7 Si2 Ti -","- C408 H552 N56 Si16 Ti8 -","8","1","","Bashall, Allan; Collier, Philip E.; Gade, Lutz H.; McPartlin, Mary; Mountford, Philip; Pugh, Stephen M.; Radojevic, Sanja; Schubart, Martin; Scowen, Ian J.; Trösch, Dominique J. M.","C−C and C−N Coupling Reactions of an Imidotitanium Complex with Isocyanides","Organometallics","2000","19","23","4784","","10.1021/om0005710","","","0.71073","MoKα","","0.1484","0.0714","","","0.1461","0.1709","","","","","","0.972","","","","has coordinates,has disorder","178665","2020-10-21","18:00:00",""
"4077603","12.684","0.002","13.8756","0.0019","17.077","0.002","74.318","0.009","70.409","0.013","65.003","0.015","2537","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C52 H71 N7 Si2 Ti -","- C52 H71 N7 Si2 Ti -","- C104 H142 N14 Si4 Ti2 -","2","1","","Bashall, Allan; Collier, Philip E.; Gade, Lutz H.; McPartlin, Mary; Mountford, Philip; Pugh, Stephen M.; Radojevic, Sanja; Schubart, Martin; Scowen, Ian J.; Trösch, Dominique J. M.","C−C and C−N Coupling Reactions of an Imidotitanium Complex with Isocyanides","Organometallics","2000","19","23","4784","","10.1021/om0005710","","","0.71073","MoKα","","0.1179","0.0691","","","0.1651","0.1829","","","","","","1.047","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077604","20.865","0.005","12.6101","0.0013","39.31","0.007","90","","102.547","0.011","90","","10096","3","299","2","299","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C50 H73 N7 Si2 Ti -","- C50 H73 N7 Si2 Ti -","- C400 H584 N56 Si16 Ti8 -","8","1","","Bashall, Allan; Collier, Philip E.; Gade, Lutz H.; McPartlin, Mary; Mountford, Philip; Pugh, Stephen M.; Radojevic, Sanja; Schubart, Martin; Scowen, Ian J.; Trösch, Dominique J. M.","C−C and C−N Coupling Reactions of an Imidotitanium Complex with Isocyanides","Organometallics","2000","19","23","4784","","10.1021/om0005710","","","0.71073","MoKα","","0.1142","0.0529","","","0.1077","0.1329","","","","","","0.953","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077605","9.119","0.001","9.919","0.001","13.029","0.002","95.601","0.002","98.379","0.002","101.148","0.002","1134.3","0.2","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C21 H9 Al2 F15 -","- C21 H9 Al2 F15 -","- C42 H18 Al4 F30 -","2","1","","Klosin, Jerzy; Roof, Gordon R.; Chen, Eugene Y.-X.; Abboud, Khalil A.","Ligand Exchange and Alkyl Abstraction Involving (Perfluoroaryl)boranes and -alanes with Aluminum and Gallium Alkyls","Organometallics","2000","19","23","4684","","10.1021/om000573k","","","0.71073","MoKα","","0.0627","0.0356","","","0.0704","0.0733","","","","","","1.038","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077606","25.908","0.001","15.6457","0.0009","26.146","0.001","90","","115.234","0.001","90","","9586.9","0.8","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C47 H29 Al B F27 O2 -","- C47 H29 Al B F27 O2 -","- C376 H232 Al8 B8 F216 O16 -","8","2","","Klosin, Jerzy; Roof, Gordon R.; Chen, Eugene Y.-X.; Abboud, Khalil A.","Ligand Exchange and Alkyl Abstraction Involving (Perfluoroaryl)boranes and -alanes with Aluminum and Gallium Alkyls","Organometallics","2000","19","23","4684","","10.1021/om000573k","","","0.71073","MoKα","","0.1657","0.0553","","","0.096","0.1165","","","","","","0.887","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077607","9.7495","0.0006","10.9672","0.0007","14.6076","0.0009","85.155","0.001","87.556","0.001","72.055","0.001","1480.39","0.16","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C27 H25 B F15 Ga N2 -","- C27 H25 B F15 Ga N2 -","- C54 H50 B2 F30 Ga2 N4 -","2","1","","Klosin, Jerzy; Roof, Gordon R.; Chen, Eugene Y.-X.; Abboud, Khalil A.","Ligand Exchange and Alkyl Abstraction Involving (Perfluoroaryl)boranes and -alanes with Aluminum and Gallium Alkyls","Organometallics","2000","19","23","4684","","10.1021/om000573k","","","0.71073","MoKα","","0.052","0.0394","","","0.104","0.1095","","","","","","1.039","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077608","20.8365","0.0002","15.0577","0.0002","24.9047","0.0003","90","","93.693","0.001","90","","7797.62","0.16","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C50.9 H60.3 I2 N3 O24.81 Rh15 -","- C52.37 H59.22 I2 N3 O24.79 Rh15 -","- C209.48 H236.88 I8 N12 O99.16 Rh60 -","4","1","","Fumagalli, Alessandro; Martinengo, Secondo; Bernasconi, Giovanni; Noziglia, Luciana; Albano, Vincenzo G.; Monari, Magda; Castellari, Carlo","Skeletal Growth by Condensation of Small Metal Fragments on a Carbido Carbonyl Cluster. Synthesis of the Anions [Rh15C2(CO)24X2]3-(X = Cl, Br, I) and Molecular Structure of the Bromo and Iodo Derivatives","Organometallics","2000","19","24","5149","","10.1021/om000577p","","","0.71073","MoKα","","0.0424","0.0269","","0.0694","0.0648","","","","0.988","1.08","1.08","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4077609","21.696","0.004","18.109","0.003","19.249","0.003","90","","90","","90","","7563","2","203","2","203","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C52 H127 Al4 Li3 N12 -","- C51.998 H117 Al4 Li3 N12 -","- C207.992 H468 Al16 Li12 N48 -","4","1","","Brask, Justin K.; Chivers, Tristram; Schatte, Gabriele; Yap, Glenn P. A.","Entrapment oftert-Butyllithium and Lithiumtert-Butylamide Monomers by Partially Lithiated Derivatives of Aluminum and Gallium Primary Amide Complexes","Organometallics","2000","19","26","5683","","10.1021/om000603j","","","0.71073","MoKα","","0.1549","0.108","","","0.2831","0.322","","","","","","1.119","","","","has coordinates,has disorder","178665","2020-10-21","18:00:00",""
"4077610","18.9693","0.0017","10.8903","0.001","18.7885","0.0017","90","","90","","90","","3881.4","0.6","193","2","193","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C28 H68 Ga2 Li3 N7 -","- C28 H68 Ga2 Li3 N7 -","- C112 H272 Ga8 Li12 N28 -","4","1","","Brask, Justin K.; Chivers, Tristram; Schatte, Gabriele; Yap, Glenn P. A.","Entrapment oftert-Butyllithium and Lithiumtert-Butylamide Monomers by Partially Lithiated Derivatives of Aluminum and Gallium Primary Amide Complexes","Organometallics","2000","19","26","5683","","10.1021/om000603j","","","0.71073","MoKα","","0.0563","0.0349","","","0.0766","0.0858","","","","","","1.013","","","","has coordinates,has disorder","178665","2020-10-21","18:00:00",""
"4077611","18.929","0.007","10.966","0.004","18.59","0.007","90","","90","","90","","3859","2","203","2","203","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C28 H68 Al2 Li3 N7 -","- C28 H63 Al2 Li3 N7 -","- C112 H252 Al8 Li12 N28 -","4","1","","Brask, Justin K.; Chivers, Tristram; Schatte, Gabriele; Yap, Glenn P. A.","Entrapment oftert-Butyllithium and Lithiumtert-Butylamide Monomers by Partially Lithiated Derivatives of Aluminum and Gallium Primary Amide Complexes","Organometallics","2000","19","26","5683","","10.1021/om000603j","","","0.71073","MoKα","","0.0828","0.0688","","","0.1854","0.1907","","","","","","1.026","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077612","19.974","0.005","9.9","0.001","22.472","0.005","90","","122.375","0.009","90","","3753","1.4","183","2","183","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","di(bis(TMS)benzyl)calcium.THF2","","- C17 H31 Ca0.5 O Si2 -","- C17 H31 Ca0.5 O Si2 -","- C136 H248 Ca4 O8 Si16 -","8","1","","Feil, Florian; Harder, Sjoerd","α,α-Bis(trimethylsilyl)-Substituted Benzyl Complexes of Potassium and Calcium","Organometallics","2000","19","24","5010","","10.1021/om0006209","","","0.71073","MoKα","","0.0803","0.0421","","","0.1003","0.1136","","","","","","1.004","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077613","6.5946","0.0006","13.388","0.001","17.544","0.002","90","","90","","90","","1548.9","0.3","183","2","183","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","(bis(TMS)benzyl)potassium","","","- C13 H23 K Si2 -","- C13 H23 K Si2 -","- C52 H92 K4 Si8 -","4","1","","Feil, Florian; Harder, Sjoerd","α,α-Bis(trimethylsilyl)-Substituted Benzyl Complexes of Potassium and Calcium","Organometallics","2000","19","24","5010","","10.1021/om0006209","","","0.71073","MoKα","","0.0566","0.0337","","","0.0696","0.0758","","","","","","1.056","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077614","11.9276","0.0004","13.9813","0.0005","18.2051","0.0005","90","","97.57","0.0019","90","","3009.48","0.17","200","2","200","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H54 Cu P3 S Si -","- C21 H54 Cu P3 S Si -","- C84 H216 Cu4 P12 S4 Si4 -","4","1","","Tran, Diem T. T.; Corrigan, John F.","Synthesis and Characterization of Tris(trialkylphosphine)copper(I)trimethylsilylchalcogenolates","Organometallics","2000","19","24","5202","","10.1021/om000624d","","","0.71073","MoKα","","0.0358","0.0267","","","0.0691","0.0716","","","","","","1.062","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077615","16.7522","0.0007","11.6163","0.0003","17.4349","0.0007","90","","117.278","0.0014","90","","3015.5","0.2","200","2","200","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H59.25 Cu P3 Se Si -","- C21 H59.25 Cu P3 Se Si -","- C84 H237 Cu4 P12 Se4 Si4 -","4","1","","Tran, Diem T. T.; Corrigan, John F.","Synthesis and Characterization of Tris(trialkylphosphine)copper(I)trimethylsilylchalcogenolates","Organometallics","2000","19","24","5202","","10.1021/om000624d","","","0.71073","MoKα","","0.0921","0.0393","","","0.0786","0.0886","","","","","","0.943","","","","has coordinates,has disorder","178665","2020-10-21","18:00:00",""
"4077616","16.5294","0.0003","12.0854","0.0002","16.9309","0.0003","90","","115.671","0.001","90","","3048.36","0.1","200","2","200","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H54 Cu P3 Si Te -","- C21 H54 Cu P3 Si Te -","- C84 H216 Cu4 P12 Si4 Te4 -","4","1","","Tran, Diem T. T.; Corrigan, John F.","Synthesis and Characterization of Tris(trialkylphosphine)copper(I)trimethylsilylchalcogenolates","Organometallics","2000","19","24","5202","","10.1021/om000624d","","","0.71073","MoKα","","0.0384","0.0334","","","0.083","0.0865","","","","","","1.056","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077617","10.901","0.0002","11.1233","0.0002","17.3734","0.0002","92.889","0.0011","97.316","0.0011","105.114","0.0007","2009.48","0.06","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H72 Cu P3 S Si -","- C30 H72 Cu P3 S Si -","- C60 H144 Cu2 P6 S2 Si2 -","2","1","","Tran, Diem T. T.; Corrigan, John F.","Synthesis and Characterization of Tris(trialkylphosphine)copper(I)trimethylsilylchalcogenolates","Organometallics","2000","19","24","5202","","10.1021/om000624d","","","0.71073","MoKα","","0.0412","0.0357","","","0.0851","0.0886","","","","","","1.058","","","","has coordinates,has disorder","178665","2020-10-21","18:00:00",""
"4077618","10.8887","0.0004","11.1231","0.0005","17.3991","0.0004","94.015","0.002","97.069","0.002","103.93","0.003","2018.9","0.13","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H72 Cu P3 Se Si -","- C30 H72 Cu P3 Se Si -","- C60 H144 Cu2 P6 Se2 Si2 -","2","1","","Tran, Diem T. T.; Corrigan, John F.","Synthesis and Characterization of Tris(trialkylphosphine)copper(I)trimethylsilylchalcogenolates","Organometallics","2000","19","24","5202","","10.1021/om000624d","","","0.71073","MoKα","","0.0576","0.0406","","","0.0993","0.1096","","","","","","1.023","","","","has coordinates,has disorder","178665","2020-10-21","18:00:00",""
"4077619","10.912","0.0002","11.136","0.0002","17.54","0.0002","95.014","0.0011","97.08","0.0011","102.223","0.0011","2052.99","0.06","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H72 Cu P3 Si Te -","- C30 H72 Cu P3 Si Te -","- C60 H144 Cu2 P6 Si2 Te2 -","2","1","","Tran, Diem T. T.; Corrigan, John F.","Synthesis and Characterization of Tris(trialkylphosphine)copper(I)trimethylsilylchalcogenolates","Organometallics","2000","19","24","5202","","10.1021/om000624d","","","0.71073","MoKα","","0.0401","0.0342","","","0.0857","0.0899","","","","","","1.069","","","","has coordinates,has disorder","178665","2020-10-21","18:00:00",""
"4077620","15.645","0.003","16.76","0.004","19.187","0.006","111.34","0.03","103.23","0.03","96.79","0.03","4448","2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C88 H92 Li3 O13 Y -","- C88 H92 Li3 O13 Y -","- C176 H184 Li6 O26 Y2 -","2","1","","Aspinall, Helen C.; Bickley, Jamie F.; Dwyer, Jennifer L. M.; Greeves, Nicholas; Kelly, Richard V.; Steiner, Alexander","Pinwheel-Shaped Heterobimetallic Lanthanide Alkali Metal Binaphtholates: Ionic Size Matters!","Organometallics","2000","19","25","5416","","10.1021/om0006256","","","0.71073","MoKα","","0.3393","0.0837","","","0.1385","0.204","","","","","","0.557","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077621","15.1989","0.0016","15.1989","0.0016","55.338","0.009","90","","90","","120","","11071","2","213","2","213","2","","","","","","","","5","R 3 c :H","R 3 -2""c","161","","","","- C84 H84 Na3 O12 Y -","- C84 H84 Na3 O12 Y -","- C504 H504 Na18 O72 Y6 -","6","0.333333","","Aspinall, Helen C.; Bickley, Jamie F.; Dwyer, Jennifer L. M.; Greeves, Nicholas; Kelly, Richard V.; Steiner, Alexander","Pinwheel-Shaped Heterobimetallic Lanthanide Alkali Metal Binaphtholates: Ionic Size Matters!","Organometallics","2000","19","25","5416","","10.1021/om0006256","","","0.71073","MoKα","","0.112","0.0596","","","0.1101","0.1227","","","","","","0.841","","","","has coordinates,has disorder","178665","2020-10-21","18:00:00",""
"4077622","14.9654","0.0016","37.174","0.003","15.152","0.0015","90","","118.496","0.012","90","","7408.2","1.5","213","2","213","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C76 H75.5 Eu Li3 O10.5 -","- C76 H75.5 Eu Li3 O10.5 -","- C304 H302 Eu4 Li12 O42 -","4","2","","Aspinall, Helen C.; Bickley, Jamie F.; Dwyer, Jennifer L. M.; Greeves, Nicholas; Kelly, Richard V.; Steiner, Alexander","Pinwheel-Shaped Heterobimetallic Lanthanide Alkali Metal Binaphtholates: Ionic Size Matters!","Organometallics","2000","19","25","5416","","10.1021/om0006256","","","0.71073","MoKα","","0.1008","0.0648","","","0.1544","0.1685","","","","","","0.826","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077623","15.1157","0.001","15.1157","0.001","59.098","0.007","90","","90","","120","","11693.9","1.8","213","2","213","2","","","","","","","","5","P 65 2 2","P 65 2 (0 0 1)","179","","","","- C88 H94 Li3 O13 Yb -","- C88 H94 Li3 O13 Yb -","- C528 H564 Li18 O78 Yb6 -","6","0.5","","Aspinall, Helen C.; Bickley, Jamie F.; Dwyer, Jennifer L. M.; Greeves, Nicholas; Kelly, Richard V.; Steiner, Alexander","Pinwheel-Shaped Heterobimetallic Lanthanide Alkali Metal Binaphtholates: Ionic Size Matters!","Organometallics","2000","19","25","5416","","10.1021/om0006256","","","0.71073","MoKα","","0.1156","0.0987","","","0.1993","0.2214","","","","","","1.097","","","","has coordinates,has disorder","178665","2020-10-21","18:00:00",""
"4077624","15.1044","0.0017","15.1044","0.0017","18.419","0.002","90","","90","","120","","3639.2","0.7","213","2","213","2","","","","","","","","5","P 63","P 6c","173","","","","- C84 H84 Na3 O12 Yb -","- C84 H84 Na3 O12 Yb -","- C168 H168 Na6 O24 Yb2 -","2","0.333333","","Aspinall, Helen C.; Bickley, Jamie F.; Dwyer, Jennifer L. M.; Greeves, Nicholas; Kelly, Richard V.; Steiner, Alexander","Pinwheel-Shaped Heterobimetallic Lanthanide Alkali Metal Binaphtholates: Ionic Size Matters!","Organometallics","2000","19","25","5416","","10.1021/om0006256","","","0.71073","MoKα","","0.031","0.0269","","","0.0632","0.0645","","","","","","1.097","","","","has coordinates,has disorder","178665","2020-10-21","18:00:00",""
"4077625","15.2581","0.0017","15.2581","0.0017","18.207","0.002","90","","90","","120","","3670.9","0.7","213","2","213","2","","","","","","","","5","P 63","P 6c","173","","","","- C84 H84 La Na3 O13 -","- C84 H84 La Na3 O13 -","- C168 H168 La2 Na6 O26 -","2","0.333333","","Aspinall, Helen C.; Bickley, Jamie F.; Dwyer, Jennifer L. M.; Greeves, Nicholas; Kelly, Richard V.; Steiner, Alexander","Pinwheel-Shaped Heterobimetallic Lanthanide Alkali Metal Binaphtholates: Ionic Size Matters!","Organometallics","2000","19","25","5416","","10.1021/om0006256","","","0.71073","MoKα","","0.0341","0.025","","","0.0528","0.0545","","","","","","0.933","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077626","11.873","0.004","12.229","0.009","20.913","0.003","90","","93.68","0.02","90","","3030","2","293","","293","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C18 H25 N2 O8.5 S7 W -","- C18 H24 N2 O9 S7 W -","- C72 H96 N8 O36 S28 W4 -","4","2","","Lim, Patrick J.; Cook, Vernon C.; Doonan, Christian J.; Young, Charles G.; Tiekink, Edward R. T.","Transformations Leading to the Generation of Dithiolene Ligands Initiated by Reactions of Sulfur-Rich WS(S2)(S2CNR2)2Complexes with Dimethyl Acetylenedicarboxylate and Phenylacetylene","Organometallics","2000","19","26","5643","","10.1021/om0006561","","","0.7107","MoKalpha","","","0.0421","","","0.0559","","","","","1.919","1.919","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077627","9.278","0.003","13.794","0.004","14.174","0.002","71.82","0.03","76.68","0.02","78.16","0.03","1659.6","0.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C23 H38 N2 O8 S6 W -","- C23 H18 N2 O8 S6 W -","- C46 H36 N4 O16 S12 W2 -","2","1","","Lim, Patrick J.; Cook, Vernon C.; Doonan, Christian J.; Young, Charles G.; Tiekink, Edward R. T.","Transformations Leading to the Generation of Dithiolene Ligands Initiated by Reactions of Sulfur-Rich WS(S2)(S2CNR2)2Complexes with Dimethyl Acetylenedicarboxylate and Phenylacetylene","Organometallics","2000","19","26","5643","","10.1021/om0006561","","","0.71069","MoKα","","0.0362","0.0308","","","0.0769","0.0797","","","","","","1.076","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077628","10.3801","0.0006","16.7455","0.0014","19.4553","0.0015","90","","95.94","0.006","90","","3363.6","0.4","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","{(C5Me5)Ru}2Co(CO)3(PMe2Ph)B3H4","","- C31 H45 B3 Co O3 P Ru2 -","- C31 H45 B3 Co O3 P Ru2 -","- C124 H180 B12 Co4 O12 P4 Ru8 -","4","1","","Lei, Xinjian; Shang, Maoyu; Fehlner, Thomas P.","Reaction of Phosphines and Pyridine with a Heterometal Metallaborane. Ligand Substitution on Boron vs Metal Sites, Borane Displacement, and Orthometalation of a Boron-Coordinated Pyridine","Organometallics","2000","19","25","5266","","10.1021/om000667u","","","0.71073","MoKα","","0.0527","0.0415","","0.12","0.1095","","","","1.003","1.017","1.017","","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077629","17.0349","0.0015","15.777","0.0013","22.1476","0.0016","90","","90","","90","","5952.4","0.8","293","2","293","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","{Cp*Ru(CO)}{Cp*Ru}{Co(CO)2(mu-CO)(NC4H4C)(BH)2","","- C29 H36 B2 Co N O4 Ru2 -","- C29 H36 B2 Co N O4 Ru2 -","- C232 H288 B16 Co8 N8 O32 Ru16 -","8","1","","Lei, Xinjian; Shang, Maoyu; Fehlner, Thomas P.","Reaction of Phosphines and Pyridine with a Heterometal Metallaborane. Ligand Substitution on Boron vs Metal Sites, Borane Displacement, and Orthometalation of a Boron-Coordinated Pyridine","Organometallics","2000","19","25","5266","","10.1021/om000667u","","","0.71073","MoKα","","0.0563","0.0368","","","0.0847","0.0936","","","","","","1.047","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077630","8.788","0.0014","9.276","0.002","20.171","0.003","97.418","0.019","97.89","0.02","111.35","0.015","1488.1","0.5","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","{Cp*Ru}2{Co(CO)3(mu-CO)(BNC5H5)}(BH)2","","- C29 H37 B3 Co N O4 Ru2 -","- C29 H37 B3 Co N O4 Ru2 -","- C58 H74 B6 Co2 N2 O8 Ru4 -","2","1","","Lei, Xinjian; Shang, Maoyu; Fehlner, Thomas P.","Reaction of Phosphines and Pyridine with a Heterometal Metallaborane. Ligand Substitution on Boron vs Metal Sites, Borane Displacement, and Orthometalation of a Boron-Coordinated Pyridine","Organometallics","2000","19","25","5266","","10.1021/om000667u","","","0.71073","MoKα","","0.0466","0.0399","","","0.1021","0.1078","","","","","","1.05","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077631","9.4626","0.0001","28.851","0.0002","13.96","0.0002","90","","104.177","0.001","90","","3695.08","0.07","180","1","180","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C42 H35 P Te3 -","- C42 H35 P Te3 -","- C168 H140 P4 Te12 -","4","1","","Witthaut, Daniel; Kirschbaum, Kristin; Conrad, Olaf; Giolando, Dean M.","Isolation of a Catenated Organotelluride Anion in the Sodium Borohydride Reduction of Diphenylditelluride","Organometallics","2000","19","24","5238","","10.1021/om000669e","","","0.71073","MoKα","","0.0406","0.0314","","0.0758","0.0723","","","","1.044","1.083","1.083","","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077632","9.4734","0.0001","28.8035","0.0002","14.1073","0.0001","90","","104.285","0.001","90","","3730.4","0.06","180","1","180","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C42 H35 As Te3 -","- C42 H35 As Te3 -","- C168 H140 As4 Te12 -","4","1","","Witthaut, Daniel; Kirschbaum, Kristin; Conrad, Olaf; Giolando, Dean M.","Isolation of a Catenated Organotelluride Anion in the Sodium Borohydride Reduction of Diphenylditelluride","Organometallics","2000","19","24","5238","","10.1021/om000669e","","","0.71073","MoKα","","0.0387","0.027","","0.0604","0.0562","","","","1.03","1.062","1.062","","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077633","13.816","0.006","14.931","0.004","10.731","0.005","93.54","0.03","99.38","0.04","78.16","0.03","2136.7","1.5","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C40 H31 Cl2 Fe4 Ga2 N3 O8 -","- C40 H31 Cl2 Fe4 Ga2 N3 O8 -","- C80 H62 Cl4 Fe8 Ga4 N6 O16 -","2","1","","Ueno, Keiji; Watanabe, Takahito; Ogino, Hiroshi","Synthesis of Cationic Diiron Complexes Bridged by a Base-Stabilized Gallium Atom [Fp2(μ-Ga·Do2)]+X-(Fp = (η-C5H5)Fe(CO)2, Do2= 2,2‘-Bipyridine,N,N,N‘,N‘-Tetramethylethylenediamine, 1,10-Phenanthroline, (4-(Dimethylamino)pyridine)2, X-= [Fp2GaCl2]-, BPh4-)","Organometallics","2000","19","26","5679","","10.1021/om000673q","","","0.71073","MoKα","","0.133","0.0506","","","0.1098","0.1349","","","","","","1.011","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077634","13.1387","0.0009","14.902","0.001","13.857","0.0009","90","","97.431","0.001","90","","2690.3","0.3","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C44 H50 Cl2 N8 O12 Re4 Sn -","- C44 H50 Cl2 N8 O12 Re4 Sn -","- C88 H100 Cl4 N16 O24 Re8 Sn2 -","2","0.5","","Zhang, Cungen; Guzei, Ilia A.; Espenson, James H.","Acidic C−H Activation of Methyltrioxorhenium(VII): Isolation and Characterization of Two Compounds Having the Novel Group C5H5N−CH2−ReO2Coordinated to Tin(IV)","Organometallics","2000","19","25","5257","","10.1021/om000683r","","","0.71073","MoKα","","0.0268","0.022","","","0.0463","0.0475","","","","","","1.043","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077635","16.0805","0.0007","9.5146","0.0004","24.184","0.0011","90","","108.163","0.001","90","","3515.8","0.3","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C54 H60 Cl8 N8 O12 Re4 Sn -","- C52 H58 Cl2 N8 O4 Re2 Sn -","- C104 H116 Cl4 N16 O8 Re4 Sn2 -","2","0.5","","Zhang, Cungen; Guzei, Ilia A.; Espenson, James H.","Acidic C−H Activation of Methyltrioxorhenium(VII): Isolation and Characterization of Two Compounds Having the Novel Group C5H5N−CH2−ReO2Coordinated to Tin(IV)","Organometallics","2000","19","25","5257","","10.1021/om000683r","","","0.71073","MoKα","","0.0893","0.0697","","","0.1733","0.1811","","","","","","1.055","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077636","12.3391","0.001","15.5925","0.0013","16.5319","0.0014","90","","101.176","0.002","90","","3120.4","0.4","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C40 H34 Li2 O -","- C40 H34 Li2 O -","- C160 H136 Li8 O4 -","4","0.5","","Rabe, Gerd W.; Sommer, Roger D.; Rheingold, Arnold L.","Synthesis and X-ray Crystal Structure Determination of Tetrahydrofuran Adducts of Two Terphenyllithium Compounds†","Organometallics","2000","19","25","5537","","10.1021/om0006864","","","0.71073","MoKα","","0.0718","0.0552","","","0.1324","0.1477","","","","","","1.078","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077637","7.7747","0.0007","20.33","0.002","16.8532","0.0017","90","","97.085","0.002","90","","2643.5","0.4","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C34 H33 Li O2 -","- C34 H33 Li O2 -","- C136 H132 Li4 O8 -","4","1","","Rabe, Gerd W.; Sommer, Roger D.; Rheingold, Arnold L.","Synthesis and X-ray Crystal Structure Determination of Tetrahydrofuran Adducts of Two Terphenyllithium Compounds†","Organometallics","2000","19","25","5537","","10.1021/om0006864","","","0.71073","MoKα","","0.1213","0.0953","","","0.2114","0.2307","","","","","","1.151","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077638","9.5566","0.0002","13.7631","0.0003","20.917","0.0005","90","","101.106","0.002","90","","2699.66","0.11","173","","173","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C27 H20 Cl2 Cr N O7 Re -","- C27 H20 Cl2 Cr N O7 Re -","- C108 H80 Cl8 Cr4 N4 O28 Re4 -","4","1","","Djukic, Jean-Pierre; Maisse-François, Aline; Pfeffer, Michel; Dötz, Karl Heinz; De Cian, André; Fischer, Jean","Organometallic Helices: The Mechanism of Formation of “Metallospiralenes”","Organometallics","2000","19","25","5484","","10.1021/om0006920","","","0.71073","Mo-Kα","","0.042","0.035","","0.058","","0.051","","","1.127","","","1.015","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077639","10.1444","0.0003","14.3587","0.0003","16.4887","0.0006","90","","92.744","0.009","90","","2399","0.12","294","","294","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H22 Cr Mn N O7 -","- C24 H22 Cr Mn N O7 -","- C96 H88 Cr4 Mn4 N4 O28 -","4","1","","Djukic, Jean-Pierre; Maisse-François, Aline; Pfeffer, Michel; Dötz, Karl Heinz; De Cian, André; Fischer, Jean","Organometallic Helices: The Mechanism of Formation of “Metallospiralenes”","Organometallics","2000","19","25","5484","","10.1021/om0006920","","","0.71073","Mo-Kα","","0.049","0.034","","0.05","","0.049","","","1.005","","","1.02","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077640","9.189","0.0002","12.903","0.0004","13.061","0.0004","62.701","0.007","76.915","0.007","76.943","0.007","1326.98","0.11","173","","173","","","","","","","","","7","P -1","-P 1","2","","","","- C49 H48 Cl2 Cr2 Mn2 N2 O15 -","- C49 H44 Cl2 Cr2 Mn2 N2 O15 -","- C49 H44 Cl2 Cr2 Mn2 N2 O15 -","1","0.5","","Djukic, Jean-Pierre; Maisse-François, Aline; Pfeffer, Michel; Dötz, Karl Heinz; De Cian, André; Fischer, Jean","Organometallic Helices: The Mechanism of Formation of “Metallospiralenes”","Organometallics","2000","19","25","5484","","10.1021/om0006920","","","0.71073","Mo-Kα","","0.074","0.047","","0.076","","0.075","","","1.556","","","1.525","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077641","10.4149","0.0003","16.1127","0.0003","16.8256","0.0005","90","","90","","90","","2823.54","0.13","173","","173","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C28 H32 Cr Mn N O7 -","- C28 H32 Cr Mn N O7 -","- C112 H128 Cr4 Mn4 N4 O28 -","4","1","","Djukic, Jean-Pierre; Maisse-François, Aline; Pfeffer, Michel; Dötz, Karl Heinz; De Cian, André; Fischer, Jean","Organometallic Helices: The Mechanism of Formation of “Metallospiralenes”","Organometallics","2000","19","25","5484","","10.1021/om0006920","","","0.71073","Mo-Kα","","0.054","0.034","","0.045","","0.041","","","1.027","","","0.924","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4077642","20.233","0.0007","16.576","0.0003","16.912","0.0005","90","","114.618","0.004","90","","5156.4","0.3","294","","294","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H22 Cr Mn N O8 -","- C26 H22 Cr Mn N O8 -","- C208 H176 Cr8 Mn8 N8 O64 -","8","2","","Djukic, Jean-Pierre; Maisse-François, Aline; Pfeffer, Michel; Dötz, Karl Heinz; De Cian, André; Fischer, Jean","Organometallic Helices: The Mechanism of Formation of “Metallospiralenes”","Organometallics","2000","19","25","5484","","10.1021/om0006920","","","0.71073","Mo-Kα","","0.094","0.04","","0.092","","0.059","","","1.705","","","1.108","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077643","15.392","0.0007","10.891","0.0005","14.872","0.0005","90","","91.03","0.002","90","","2492.65","0.18","173","","173","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H22 Cr Mn N O8 -","- C26 H22 Cr Mn N O8 -","- C104 H88 Cr4 Mn4 N4 O32 -","4","1","","Djukic, Jean-Pierre; Maisse-François, Aline; Pfeffer, Michel; Dötz, Karl Heinz; De Cian, André; Fischer, Jean","Organometallic Helices: The Mechanism of Formation of “Metallospiralenes”","Organometallics","2000","19","25","5484","","10.1021/om0006920","","","0.71073","Mo-Kα","","0.063","0.044","","0.09","","0.083","","","1.604","","","1.509","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077644","15.594","0.004","16.407","0.004","21.718","0.005","90","","96.97","0.006","90","","5516","2","203","2","203","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C112 H160 Cl2 Li6 N10 O8 Sm2 -","- C112 H160 Cl2 Li6 N10 O8 Sm2 -","- C224 H320 Cl4 Li12 N20 O16 Sm4 -","2","0.5","","Guan, Jingwen; Dubé, Tiffany; Gambarotta, Sandro; Yap, Glenn P. A.","Dinitrogen Labile Coordination versus Four-Electron Reduction, THF Cleavage, and Fragmentation Promoted by a (calix-tetrapyrrole)Sm(II) Complex","Organometallics","2000","19","23","4820","4827","10.1021/om000698p","","","0.71073","MoKα","","0.1581","0.0923","","","0.2264","0.2717","","","","","","1.035","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077645","20.78","0.003","18.755","0.003","12.1258","0.0017","90","","99.509","0.002","90","","4660.8","1.2","203","2","203","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C50 H67 Li3 N4 O3 Sm -","- C50 H67 Li3 N4 O3 Sm -","- C200 H268 Li12 N16 O12 Sm4 -","4","1","","Guan, Jingwen; Dubé, Tiffany; Gambarotta, Sandro; Yap, Glenn P. A.","Dinitrogen Labile Coordination versus Four-Electron Reduction, THF Cleavage, and Fragmentation Promoted by a (calix-tetrapyrrole)Sm(II) Complex","Organometallics","2000","19","23","4820","4827","10.1021/om000698p","","","0.71073","MoKα","","0.1037","0.0617","","","0.1487","0.1615","","","","","","1.077","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077646","21.744","0.004","14.088","0.002","19.271","0.003","90","","91.715","0.003","90","","5900.6","1.7","238","2","238","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C62 H91 Li3 N4 O6 Sm -","- C62 H91 Li3 N4 O6 Sm -","- C248 H364 Li12 N16 O24 Sm4 -","4","1","","Guan, Jingwen; Dubé, Tiffany; Gambarotta, Sandro; Yap, Glenn P. A.","Dinitrogen Labile Coordination versus Four-Electron Reduction, THF Cleavage, and Fragmentation Promoted by a (calix-tetrapyrrole)Sm(II) Complex","Organometallics","2000","19","23","4820","4827","10.1021/om000698p","","","0.71073","MoKα","","0.0922","0.0553","","","0.1263","0.14","","","","","","1.066","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077647","14.443","0.001","14.443","0.001","12.267","0.002","90","","90","","90","","2558.9","0.5","296","2","296","2","","","","","","","","5","P 42/n :2","-P 4bc","86","","","","- C56 H76 Li4 N4 O4 -","- C56 H76 Li4 N4 O4 -","- C112 H152 Li8 N8 O8 -","2","0.25","","Guan, Jingwen; Dubé, Tiffany; Gambarotta, Sandro; Yap, Glenn P. A.","Dinitrogen Labile Coordination versus Four-Electron Reduction, THF Cleavage, and Fragmentation Promoted by a (calix-tetrapyrrole)Sm(II) Complex","Organometallics","2000","19","23","4820","4827","10.1021/om000698p","","","0.71073","MoKα","","0.1027","0.0751","","","0.2179","0.2399","","","","","","1.057","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077648","13.286","0.002","29.145","0.004","22.784","0.003","90","","103.602","0.002","90","","8575","2","203","2","203","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C93 H112 Li3 N10 O2 Sm3 -","- C93 H112 Li3 N10 O2 Sm3 -","- C372 H448 Li12 N40 O8 Sm12 -","4","1","","Guan, Jingwen; Dubé, Tiffany; Gambarotta, Sandro; Yap, Glenn P. A.","Dinitrogen Labile Coordination versus Four-Electron Reduction, THF Cleavage, and Fragmentation Promoted by a (calix-tetrapyrrole)Sm(II) Complex","Organometallics","2000","19","23","4820","4827","10.1021/om000698p","","","0.71073","MoKα","","0.0519","0.0336","","","0.0856","0.0896","","","","","","1.006","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077649","8","0.001","6.363","0.001","10.242","0.001","90","","99.08","0.01","90","","514.83","0.12","173","2","173","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- C12 H8 N4 O2 -","- C12 H8 N4 O2 -","- C24 H16 N8 O4 -","2","0.25","","Ding, Li; Fabrizi de Biani, Fabrizia; Bolte, Michael; Zanello, Piero; Wagner, Matthias","Reactivity of Ferrocenylboranes: Rearrangements versus Electron Transfer Reactions","Organometallics","2000","19","26","5763","","10.1021/om000727w","","","0.71073","MoKα","","0.0569","0.0405","","","0.1067","0.1146","","","","","","1.032","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077650","9.017","0.001","14.06","0.002","15.639","0.002","94.09","0.01","104.65","0.01","105.13","0.01","1831.6","0.4","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C36.5 H37 B2 Cl3 Fe2 N4 O2 -","- C36.5 H37 B2 Cl3 Fe2 N4 O2 -","- C73 H74 B4 Cl6 Fe4 N8 O4 -","2","1","","Ding, Li; Fabrizi de Biani, Fabrizia; Bolte, Michael; Zanello, Piero; Wagner, Matthias","Reactivity of Ferrocenylboranes: Rearrangements versus Electron Transfer Reactions","Organometallics","2000","19","26","5763","","10.1021/om000727w","","","0.71073","MoKα","","0.1165","0.0672","","","0.1825","0.2142","","","","","","1.041","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077651","8.284","0.001","10.362","0.001","11.887","0.001","99.4","0.01","97.98","0.01","106.12","0.01","948.65","0.18","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C38 H44 B2 Fe2 N4 O4 S2 -","- C38 H44 B2 Fe2 N4 O4 S2 -","- C38 H44 B2 Fe2 N4 O4 S2 -","1","0.5","","Ding, Li; Fabrizi de Biani, Fabrizia; Bolte, Michael; Zanello, Piero; Wagner, Matthias","Reactivity of Ferrocenylboranes: Rearrangements versus Electron Transfer Reactions","Organometallics","2000","19","26","5763","","10.1021/om000727w","","","0.71073","MoKα","","0.0962","0.066","","","0.1618","0.1774","","","","","","1.09","","","","has coordinates,has disorder","178665","2020-10-21","18:00:00",""
"4077652","15.0169","0.001","10.0777","0.0007","17.0582","0.0008","90","","91.649","0.004","90","","2580.4","0.3","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tris(trimethylsilyl)bismutan-tri-ethylgallium-Addukt","","- C15 H42 Bi Ga Si3 -","- C15 H42 Bi Ga Si3 -","- C60 H168 Bi4 Ga4 Si12 -","4","1","","Kuczkowski, Andreas; Thomas, Florian; Schulz, Stephan; Nieger, Martin","Synthesis and X-ray Crystal Structures of Novel Al−Bi and Ga−Bi Compounds†","Organometallics","2000","19","26","5758","","10.1021/om0007365","","","0.71073","MoKα","","0.0604","0.0434","","","0.0984","0.1023","","","","","","0.981","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077653","8.9595","0.0004","10.2084","0.0004","14.9286","0.0004","85.081","0.002","89.859","0.002","67.948","0.002","1260.2","0.08","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","Tri-isopropylbismut-tris(tert.butyl)gallium-adduct","","- C21 H48 Bi Ga -","- C20.982 H48 Bi Ga -","- C41.964 H96 Bi2 Ga2 -","2","1","","Kuczkowski, Andreas; Thomas, Florian; Schulz, Stephan; Nieger, Martin","Synthesis and X-ray Crystal Structures of Novel Al−Bi and Ga−Bi Compounds†","Organometallics","2000","19","26","5758","","10.1021/om0007365","","","0.71073","MoKα","","0.0283","0.0246","","","0.0571","0.0581","","","","","","1.023","","","","has coordinates,has disorder","178665","2020-10-21","18:00:00",""
"4077654","14.385","0.0005","9.9173","0.0004","17.45","0.0007","90","","110.512","0.002","90","","2331.59","0.16","123","2","123","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Dimethylaluminium-bis(trimethylsilyl)bismutan-dimethylamino- pyridin-adduct","","- C15 H34 Al Bi N2 Si2 -","- C15 H34 Al Bi N2 Si2 -","- C60 H136 Al4 Bi4 N8 Si8 -","4","1","","Kuczkowski, Andreas; Thomas, Florian; Schulz, Stephan; Nieger, Martin","Synthesis and X-ray Crystal Structures of Novel Al−Bi and Ga−Bi Compounds†","Organometallics","2000","19","26","5758","","10.1021/om0007365","","","0.71073","MoKα","","0.0529","0.0413","","","0.0932","0.0966","","","","","","1.012","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077655","9.6324","0.0004","10.3942","0.0004","14.144","0.0004","77.476","0.002","76.342","0.002","69.756","0.002","1276.8","0.08","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","Diethylaluminium-bis(trimethylsilyl)bismutan-Dimethylaminopyridin-adduct","","- C17 H38 Al Bi N2 Si2 -","- C17 H38 Al Bi N2 Si2 -","- C34 H76 Al2 Bi2 N4 Si4 -","2","1","","Kuczkowski, Andreas; Thomas, Florian; Schulz, Stephan; Nieger, Martin","Synthesis and X-ray Crystal Structures of Novel Al−Bi and Ga−Bi Compounds†","Organometallics","2000","19","26","5758","","10.1021/om0007365","","","0.71073","MoKα","","0.0439","0.0404","","","0.1064","0.1079","","","","","","1.101","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077656","7.5054","0.0006","9.7217","0.0007","15.8937","0.0011","106.269","0.002","90.816","0.001","108.59","0.001","1048.31","0.13","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","","","- C25 H26 N2 Ru -","- C25 H26 N2 Ru -","- C50 H52 N4 Ru2 -","2","1","","Perera, Jayani R.; Heeg, Mary Jane; Winter, Charles H.","η5-Imidazolato Complexes of Ruthenium","Organometallics","2000","19","25","5263","","10.1021/om000810j","","","0.71073","MoKα","","0.0706","0.0454","","","0.09","0.0971","","","","","","0.941","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077657","11.643","0.004","10.994","0.003","20.086","0.006","90","","104.59","0.04","90","","2488.2","1.4","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[2-(dimethylaminomethyl)ferrocenyl]lead(II)","[2-(dimethylaminomethyl)ferrocenyl]lead(II) ?","","- C26 H32 Fe2 N2 Pb -","- C26 H32 Fe2 N2 Pb -","- C104 H128 Fe8 N8 Pb4 -","4","1","","Seidel, Naka; Jacob, Klaus; van der Zeijden, Adolphus A. H.; Menge, Heike; Merzweiler, Kurt; Wagner, Christoph","Synthesis and Characterization of a Stable Organolead(II) Compound: Bis[2-(N,N-dimethylaminomethyl)ferrocenyl]lead†","Organometallics","2000","19","7","1438","","10.1021/om990614g","","","0.71073","MoKα","","0.0313","0.0268","","","0.0657","0.0676","","","","","","1.009","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077658","19.239","0.005","10.628","0.0019","24.756","0.006","90","","103.95","0.03","90","","4913","2","193","2","193","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","[2-(dimethylaminomethyl)ferrocenyl]lead(II)","[2-(dimethylaminomethyl)ferrocenyl)]lead(II) ?","","- C26 H32 Fe2 N2 Pb -","- C26 H32 Fe2 N2 Pb -","- C208 H256 Fe16 N16 Pb8 -","8","1","","Seidel, Naka; Jacob, Klaus; van der Zeijden, Adolphus A. H.; Menge, Heike; Merzweiler, Kurt; Wagner, Christoph","Synthesis and Characterization of a Stable Organolead(II) Compound: Bis[2-(N,N-dimethylaminomethyl)ferrocenyl]lead†","Organometallics","2000","19","7","1438","","10.1021/om990614g","","","0.7103","MoKα","","0.0388","0.029","","","0.0692","0.0723","","","","","","1.073","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077659","9.006","0.001","22.009","0.002","20.763","0.002","90","","101.83","0.01","90","","4028.1","0.7","294","2","294","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C44 H50 N2 Na O2 Sm -","- C44 H50 N2 Na O2 Sm -","- C176 H200 N8 Na4 O8 Sm4 -","4","1","","Wang, Yaorong; Shen, Qi; Xue, Feng; Yu, Kaibei","Novel Anionic Lanthanocene Amide Complexes: Syntheses and X-ray Crystal Structures of [Na(THF)2(μ-η5:η5-MeC5H4)2Ln(NPh2)2]n(Ln = Sm, Er)","Organometallics","2000","19","3","357","","10.1021/om9906215","","","0.71073","MoKα","","0.0603","0.0555","","","0.1393","0.1438","","","","","","1.109","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077660","8.889","0.002","21.982","0.004","20.646","0.003","90","","101.3","0.01","90","","3956","1.3","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C44 H50 Er N2 Na O2 -","- C44 H50 Er N2 Na O2 -","- C176 H200 Er4 N8 Na4 O8 -","4","1","","Wang, Yaorong; Shen, Qi; Xue, Feng; Yu, Kaibei","Novel Anionic Lanthanocene Amide Complexes: Syntheses and X-ray Crystal Structures of [Na(THF)2(μ-η5:η5-MeC5H4)2Ln(NPh2)2]n(Ln = Sm, Er)","Organometallics","2000","19","3","357","","10.1021/om9906215","","","0.71073","MoKα","","0.0851","0.0436","","","0.0845","0.0931","","","","","","0.899","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077661","11.9551","0.0011","14.0018","0.0013","12.4844","0.0012","90","","99.183","0.008","90","","2063","0.3","200","0.2","200","0.2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","chloro-dicarbonyl-(eta$6!-p-cymene)-bis-(mu!2$-pyrazolyl-N,N')- rhodium(i)-osmium(ii)","","- C18 H20 Cl N4 O2 Os Rh -","- C18 H20 Cl N4 O2 Os Rh -","- C72 H80 Cl4 N16 O8 Os4 Rh4 -","4","1","","Carmona, Daniel; Ferrer, Joaquina; Arilla, José M.; Reyes, Josefa; Lahoz, Fernando J.; Elipe, Sergio; Modrego, F. Javier; Oro, Luis A.","Synthesis, Characterization, and Theoretical Studies on Heterobinuclear (p-cymene)Os(μ-pz)2M (M = Ir, Rh; Hpz = Pyrazole) Complexes","Organometallics","2000","19","5","798","","10.1021/om990624h","","","0.71073","MoKα","","0.0439","0.0314","","","0.0725","0.0753","","","","","","0.937","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077662","9.7378","0.0008","11.2371","0.0011","18.8008","0.0014","73.716","0.006","83.814","0.006","78.431","0.007","1931.7","0.3","200","0.2","200","0.2","","","","","","","","7","P -1","-P 1","2","","tricarbonyl-(eta$6!-p-cymene)-bis-(mu!2$-pyrazolyl-N,N')- rhodium(i)-osmium(ii) tetraphenylborate","","- C43 H40 B N4 O3 Os Rh -","- C43 H40 B N4 O3 Os Rh -","- C86 H80 B2 N8 O6 Os2 Rh2 -","2","1","","Carmona, Daniel; Ferrer, Joaquina; Arilla, José M.; Reyes, Josefa; Lahoz, Fernando J.; Elipe, Sergio; Modrego, F. Javier; Oro, Luis A.","Synthesis, Characterization, and Theoretical Studies on Heterobinuclear (p-cymene)Os(μ-pz)2M (M = Ir, Rh; Hpz = Pyrazole) Complexes","Organometallics","2000","19","5","798","","10.1021/om990624h","","","0.71073","MoKα","","0.056","0.0365","","","0.0731","0.0769","","","","","","0.9","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077663","9.5321","0.0011","12.7061","0.0015","17.966","0.0013","90","","90","","90","","2176","0.4","200","0.2","200","0.2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","iodo-dicarbonyl-(eta$6!-p-cymene)-bis-(mu!2$-pyrazolyl-N,N')- iridium(i)-osmium(ii)","","- C18 H20 I Ir N4 O2 Os -","- C18 H20 I Ir N4 O2 Os -","- C72 H80 I4 Ir4 N16 O8 Os4 -","4","1","","Carmona, Daniel; Ferrer, Joaquina; Arilla, José M.; Reyes, Josefa; Lahoz, Fernando J.; Elipe, Sergio; Modrego, F. Javier; Oro, Luis A.","Synthesis, Characterization, and Theoretical Studies on Heterobinuclear (p-cymene)Os(μ-pz)2M (M = Ir, Rh; Hpz = Pyrazole) Complexes","Organometallics","2000","19","5","798","","10.1021/om990624h","","","0.71073","MoKα","","0.0465","0.0321","","","0.0471","0.0498","","","","","","1.015","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077664","9.2213","0.0015","13.577","0.002","16.009","0.002","90","","102.544","0.012","90","","1956.4","0.5","200","0.2","200","0.2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","iodo-carbonyl-(eta$6!-p-cymene)-bis-(mu!2$-pyrazolyl-N,N')- rhodium(i)-osmium(ii)","","- C17 H20 I N4 O Os Rh -","- C17 H20 I N4 O Os Rh -","- C68 H80 I4 N16 O4 Os4 Rh4 -","4","1","","Carmona, Daniel; Ferrer, Joaquina; Arilla, José M.; Reyes, Josefa; Lahoz, Fernando J.; Elipe, Sergio; Modrego, F. Javier; Oro, Luis A.","Synthesis, Characterization, and Theoretical Studies on Heterobinuclear (p-cymene)Os(μ-pz)2M (M = Ir, Rh; Hpz = Pyrazole) Complexes","Organometallics","2000","19","5","798","","10.1021/om990624h","","","0.71073","MoKα","","0.0809","0.0425","","","0.06","0.0675","","","","","","0.973","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077665","11.624","0.001","12.928","0.0008","16.753","0.0016","80.009","0.006","77","0.003","84.926","0.006","2412.6","0.3","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H64 B20 Li O4 Sm -","- C36 H60 B20 Li O4 Sm -","- C72 H120 B40 Li2 O8 Sm2 -","2","1","","Wang, Shaowu; Yang, Qingchuan; Mak, Thomas C. W.; Xie, Zuowei","Carbon versus Silicon Bridges. Synthesis of a New Versatile Ligand and Its Applications in Organolanthanide Chemistry","Organometallics","2000","19","3","334","","10.1021/om990648o","","","0.71073","MoKα","","0.0542","0.0508","","","0.1396","0.1425","","","","","","1.054","","","","has coordinates,has disorder","178665","2020-10-21","18:00:00",""
"4077666","11.994","0.003","13.266","0.004","17.716","0.005","76.83","0.02","76.13","0.018","85.856","0.016","2664.2","1.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C44 H52 B20 Li O4 Sm -","- C44 H52 B20 Li O4 Sm -","- C88 H104 B40 Li2 O8 Sm2 -","2","1","","Wang, Shaowu; Yang, Qingchuan; Mak, Thomas C. W.; Xie, Zuowei","Carbon versus Silicon Bridges. Synthesis of a New Versatile Ligand and Its Applications in Organolanthanide Chemistry","Organometallics","2000","19","3","334","","10.1021/om990648o","","","0.71073","MoKα","","0.0842","0.0745","","","0.2073","0.2263","","","","","","1.013","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077667","20.354","0.0019","9.6415","0.0007","15.4","0.0014","90","","90","","90","","3022.1","0.5","296","2","296","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C22 H42 B10 O4 Yb -","- C22 H42 B10 O4 Yb -","- C88 H168 B40 O16 Yb4 -","4","1","","Wang, Shaowu; Yang, Qingchuan; Mak, Thomas C. W.; Xie, Zuowei","Carbon versus Silicon Bridges. Synthesis of a New Versatile Ligand and Its Applications in Organolanthanide Chemistry","Organometallics","2000","19","3","334","","10.1021/om990648o","","","0.71073","MoKα","","0.0767","0.0673","","","0.167","0.1744","","","","","","1.141","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077668","12.716","0.003","21.471","0.004","22.011","0.004","90","","90","","90","","6010","2","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C47 H82 B20 Li O6 Yb -","- C47 H82 B20 Li O6 Yb -","- C188 H328 B80 Li4 O24 Yb4 -","4","1","","Wang, Shaowu; Yang, Qingchuan; Mak, Thomas C. W.; Xie, Zuowei","Carbon versus Silicon Bridges. Synthesis of a New Versatile Ligand and Its Applications in Organolanthanide Chemistry","Organometallics","2000","19","3","334","","10.1021/om990648o","","","0.71073","MoKα","","0.0628","0.0574","","","0.1477","0.1523","","","","","","1.059","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077669","11.551","0.003","12.899","0.003","16.805","0.004","79.912","0.008","76.46","0.019","83.453","0.017","2389.7","1","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H64 B20 Li O4 Yb -","- C36 H62 B20 Li O4 Yb -","- C72 H124 B40 Li2 O8 Yb2 -","2","1","","Wang, Shaowu; Yang, Qingchuan; Mak, Thomas C. W.; Xie, Zuowei","Carbon versus Silicon Bridges. Synthesis of a New Versatile Ligand and Its Applications in Organolanthanide Chemistry","Organometallics","2000","19","3","334","","10.1021/om990648o","","","0.71073","MoKα","","0.0994","0.0956","","","0.245","0.2477","","","","","","1.171","","","","has coordinates,has disorder","178665","2020-10-21","18:00:00",""
"4077670","11.645","0.0006","12.959","0.0006","16.732","0.001","79.917","0.004","77.13","0.002","84.865","0.004","2420.2","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H64 B20 Li Nd O4 -","- C36 H64 B20 Li Nd O4 -","- C72 H128 B40 Li2 Nd2 O8 -","2","1","","Wang, Shaowu; Yang, Qingchuan; Mak, Thomas C. W.; Xie, Zuowei","Carbon versus Silicon Bridges. Synthesis of a New Versatile Ligand and Its Applications in Organolanthanide Chemistry","Organometallics","2000","19","3","334","","10.1021/om990648o","","","0.71073","MoKα","","0.0596","0.0582","","","0.1688","0.1711","","","","","","1.025","","","","has coordinates,has disorder","178665","2020-10-21","18:00:00",""
"4077671","11.874","0.002","31.547","0.006","18.809","0.004","90","","105.16","0.008","90","","6800","2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C54 H90 B20 Li O6 Yb -","- C54 H90 B20 Li O6 Yb -","- C216 H360 B80 Li4 O24 Yb4 -","4","1","","Wang, Shaowu; Yang, Qingchuan; Mak, Thomas C. W.; Xie, Zuowei","Carbon versus Silicon Bridges. Synthesis of a New Versatile Ligand and Its Applications in Organolanthanide Chemistry","Organometallics","2000","19","3","334","","10.1021/om990648o","","","0.71073","MoKα","","0.1171","0.0964","","","0.2345","0.2538","","","","","","1.099","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077672","9.5596","0.0008","19.739","0.004","17.731","0.002","90","","104.555","0.008","90","","3238.4","0.8","243","","243","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C34 H46 Ba Si2 -","- C34 H46 Ba Si2 -","- C136 H184 Ba4 Si8 -","4","1","","Weeber, Armin; Harder, Sjoerd; Brintzinger, Hans H.; Knoll, Konrad","Homoleptic and Heteroleptic Barium Benzyl Complexes: Synthesis and Reactivity as Initiators for Anionic Styrene Polymerizations","Organometallics","2000","19","7","1325","","10.1021/om990705d","","","0.71073","MoKα","","0.057","0.0381","","0.1082","","0.0918","","","1.057","","","1.09","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077673","15.099","0.002","16.131","0.002","19.817","0.003","108.2","0.03","103.14","0.03","94.34","0.03","4408.7","1.6","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C46.73 H34 F6 O7 P2 Ru S2 -","- C46.7315 H31.5 F6 O7 P2 Ru S2 -","- C186.926 H126 F24 O28 P8 Ru4 S8 -","4","2","","den Reijer, Carolien J.; Wörle, Michael; Pregosin, Paul S.","P−C Bond Splitting Reactions in Ruthenium(II) Complexes of Binap and MeO−Biphep Using CF3SO3H and HBF4. A Novel Ru−F−H Interaction","Organometallics","2000","19","3","309","","10.1021/om990714m","","","0.71073","MoKα","","0.0885","0.05","","","0.1221","0.1457","","","","","","0.976","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077674","21.02","0.003","10.294","0.002","21.626","0.003","90","","117.16","0.03","90","","4163.5","1.6","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C40 H34 F6 O9 P2 Ru S2 -","- C40 H34 F6 O9 P2 Ru S2 -","- C160 H136 F24 O36 P8 Ru4 S8 -","4","1","","den Reijer, Carolien J.; Wörle, Michael; Pregosin, Paul S.","P−C Bond Splitting Reactions in Ruthenium(II) Complexes of Binap and MeO−Biphep Using CF3SO3H and HBF4. A Novel Ru−F−H Interaction","Organometallics","2000","19","3","309","","10.1021/om990714m","","","0.71073","MoKα","","0.1071","0.0695","","","0.1793","0.2061","","","","","","1.04","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077675","10.5712","0.0017","15.2271","0.0016","15.605","0.003","79.574","0.012","74.864","0.017","71.81","0.01","2290","0.7","294","","294","","","","","","","","?","5","P -1","-P 1","2","","","","- C50.75 H38 Cl3.5 Fe2 Ti -","- C50.75 H38 Cl3.5 Fe2 Ti -","- C101.5 H76 Cl7 Fe4 Ti2 -","2","1","","Hudson, Richard D. A.; Foxman, Bruce M.; Rosenblum, Myron","New Face-To-Face Metallocene Triads","Organometallics","2000","19","4","469","","10.1021/om990750l","","","0.71073","MoKα","","","0.0951","","","0.1097","","","","","0.9852","0.9852","","","","","has coordinates","190534","2020-10-21","18:00:00",""
"4077676","9.6251","0.0003","14.4492","0.0004","13.3573","0.0005","90","","92.121","0.001","90","","1856.39","0.1","299","2","299","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H20 O Se2 W -","- C18 H20 O Se2 W -","- C72 H80 O4 Se8 W4 -","4","1","","Mathur, Pradeep; Ahmed, Moawia O.; Dash, Aswini K.; Kaldis, John H.","Synthesis of New Selenium- and Oxygen-Containing Tungsten Acetylide Complexes [(η5-C5Me5)W(O)(Se2)(CCPh)] and [(η5-C5Me5)W(Se5CCPh)]","Organometallics","2000","19","5","941","","10.1021/om990775k","","","0.71073","MoKα","","0.0609","0.0338","","0.0815","0.0733","","","","1.009","1.093","1.093","","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077677","7.191","0.002","8.353","0.002","17.93","0.005","100.669","0.006","93.552","0.005","99.281","0.008","1039.8","0.5","299","2","299","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H20 Se5 W -","- C18 H20 Se5 W -","- C36 H40 Se10 W2 -","2","1","","Mathur, Pradeep; Ahmed, Moawia O.; Dash, Aswini K.; Kaldis, John H.","Synthesis of New Selenium- and Oxygen-Containing Tungsten Acetylide Complexes [(η5-C5Me5)W(O)(Se2)(CCPh)] and [(η5-C5Me5)W(Se5CCPh)]","Organometallics","2000","19","5","941","","10.1021/om990775k","","","0.71073","MoKα","","0.0512","0.0317","","0.0724","0.0661","","","","0.891","0.952","0.952","","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077678","9.775","0.002","11.127","0.002","13.44","0.002","99.18","0.02","105.12","0.02","102.03","0.01","1344.3","0.5","293","2","293","2","","","","","","","CH2Cl2/ET2O","5","P -1","-P 1","2","","","","- C25 H41 N O5 W -","- C25 H41 N O5 W -","- C50 H82 N2 O10 W2 -","2","1","","Shafiq, Faisal; Szalda, David J.; Creutz, Carol; Bullock, R. Morris","Water-Soluble Tungsten Hydrides: Synthesis, Structures, and Reactions of (C5H4CO2H)(CO)3WH and Related Complexes","Organometallics","2000","19","5","824","","10.1021/om990778x","","","0.71073","MoKα","","0.0869","0.0361","","0.0915","0.0797","","","","1.053","1.107","1.107","","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077679","7.648","0.002","10.888","0.003","12.64","0.004","90","0.02","102.97","0.02","90","0.02","1025.7","0.5","293","2","293","2","","","","","","","THF/hexanes","4","P 1 21/c 1","-P 2ybc","14","","","","- C9 H6 O5 W -","- C9 H5 O5 W -","- C36 H20 O20 W4 -","4","1","","Shafiq, Faisal; Szalda, David J.; Creutz, Carol; Bullock, R. Morris","Water-Soluble Tungsten Hydrides: Synthesis, Structures, and Reactions of (C5H4CO2H)(CO)3WH and Related Complexes","Organometallics","2000","19","5","824","","10.1021/om990778x","","","0.71073","MoKα","","0.0776","0.034","","0.0899","0.0744","","","","0.988","1.081","1.081","","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077680","11.92","0.003","6.642","0.002","18.845","0.004","90","","106.76","0.03","90","","1428.6","0.7","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C13 H18 N3 O2 P W -","- C13 H18 N3 O2 P W -","- C52 H72 N12 O8 P4 W4 -","4","1","","Shafiq, Faisal; Szalda, David J.; Creutz, Carol; Bullock, R. Morris","Water-Soluble Tungsten Hydrides: Synthesis, Structures, and Reactions of (C5H4CO2H)(CO)3WH and Related Complexes","Organometallics","2000","19","5","824","","10.1021/om990778x","","","0.71073","MoKα","","0.081","0.058","","","0.1603","0.1663","","","","","","1.329","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077681","11.12","0.009","15.739","0.005","30.074","0.018","90","","95.4","0.06","90","","5240","6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H36 P2 Rh2 -","- C26 H36 P2 Rh2 -","- C208 H288 P16 Rh16 -","8","2","","Cronin, Leroy; Higgitt, Catherine L.; Perutz, Robin N.","Structure and Dynamic Exchange in Rhodium η2-Naphthalene and Rhodium η2-Phenanthrene Complexes: Quantitative NOESY and EXSY Studies","Organometallics","2000","19","4","672","","10.1021/om9908377","","","0.71069","MoKα","","0.0781","0.0475","","0.2248","0.1232","","","","1.112","1.09","1.09","","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077682","12.9195","0.0003","11.4336","0.0003","11.8833","0.0003","90","","108.133","0.001","90","","1668.18","0.07","296","2","296","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C12 H18 F3 N3 O3 Pt S -","- C12 H18 F3 N3 O3 Pt S -","- C48 H72 F12 N12 O12 Pt4 S4 -","4","1","","Hinman, Justin G.; Baar, Cliff R.; Jennings, Michael C.; Puddephatt, Richard J.","Protonolysis of Dimethylplatinum(II) Complexes: Primary Attack at Metal or Ligand","Organometallics","2000","19","4","563","","10.1021/om990840q","","","0.71073","MoKα","","0.0668","0.0365","","","0.0736","0.0815","","","","","","1.008","","","","has coordinates,has disorder","178665","2020-10-21","18:00:00",""
"4077683","9.0192","0.0005","18.6474","0.001","12.9098","0.0008","90","","109.413","0.003","90","","2047.8","0.2","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C15 H18 F6 N3 O4 Pt -","- C15 H18 F6 N3 O4 Pt -","- C60 H72 F24 N12 O16 Pt4 -","4","1","","Hinman, Justin G.; Baar, Cliff R.; Jennings, Michael C.; Puddephatt, Richard J.","Protonolysis of Dimethylplatinum(II) Complexes: Primary Attack at Metal or Ligand","Organometallics","2000","19","4","563","","10.1021/om990840q","","","0.71073","MoKα","","0.1237","0.0427","","","0.0748","0.0918","","","","","","0.896","","","","has coordinates,has disorder","178665","2020-10-21","18:00:00",""
"4077684","10.864","0.002","11.46","0.003","8.481","0.002","109.37","0.01","110.76","0.01","97.5","0.01","893.9","0.4","298.2","","298.2","","","","","","","","","5","P -1","-P 1","2","","","","- C19 H15 Bi O4 S -","- C19 H15 Bi O4 S -","- C38 H30 Bi2 O8 S2 -","2","1","","Murafuji, Toshihiro; Nagasue, Masahiro; Tashiro, Yoshihiro; Sugihara, Yoshikazu; Azuma, Nagao","Structural Characteristics of Aryloxybismuthanes Stabilized by Hypervalent Bond Formation. Synthesis, Incorporation of 4-Methoxyphenol through Hydrogen Bonding, and Crystal Supramolecularity","Organometallics","2000","19","6","1003","","10.1021/om9908534","","","0.7107","MoKα","","","0.04","","","","0.035","0.0524","","","","","1.6317","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077685","17.817","0.006","8.443","0.002","18.232","0.005","90","","117.71","0.02","90","","2428.1","1.3","298.2","","298.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H23 Bi O6 S -","- C26 H23 Bi O6 S -","- C104 H92 Bi4 O24 S4 -","4","1","","Murafuji, Toshihiro; Nagasue, Masahiro; Tashiro, Yoshihiro; Sugihara, Yoshikazu; Azuma, Nagao","Structural Characteristics of Aryloxybismuthanes Stabilized by Hypervalent Bond Formation. Synthesis, Incorporation of 4-Methoxyphenol through Hydrogen Bonding, and Crystal Supramolecularity","Organometallics","2000","19","6","1003","","10.1021/om9908534","","","0.7107","MoKα","","","0.0501","","","","0.0406","","","","","","1.275","","","","has coordinates","288221","2023-12-11","22:20:44",""
"4077686","24.177","0.009","7.174","0.002","21.94","0.006","90","","108.32","0.02","90","","3613","2","298.2","","298.2","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C19 H15 Bi O4 S -","- C19 H15 Bi O4 S -","- C152 H120 Bi8 O32 S8 -","8","1","","Murafuji, Toshihiro; Nagasue, Masahiro; Tashiro, Yoshihiro; Sugihara, Yoshikazu; Azuma, Nagao","Structural Characteristics of Aryloxybismuthanes Stabilized by Hypervalent Bond Formation. Synthesis, Incorporation of 4-Methoxyphenol through Hydrogen Bonding, and Crystal Supramolecularity","Organometallics","2000","19","6","1003","","10.1021/om9908534","","","0.7107","MoKα","","","0.0545","","","","0.047","","","","","","1.724","","","","has coordinates","288221","2023-12-11","22:20:44",""
"4077687","11.891","0.002","15.397","0.002","14.23","0.002","90","","107.098","0.003","90","","2490.2","0.6","213","2","213","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H16 B F15 N O -","- C24 H16 B F15 N O -","- C96 H64 B4 F60 N4 O4 -","4","1","","Duchateau, Robbert; van Santen, Rutger A.; Yap, G. P. A.","Silica-Grafted Borato Cocatalysts for Olefin Polymerization Modeled by Silsesquioxane−Borato Complexes","Organometallics","2000","19","5","809","","10.1021/om990855o","","","0.71073","MoKα","","0.108","0.0547","","","0.1186","0.13","","","","","","1.031","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077688","17.05","0.003","20.919","0.004","20.046","0.004","90","","90.975","0.004","90","","7149","2","238","2","238","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C61 H75 B F15 N O13 Si8 -","- C61 H75 B F15 N O13 Si8 -","- C244 H300 B4 F60 N4 O52 Si32 -","4","1","","Duchateau, Robbert; van Santen, Rutger A.; Yap, G. P. A.","Silica-Grafted Borato Cocatalysts for Olefin Polymerization Modeled by Silsesquioxane−Borato Complexes","Organometallics","2000","19","5","809","","10.1021/om990855o","","","0.71073","MoKα","","0.066","0.0426","","","0.1052","0.1114","","","","","","1.014","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077689","14.191","0.003","14.937","0.003","19.488","0.004","111.53","0.03","102.65","0.03","101.93","0.03","3556.9","1.9","173","2","173","2","","","","","","","","9","P -1","-P 1","2","","","","- C60 H62 F12 Hg2 N2 O9 P2 Pt2 S4 -","- C60 H62 F12 Hg2 N2 O9 P2 Pt2 S4 -","- C120 H124 F24 Hg4 N4 O18 P4 Pt4 S8 -","2","1","","Forniés, Juan; Martín, Antonio; Sicilia, Violeta; Villarroya, Pablo","Reactivity of [M(C∧P)(S2CNMe2)] [M = Pt, Pd; C∧P = CH2−C6H4−P(o-tolyl)2-κC,P] toward Mercury(II) Carboxylates. X-ray Molecular Structures of [Pt(C∧P)(S2CNMe2)(O2CCF3)Hg(O2CCF3)] and [Pd(S2CNMe2){μ-P(o-tolyl)2−C6H4−CH2−}(μ-O2CCH3)Hg(O2CCH3)]","Organometallics","2000","19","6","1107","","10.1021/om990856g","","","0.71073","MoKα","","0.0756","0.0427","","0.1189","0.0838","","","","1.073","1.132","1.132","","","","","has coordinates,has disorder","178665","2020-10-21","18:00:00",""
"4077690","8.012","0.001","35.069","0.005","11.355","0.001","90","","101.31","0.01","90","","3128.5","0.7","200","2","200","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C28 H34 Hg N O5 P Pd S2 -","- C28 H32 Hg N O5 P Pd S2 -","- C112 H128 Hg4 N4 O20 P4 Pd4 S8 -","4","1","","Forniés, Juan; Martín, Antonio; Sicilia, Violeta; Villarroya, Pablo","Reactivity of [M(C∧P)(S2CNMe2)] [M = Pt, Pd; C∧P = CH2−C6H4−P(o-tolyl)2-κC,P] toward Mercury(II) Carboxylates. X-ray Molecular Structures of [Pt(C∧P)(S2CNMe2)(O2CCF3)Hg(O2CCF3)] and [Pd(S2CNMe2){μ-P(o-tolyl)2−C6H4−CH2−}(μ-O2CCH3)Hg(O2CCH3)]","Organometallics","2000","19","6","1107","","10.1021/om990856g","","","0.71073","MoKα","","0.0484","0.0297","","0.087","0.058","","","","1.102","1.134","1.134","","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077691","12.671","0.0002","11.974","0.0001","20.8219","0.0003","90","","99.093","0.0008","90","","3119.45","0.07","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H22 B F15 O Zr -","- C32 H22 B F15 O Zr -","- C128 H88 B4 F60 O4 Zr4 -","4","1","","Corradi, Marco M.; Pindado, Gerardo Jiménez; Sarsfield, Mark J.; Thornton-Pett, Mark; Bochmann, Manfred","Synthesis, Fluxionality, and Propene Insertion Reactions of Zirconium Boryldiene Complexes with Sterically Undemanding Cp Ligands","Organometallics","2000","19","6","1150","","10.1021/om990859t","","","0.71073","MoKα","","0.0334","0.0307","","","0.0811","0.084","","","","","","1.038","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077692","12.722","","14.07","","16.014","","114.003","","96.616","","104.237","","2462.03","","298","","298","","","","","","","","?","5","P -1","-P 1","2","","","","- C33 H68 O14 S Sn6 -","- C33 H67 O14 S Sn6 -","- C66 H134 O28 S2 Sn12 -","2","1","","Eychenne-Baron, Christophe; Ribot, François; Steunou, Nathalie; Sanchez, Clément; Fayon, Franck; Biesemans, Monique; Martins, José C.; Willem, Rudolph","Reaction of Butyltin Hydroxide Oxide withp-Toluenesulfonic Acid: Synthesis, X-ray Crystal Analysis, and Multinuclear NMR Characterization of {(BuSn)12O14(OH)6}(4-CH3C6H4SO3)2","Organometallics","2000","19","10","1940","","10.1021/om990877a","","","0.71069","MoKα","","","0.0326","","","0.034","","","","","2.1619","2.1619","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4077693","13.207","0.004","8.781","0.004","13.844","0.003","90","","92.25","0.02","90","","1604.3","0.9","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C30 H54 Ge Si2 -","- C30 H54 Ge Si2 -","- C60 H108 Ge2 Si4 -","2","0.5","","Constantine, Steven P.; Cox, Hazel; Hitchcock, Peter B.; Lawless, Gerard A.","Parallel Metallocenes of Germanium, Tin, and Lead","Organometallics","2000","19","3","317","","10.1021/om990884z","","","0.71073","MoKα","","0.2088","0.0839","","0.2072","0.1549","","","","1.036","1.217","1.217","","","","","has coordinates,has disorder","178665","2020-10-21","18:00:00",""
"4077694","12.3927","0.0002","9.7566","0.0001","24.2436","0.0005","90","","99.541","0.001","90","","2890.76","0.08","210","2","210","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H43 B P2 Ru Si -","- C27 H43 B P2 Ru Si -","- C108 H172 B4 P8 Ru4 Si4 -","4","1","","Dioumaev, Vladimir K.; Plössl, Karl; Carroll, Patrick J.; Berry, Donald H.","Access to Unsaturated Ruthenium Complexes via Phosphine Complexation with Triphenylborane: Synthesis and Structure of a Zwitterionic Arene Complex, (η6-Ph-BPh2H)Ru(PMe3)2(SiMe3)","Organometallics","2000","19","17","3374","","10.1021/om9908938","","","0.71069","MoKα","","0.0929","0.076","","0.132","0.1248","","","","1.229","","","1.253","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077695","8.1554","0.0003","21.5857","0.0006","29.8363","0.0009","90","","90","","90","","5252.4","0.3","298","2","298","2","","","","","","","","6","P 21 c a","P -2ac 2a","29","","","","- C25 H18 Co2 N3 O5 P -","- C25 H18 Co2 N3 O5 P -","- C200 H144 Co16 N24 O40 P8 -","8","2","","Castro, Jaume; Moyano, Albert; Pericàs, Miquel A.; Riera, Antoni; Maestro, Miguel Angel; Mahía, José","Tris(pyrrolyl)phosphine-Substituted Acetylene−Dicobaltcarbonyl Complexes: Syntheses, Structural Characterization, and Reactivity Studies","Organometallics","2000","19","9","1704","","10.1021/om990914y","","","0.71073","MoKα","","0.0895","0.0543","","","0.1197","0.1417","","","","","","1.008","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077696","9.434","0.002","13.136","0.004","16.781","0.005","100.34","0.03","103.86","0.02","108.44","0.02","1840.3","1","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H30 Co2 N6 O4 P2 -","- C36 H30 Co2 N6 O4 P2 -","- C72 H60 Co4 N12 O8 P4 -","2","1","","Castro, Jaume; Moyano, Albert; Pericàs, Miquel A.; Riera, Antoni; Maestro, Miguel Angel; Mahía, José","Tris(pyrrolyl)phosphine-Substituted Acetylene−Dicobaltcarbonyl Complexes: Syntheses, Structural Characterization, and Reactivity Studies","Organometallics","2000","19","9","1704","","10.1021/om990914y","","","0.71073","MoKα","","0.1098","0.0552","","","0.1054","0.131","","","","","","1.026","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077697","10.926","0.0001","18.3592","0.0002","11.139","","90","","103.496","0.001","90","","2172.7","0.03","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H14 Co2 N3 O5 P -","- C20 H14 Co2 N3 O5 P -","- C80 H56 Co8 N12 O20 P4 -","4","1","","Castro, Jaume; Moyano, Albert; Pericàs, Miquel A.; Riera, Antoni; Maestro, Miguel Angel; Mahía, José","Tris(pyrrolyl)phosphine-Substituted Acetylene−Dicobaltcarbonyl Complexes: Syntheses, Structural Characterization, and Reactivity Studies","Organometallics","2000","19","9","1704","","10.1021/om990914y","","","0.71073","MoKα","","0.0672","0.0394","","","0.0768","0.0877","","","","","","1.054","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077698","17.7686","0.0003","7.8881","0.0003","30.6968","0.001","90","","90","","90","","4302.5","0.2","133","2","133","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C24 H25 F3 Si -","- C24 H25 F3 Si -","- C192 H200 F24 Si8 -","8","1","","Pietschnig, Rudolf; West, Robert; Powell, Douglas R.","Reduction of Terphenyltrifluorosilanes: C−C Insertion Products and Possible Formation of a Disilyne","Organometallics","2000","19","14","2724","","10.1021/om990924z","","","0.71073","MoKα","","0.0765","0.051","","","0.1073","0.1147","","","","","","1.08","","","","has coordinates","178665","2020-10-21","18:00:00",""
"4077699","10.9496","0.0004","12.0899","0.0005","25.4843","0.0009","90","","90","","90","","3373.6","0.2","133","2","133","2","","","","","","","","4","P b c m","-P 2c 2b","57","","","","- C36 H49 F3 Si -","- C36 H49 F3.003 Si -","- C144 H196 F12.012 Si4 -","4","0.5","","Pietschnig, Rudolf; West, Robert; Powell, Douglas R.","Reduction of Terphenyltrifluorosilanes: C−C Insertion Products and Possible Formation of a Disilyne","Organometallics","2000","19","14","2724","","10.1021/om990924z","","","0.71073","MoKα","","0.0672","0.0569","","","0.1433","0.1481","","","","","","1.106","","","","has coordinates,has disorder","178665","2020-10-21","18:00:00",""
"4077700","8.8406","0.0018","11.157","0.002","21.144","0.004","88.282","0.005","82.74","0.003","71.166","0.003","1957.9","0.6","143","2","143","2","","","","","","","","3","P -1","-P 1","2","","","","- C48 H50 Si2 -","- C48 H50 Si2 -","- C96 H100 Si4 -","2","1","","Pietschnig, Rudolf; West, Robert; Powell, Douglas R.","Reduction of Terphenyltrifluorosilanes: C−C Insertion Products and Possible Formation of a Disilyne","Organometallics","2000","19","14","2724","","10.1021/om990924z","","","0.71073","MoKα","","0.2757","0.1186","","","0.2471","0.3053","","","","","","0.897","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077701","13.7295","0.001","26.639","0.002","29.299","0.002","90","","97.287","0.003","90","","10629.3","1.3","133","2","133","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C54 H56 F9 K3 Si2 -","- C54 H56 F9 K3 Si2 -","- C432 H448 F72 K24 Si16 -","8","2","","Pietschnig, Rudolf; West, Robert; Powell, Douglas R.","Reduction of Terphenyltrifluorosilanes: C−C Insertion Products and Possible Formation of a Disilyne","Organometallics","2000","19","14","2724","","10.1021/om990924z","","","0.71073","MoKα","","0.0783","0.0458","","","0.0981","0.1048","","","","","","0.838","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077702","7.67","0.0004","23.433","0.002","11.522","0.0009","90","","91.74","0.005","90","","2069.9","0.3","296","2","296","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C28 H58 B20 Cl O2 Sm -","- C28 H58 B20 Cl O2 Sm -","- C56 H116 B40 Cl2 O4 Sm2 -","2","1","","Chui, Kwoli; Yang, Qingchuan; Mak, Thomas C. W.; Xie, Zuowei","Synthesis, Structure, and Reactivity of Organolanthanide Carboranyl Compounds and Lanthanacarboranes Derived from a Versatile Ligand, Me2C(C5H5)(C2B10H11)","Organometallics","2000","19","7","1391","","10.1021/om990941o","","","0.71073","MoKα","","0.0553","0.0532","","0.1603","0.152","","","","0.997","0.997","0.997","","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077703","22.254","0.005","20.737","0.004","24.968","0.005","90","","110.23","0.03","90","","10811","4","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C67 H134 B60 Sm2 -","- C67 H134 B60 Sm2 -","- C268 H536 B240 Sm8 -","4","1","","Chui, Kwoli; Yang, Qingchuan; Mak, Thomas C. W.; Xie, Zuowei","Synthesis, Structure, and Reactivity of Organolanthanide Carboranyl Compounds and Lanthanacarboranes Derived from a Versatile Ligand, Me2C(C5H5)(C2B10H11)","Organometallics","2000","19","7","1391","","10.1021/om990941o","","","0.71073","MoKα","","0.0997","0.0763","","","0.2096","0.2294","","","","","","1.07","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077704","9.8683","0.0003","28.436","0.0013","17.34","0.0007","90","","92.186","0.003","90","","4862.3","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H70 B20 Li O6 Sm -","- C32 H70 B20 Li O6 Sm -","- C128 H280 B80 Li4 O24 Sm4 -","4","1","","Chui, Kwoli; Yang, Qingchuan; Mak, Thomas C. W.; Xie, Zuowei","Synthesis, Structure, and Reactivity of Organolanthanide Carboranyl Compounds and Lanthanacarboranes Derived from a Versatile Ligand, Me2C(C5H5)(C2B10H11)","Organometallics","2000","19","7","1391","","10.1021/om990941o","","","0.71073","MoKα","","0.0516","0.0453","","","0.1207","0.1254","","","","","","1.088","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077705","9.91","0.002","28.006","0.006","17.547","0.004","90","","92.62","0.03","90","","4864.9","1.8","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H70 B20 Li O6 Yb -","- C32 H69 B20 Li O6 Yb -","- C128 H276 B80 Li4 O24 Yb4 -","4","1","","Chui, Kwoli; Yang, Qingchuan; Mak, Thomas C. W.; Xie, Zuowei","Synthesis, Structure, and Reactivity of Organolanthanide Carboranyl Compounds and Lanthanacarboranes Derived from a Versatile Ligand, Me2C(C5H5)(C2B10H11)","Organometallics","2000","19","7","1391","","10.1021/om990941o","","","0.71073","MoKα","","0.044","0.0392","","","0.103","0.107","","","","","","0.926","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077706","13.565","0.003","13.608","0.006","23.802","0.006","100.73","0.02","99.06","0.01","104.76","0.02","4076","2","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H58 B20 O2 Yb -","- C28 H58 B20 O2 Yb -","- C112 H232 B80 O8 Yb4 -","4","2","","Chui, Kwoli; Yang, Qingchuan; Mak, Thomas C. W.; Xie, Zuowei","Synthesis, Structure, and Reactivity of Organolanthanide Carboranyl Compounds and Lanthanacarboranes Derived from a Versatile Ligand, Me2C(C5H5)(C2B10H11)","Organometallics","2000","19","7","1391","","10.1021/om990941o","","","0.71073","MoKα","","0.0923","0.0839","","","0.2341","0.2472","","","","","","1.095","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077707","9.8703","0.0008","14.331","0.0018","17.309","0.002","90","","90","","90","","2448.4","0.5","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C18 H37 B10 O2 Sm -","- C18 H36 B10 O2 Sm -","- C72 H144 B40 O8 Sm4 -","4","1","","Chui, Kwoli; Yang, Qingchuan; Mak, Thomas C. W.; Xie, Zuowei","Synthesis, Structure, and Reactivity of Organolanthanide Carboranyl Compounds and Lanthanacarboranes Derived from a Versatile Ligand, Me2C(C5H5)(C2B10H11)","Organometallics","2000","19","7","1391","","10.1021/om990941o","","","0.71073","MoKα","","0.0709","0.0606","","","0.1475","0.154","","","","","","1.066","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077708","9.853","0.002","14.272","0.003","17.056","0.003","90","","90","","90","","2398.4","0.8","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C18 H37 B10 Er O2 -","- C18 H37 B10 Er O2 -","- C72 H148 B40 Er4 O8 -","4","1","","Chui, Kwoli; Yang, Qingchuan; Mak, Thomas C. W.; Xie, Zuowei","Synthesis, Structure, and Reactivity of Organolanthanide Carboranyl Compounds and Lanthanacarboranes Derived from a Versatile Ligand, Me2C(C5H5)(C2B10H11)","Organometallics","2000","19","7","1391","","10.1021/om990941o","","","0.71073","MoKα","","0.0952","0.0787","","","0.2235","0.2427","","","","","","1.17","","","","has coordinates,has disorder","178666","2020-10-21","18:00:00",""
"4077709","6.787","0.001","11.384","0.001","31.124","0.001","90","","90.47","0.001","90","","2404.7","0.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H33 Br N2 O2 Pt -","- C22 H33 Br N2 O2 Pt -","- C88 H132 Br4 N8 O8 Pt4 -","4","1","","Fraser, Christopher S. A.; Jenkins, Hilary A.; Jennings, Michael C.; Puddephatt, Richard J.","Organoplatinum(IV) Complexes with Hydrogen Bonds: From Monomers to Polymers","Organometallics","2000","19","9","1635","","10.1021/om990942g","","","0.71073","MoKα","","0.0381","0.0315","","0.0834","0.0769","","","","1.156","1.185","1.185","","","","","has coordinates,has disorder","178666","2020-10-21","18:00:00",""
"4077710","12.647","0.003","20.008","0.004","13.675","0.003","90","","104.72","0.03","90","","3346.8","1.4","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C31 H47 Cl N4 O4 Pt -","- C31 H47 Cl N4 O4 Pt -","- C124 H188 Cl4 N16 O16 Pt4 -","4","1","","Fraser, Christopher S. A.; Jenkins, Hilary A.; Jennings, Michael C.; Puddephatt, Richard J.","Organoplatinum(IV) Complexes with Hydrogen Bonds: From Monomers to Polymers","Organometallics","2000","19","9","1635","","10.1021/om990942g","","","0.71073","MoKα","","0.0618","0.0379","","0.0874","0.0818","","","","0.968","1.067","1.067","","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077711","22.1988","0.0003","14.4142","0.0002","24.3526","0.0004","90","","116.757","0.001","90","","6957.93","0.19","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C33 H48 Cl N3 O3 Pt -","- C33 H48 Cl N3 O3 Pt -","- C264 H384 Cl8 N24 O24 Pt8 -","8","2","","Fraser, Christopher S. A.; Jenkins, Hilary A.; Jennings, Michael C.; Puddephatt, Richard J.","Organoplatinum(IV) Complexes with Hydrogen Bonds: From Monomers to Polymers","Organometallics","2000","19","9","1635","","10.1021/om990942g","","","0.71073","MoKα","","0.0738","0.0492","","","0.1202","0.1369","","","","","","1.035","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077712","13.9808","0.0002","23.6523","0.0005","24.3279","0.0004","90","","103.257","0.001","90","","7830.3","0.2","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C31 H44 Cl5 N3 O2 Pt -","- C31 H44 Cl5 N3 O2 Pt -","- C248 H352 Cl40 N24 O16 Pt8 -","8","2","","Fraser, Christopher S. A.; Jenkins, Hilary A.; Jennings, Michael C.; Puddephatt, Richard J.","Organoplatinum(IV) Complexes with Hydrogen Bonds: From Monomers to Polymers","Organometallics","2000","19","9","1635","","10.1021/om990942g","","","0.71073","MoKα","","0.1303","0.0873","","","0.2207","0.2475","","","","","","1.093","","","","has coordinates,has disorder","178666","2020-10-21","18:00:00",""
"4077713","17.0747","0.0002","14.756","0.0002","17.3898","0.0002","90","","103.678","0.001","90","","4257.18","0.09","292","2","292","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C40 H54 B F4 N3 O6 Pt -","- C40 H54 B F4 N3 O6 Pt -","- C160 H216 B4 F16 N12 O24 Pt4 -","4","1","","Fraser, Christopher S. A.; Jenkins, Hilary A.; Jennings, Michael C.; Puddephatt, Richard J.","Organoplatinum(IV) Complexes with Hydrogen Bonds: From Monomers to Polymers","Organometallics","2000","19","9","1635","","10.1021/om990942g","","","0.71073","MoKα","","0.0466","0.0372","","","0.0987","0.1075","","","","","","1.063","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077714","14.5655","0.0007","15.1038","0.0007","19.4029","0.0008","90","","93.965","0.003","90","","4258.3","0.3","200","2","200","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C37 H51 B F4 N3 O3 Pt -","- C37 H51 B F4 N3 O3 Pt -","- C148 H204 B4 F16 N12 O12 Pt4 -","4","1","","Fraser, Christopher S. A.; Jenkins, Hilary A.; Jennings, Michael C.; Puddephatt, Richard J.","Organoplatinum(IV) Complexes with Hydrogen Bonds: From Monomers to Polymers","Organometallics","2000","19","9","1635","","10.1021/om990942g","","","0.71073","MoKα","","0.1039","0.0538","","","0.1396","0.1616","","","","","","1.022","","","","has coordinates,has disorder","178666","2020-10-21","18:00:00",""
"4077715","12.4406","0.0004","22.7084","0.0011","13.4517","0.0005","90","","90.304","0.002","90","","3800.1","0.3","296","2","296","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C68 H86 B2 F8 N6 O4 Pt2 -","- C68 H86 B2 F8 N6 O4 Pt2 -","- C136 H172 B4 F16 N12 O8 Pt4 -","2","0.5","","Fraser, Christopher S. A.; Jenkins, Hilary A.; Jennings, Michael C.; Puddephatt, Richard J.","Organoplatinum(IV) Complexes with Hydrogen Bonds: From Monomers to Polymers","Organometallics","2000","19","9","1635","","10.1021/om990942g","","","0.71073","MoKα","","0.1047","0.0592","","","0.162","0.184","","","","","","1.036","","","","has coordinates,has disorder","178666","2020-10-21","18:00:00",""
"4077716","15.1176","0.0019","16.2145","0.0019","16.543","0.002","116.141","0.002","98.869","0.002","99.836","0.003","3464","0.7","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C105 H48 Mo O6 P2 -","- C105 H48 Mo O6 P2 -","- C210 H96 Mo2 O12 P4 -","2","1","","Song, Li-Cheng; Liu, Jin-Ting; Hu, Qing-Mei; Weng, Lin-Hong","Synthesis and Crystal Structures of Two Isomerically Pure Organotransition-Metal [60]Fullerene Derivatives Containing dppb Ligands: mer-M(CO)3(dppb)(η2-C60) (M = Mo, W)","Organometallics","2000","19","9","1643","","10.1021/om990975w","","","0.71073","MoKα","","0.0783","0.0511","","","0.1321","0.1476","","","","","","1.011","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077717","15.0228","0.0017","16.0718","0.0019","16.4052","0.0019","115.885","0.002","98.638","0.003","100.209","0.003","3389.3","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C105 H48 O6 P2 W -","- C105 H47 O6 P2 W -","- C210 H94 O12 P4 W2 -","2","1","","Song, Li-Cheng; Liu, Jin-Ting; Hu, Qing-Mei; Weng, Lin-Hong","Synthesis and Crystal Structures of Two Isomerically Pure Organotransition-Metal [60]Fullerene Derivatives Containing dppb Ligands: mer-M(CO)3(dppb)(η2-C60) (M = Mo, W)","Organometallics","2000","19","9","1643","","10.1021/om990975w","","","0.71073","MoKα","","0.1233","0.0679","","","0.1309","0.1487","","","","","","0.999","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077718","24.7","0.001","9.7055","0.0005","18.5448","0.0004","90","","124.368","0.002","90","","3669.6","0.3","213","2","213","2","","","","","","","synthesized","5","C 1 2/c 1","-C 2yc","15","","[tetrakis(μ-trifluoroacetato-κO,κO')dirhodium(II,II)]-bis- (η2-diphenylacetylene)","","- C36 H20 F12 O8 Rh2 -","- C36 H20 F12 O8 Rh2 -","- C144 H80 F48 O32 Rh8 -","4","0.5","","Cotton, F. Albert; Dikarev, Evgeny V.; Petrukhina, Marina A.; Stiriba, Salah-Eddine","Studies of Dirhodium(II) Tetrakis(trifluoroacetate). 6. The First Structural Characterization of Axial Alkyne Complexes, Rh2(O2CCF3)4(Ph2C2)n(n= 1, 2): Diphenylacetylene as a Bifunctional Ligand","Organometallics","2000","19","7","1402","","10.1021/om9909800","","","0.71073","MoKα","","0.0379","0.0359","","0.0874","0.085","","","","1.027","1.034","1.034","","","","","has coordinates,has disorder","178666","2020-10-21","18:00:00",""
"4077719","9.303","0.0004","9.5423","0.0009","16.3049","0.0006","76.795","0.004","84.24","0.005","68.653","0.004","1312.23","0.15","213","2","213","2","","","","","","","synthesized","5","P -1","-P 1","2","","catena-Poly{[tetrakis(μ-trifluoroacetato-κO,kO')dirhodium(II,II)]- -η2,-η2-diphenylacetylene}","","- C22 H10 F12 O8 Rh2 -","- C22 H10 F12 O8 Rh2 -","- C44 H20 F24 O16 Rh4 -","2","1","","Cotton, F. Albert; Dikarev, Evgeny V.; Petrukhina, Marina A.; Stiriba, Salah-Eddine","Studies of Dirhodium(II) Tetrakis(trifluoroacetate). 6. The First Structural Characterization of Axial Alkyne Complexes, Rh2(O2CCF3)4(Ph2C2)n(n= 1, 2): Diphenylacetylene as a Bifunctional Ligand","Organometallics","2000","19","7","1402","","10.1021/om9909800","","","0.71073","MoKα","","0.0411","0.0378","","0.0972","0.0935","","","","1.043","1.049","1.049","","","","","has coordinates,has disorder","178666","2020-10-21","18:00:00",""
"4077720","11.3157","0.0011","14.5575","0.0014","14.3683","0.0014","90","","108.11","0.002","90","","2249.6","0.4","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C12 H18 Cl2 F4 Hg2 O6 P2 -","- C12 H18 Cl2 F4 Hg2 O6 P2 -","- C48 H72 Cl8 F16 Hg8 O24 P8 -","4","1","","Tschinkl, Martin; Bachman, Robert E.; Gabbaï, François P.","Coordination of Dimethyl Methylphosphonate to the Bidentate Lewis Acid 1,2-Bis(chloromercurio)tetrafluorobenzene","Organometallics","2000","19","13","2633","","10.1021/om990987h","","","0.71073","MoKα","","0.063","0.0324","","","0.0613","0.0671","","","","","","0.948","","","","has coordinates,has disorder","178666","2020-10-21","18:00:00",""
"4077721","31.4156","0.0003","7.7228","0.0002","20.696","0.0003","90","","105.479","0.0003","90","","4839.06","0.15","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C29 H28 Cr O5 -","- C29 H28 Cr O5 -","- C232 H224 Cr8 O40 -","8","1","","Matare, Gilbert J.; Foo, David M.; Kane, Kevin M.; Zehnder, Ralph; Wagener, Marion; Shapiro, Pamela J.; Concolino, Tom; Rheingold, Arnold L.","ansa-Chromocene Complexes. 1. Synthesis and Characterization of Cr(II) Carbonyl andtert-Butyl Isocyanide Complexes","Organometallics","2000","19","8","1534","","10.1021/om9909993","","","0.71073","MoKα","","0.0918","0.0762","","","0.2236","0.2385","","","","","","1.785","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077722","11.648","0.003","13.542","0.004","15.046","0.004","111.44","0.02","108.482","0.019","91.43","0.02","2068.3","1.1","295","2","295","2","","","","","","","chemical synthesys","9","P -1","-P 1","2","","2-(Diphenylphosphinopyridine)ChloroPlatinum(II) (μ-N,N'Dibenzyldithioxamidato κ-S,S Pt - κ-N,N Pd)(η^3^-Allyl)- Palladium(II).","","- C37 H34 Cl4 N3 O2 P Pd Pt S2 -","- C37 H34 Cl4 N3 O2 P Pd Pt S2 -","- C74 H68 Cl8 N6 O4 P2 Pd2 Pt2 S4 -","2","1","","Lanza, Santo; Bruno, Giuseppe; Nicolò, Francesco; Rotondo, Archimede; Scopelliti, Rosario; Rotondo, Enrico","Synthesis, Stereochemistry, and Solution Dynamics of Heterobimetallic Complexes with Metals Connected by Dithioxamides in κ-S,S‘ κ-N,N‘ Binucleation Mode. The Molecular Structure of [2-(Diphenylphosphino)pyridine-Pt-Cl-(μ-N,N‘- dibenzyldithioxbisamidato-κ-S,S‘-Pt-κ-N,N‘-Pd)(η3-allyl)Pd]","Organometallics","2000","19","13","2462","","10.1021/om991008o","","","0.71073","MoKα","","0.1023","0.051","","","0.113","0.1335","","","","","","0.791","","","","has coordinates,has disorder","178666","2020-10-21","18:00:00",""
"4077723","10.44","0.002","13.114","0.003","15.172","0.003","80.508","0.012","80.789","0.014","75.243","0.014","1965.9","0.7","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C44 H33 Au N4 O6 P2 -","- C44 H33 Au N4 O6 P2 -","- C88 H66 Au2 N8 O12 P4 -","2","1","","Vicente, José; Chicote, María-Teresa; Abrisqueta, María-Dolores; Jones, Peter G.","A Novel Type of Alkynylgold(I) Complex. Crystal and Molecular Structures of PPN[Au(Ar)(C⋮CH)] [Ar = C6F5, C6H2(NO2)3-2,4,6]","Organometallics","2000","19","13","2629","","10.1021/om9910322","","","0.71073","MoKα","","0.064","0.0379","","0.0627","0.0586","","","","0.843","0.936","0.936","","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077724","9.9604","0.001","15.3873","0.0014","26.862","0.003","90","","92.738","0.008","90","","4112.3","0.7","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C47 H37 Au F5 N O P2 -","- C47 H37 Au F5 N O P2 -","- C188 H148 Au4 F20 N4 O4 P8 -","4","1","","Vicente, José; Chicote, María-Teresa; Abrisqueta, María-Dolores; Jones, Peter G.","A Novel Type of Alkynylgold(I) Complex. Crystal and Molecular Structures of PPN[Au(Ar)(C⋮CH)] [Ar = C6F5, C6H2(NO2)3-2,4,6]","Organometallics","2000","19","13","2629","","10.1021/om9910322","","","0.71073","MoKα","","0.0581","0.0314","","0.0602","0.0561","","","","0.891","1.009","1.009","","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077725","20.8902","0.0015","34.532","0.002","7.5473","0.0006","90","","90","","90","","5444.5","0.7","200","2","200","2","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C62 H64 Cl2 N2 O2 Pt2 -","- C62 H64 Cl2 N2 O2 Pt2 -","- C248 H256 Cl8 N8 O8 Pt8 -","4","1","","Cave, Gareth W. V.; Fanizzi, Francesco P.; Deeth, Robert J.; Errington, William; Rourke, Jonathan P.","C−H Activation Induced by Water. Monocyclometalated to Dicyclometalated: C∧N∧C Tridentate Platinum Complexes","Organometallics","2000","19","7","1355","","10.1021/om9910423","","","0.71073","MoKα","","0.1432","0.0823","","","0.1714","0.2016","","","","","","1.004","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077726","7.3337","0.0006","19.1794","0.0012","18.9464","0.0012","90","","90","","90","","2664.9","0.3","180","2","180","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C18 H11 N O Pt -","- C18 H11 N O Pt -","- C144 H88 N8 O8 Pt8 -","8","2","","Cave, Gareth W. V.; Fanizzi, Francesco P.; Deeth, Robert J.; Errington, William; Rourke, Jonathan P.","C−H Activation Induced by Water. Monocyclometalated to Dicyclometalated: C∧N∧C Tridentate Platinum Complexes","Organometallics","2000","19","7","1355","","10.1021/om9910423","","","0.71073","MoKα","","0.0562","0.0351","","","0.0735","0.0836","","","","","","1.105","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077727","9.628","0.0006","22.9164","0.0009","9.0688","0.0005","90","","98.85","0.01","90","","1977.11","0.19","293","","293","","","","","","","","see text","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H27 Au I2 N2 O -","- C14 H25 Au I2 N2 O -","- C56 H100 Au4 I8 N8 O4 -","4","1","","Contel, María; Nobel, Dominique; Spek, Anthony L.; van Koten, Gerard","Reactivity of [2,6-Bis((dimethylamino)methyl)phenyl]gold(I), an Unusual Intermolecularly Stabilized Bis(amino)aryl−Gold(I) Dimer, toward Alkyl Halides. X-ray Crystal Structures of Its Iodomethane and Methylene Diiodide Adducts†","Organometallics","2000","19","17","3288","","10.1021/om991043v","","","0.71073","MoKα","","0.0848","0.0484","","","0.1101","0.1247","","","","","","1.029","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077728","13.7685","0.0007","7.3762","0.0005","21.8875","0.0011","90","","118.352","0.003","90","","1956.2","0.2","150","","150","","","","","","","","see text","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H24 Au I2 N3 -","- C15 H24 Au I2 N3 -","- C60 H96 Au4 I8 N12 -","4","1","","Contel, María; Nobel, Dominique; Spek, Anthony L.; van Koten, Gerard","Reactivity of [2,6-Bis((dimethylamino)methyl)phenyl]gold(I), an Unusual Intermolecularly Stabilized Bis(amino)aryl−Gold(I) Dimer, toward Alkyl Halides. X-ray Crystal Structures of Its Iodomethane and Methylene Diiodide Adducts†","Organometallics","2000","19","17","3288","","10.1021/om991043v","","","0.71073","MoKα","","0.0392","0.0281","","","0.0576","0.0605","","","","","","1.014","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4087353","14.913","0.004","17.559","0.006","16.333","0.005","90","","110.59","0.02","90","","4004","2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C45 H61 B N Ni P -","- C45 H61 B N Ni P -","- C180 H244 B4 N4 Ni4 P4 -","4","1","","Aresta, Michele; Dibenedetto, Angela; Quaranta, Eugenio; Lanfranchi, Maurizio; Tiripicchio, Antonio","Oxidative Addition of Allylammonium BPh4-to Nickel(0): Synthesis, Crystal Structure, Fluxional Behavior, and Catalytic Activity of Chiral [(η3-allyl)(NH3)(PCy3)Ni]BPh4","Organometallics","2000","19","21","4199","","10.1021/om000383+","","","1.54184","CuKα","","0.2544","0.0546","","","0.0948","0.1462","","","","","","0.748","","","","has coordinates,has disorder","215307","2020-10-21","18:00:00",""
"4089303","7.44","0.001","8.572","0.002","17.645","0.003","97.63","0.02","95.37","0.02","111.85","0.01","1022.6","0.3","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H16 Cl5 O2 Re -","- C18 H16 Cl5 O2 Re -","- C36 H32 Cl10 O4 Re2 -","2","1","","Klahn, A. Hugo; Toro, Adriana; Oelckers, Beatriz; Buono-Core, Gonzalo E.; Manriquez, Victor; Wittke, Oscar","Intermolecular C−Cl Activation Reaction of (η5-C5R5)Re(CO)3(R = H, Me) with Pentachlorobenzene: X-ray Structure ofcis- andtrans-(η5-C5Me5)Re(CO)2(2,3,4,5-C6HCl4)Cl and Its Conversion to (η6-C5Me4CH2)Re(CO)2(2,3,4,5-C6HCl4)","Organometallics","2000","19","13","2580","","10.1021/om000032v","","","0.71073","MoKα","","0.0347","0.034","","","0.0899","0.0906","","","","","","1.077","","","","has coordinates","243605","2020-10-21","18:00:00",""
"4089304","8.581","0.002","13.252","0.003","18.272","0.004","90","","94.65","0.02","90","","2071","0.8","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H16 Cl5 O2 Re -","- C18 H16 Cl5 O2 Re -","- C72 H64 Cl20 O8 Re4 -","4","1","","Klahn, A. Hugo; Toro, Adriana; Oelckers, Beatriz; Buono-Core, Gonzalo E.; Manriquez, Victor; Wittke, Oscar","Intermolecular C−Cl Activation Reaction of (η5-C5R5)Re(CO)3(R = H, Me) with Pentachlorobenzene: X-ray Structure ofcis- andtrans-(η5-C5Me5)Re(CO)2(2,3,4,5-C6HCl4)Cl and Its Conversion to (η6-C5Me4CH2)Re(CO)2(2,3,4,5-C6HCl4)","Organometallics","2000","19","13","2580","","10.1021/om000032v","","","0.71073","MoKα","","0.0287","0.0229","","","0.0561","0.0605","","","","","","1.108","","","","has coordinates","243605","2020-10-21","18:00:00",""
"4089713","11.143","0.002","14.934","0.002","9.254","0.002","94.49","0.01","91.32","0.02","83.02","0.01","1523.7","0.5","293.2","","","","","","","","","","","4","P -1","-P 1","2","","","","- C32 H43 P3 Ru -","- C32 H43 P3 Ru -","- C64 H86 P6 Ru2 -","2","1","","Komiya, Sanshiro; Planas, Jose Giner; Onuki, Koji; Lu, Zhaobin; Hirano, Masafumi","Versatile Coordination Modes and Transformations of the Cyclooctatriene Ligand in Ru(C8H10)L3(L = Tertiary Phosphine)","Organometallics","2000","19","20","4051","","10.1021/om991014k","","","0.7107","MoKα","","","0.0427","","","","0.0389","","","","","","2.195","","","","has coordinates","244976","2020-10-21","18:00:00",""
"4115861","7.5278","0.0013","8.1269","0.0014","6.0546","0.0011","90","","90","","90","","370.41","0.11","107","2","107","2","","","","","","","","3","P b c m","-P 2c 2b","57","","","","- Cu0.32 Dy Te2 -","- Cu0.316 Dy Te2 -","- Cu1.264 Dy4 Te8 -","4","0.5","","Fu Qiang Huang; Paul Brazis; Carl R. Kannewurf; James A. Ibers","Syntheses, Structures, Physical Properties, and Theoretical Study of LaCu0.40Te2, NdCu0.37Te2, SmCu0.34Te2, GdCu0.33Te2, and DyCu0.32Te2","Journal of the American Chemical Society","2000","122","","80","86","10.1021/ja9919635","","","0.71073","MoKα","","0.0278","0.0229","","","0.0555","0.0574","","","","","","0.94","","","","has coordinates","178929","2020-10-21","18:00:00",""
"4115862","7.567","0.0015","8.211","0.0016","6.0893","0.0012","90","","90","","90","","378.34","0.13","107","2","107","2","","","","","","","","3","P b c m","-P 2c 2b","57","","","","- Cu0.33 Gd Te2 -","- Cu0.328 Gd Te2 -","- Cu1.312 Gd4 Te8 -","4","0.5","","Fu Qiang Huang; Paul Brazis; Carl R. Kannewurf; James A. Ibers","Syntheses, Structures, Physical Properties, and Theoretical Study of LaCu0.40Te2, NdCu0.37Te2, SmCu0.34Te2, GdCu0.33Te2, and DyCu0.32Te2","Journal of the American Chemical Society","2000","122","","80","86","10.1021/ja9919635","","","0.71073","MoKα","","0.033","0.023","","","0.0451","0.0487","","","","","","0.95","","","","has coordinates","178929","2020-10-21","18:00:00",""
"4115863","7.7063","0.0013","8.5882","0.0014","6.3115","0.001","90","","90","","90","","417.72","0.12","153","2","153","2","","","","","","","","3","P b c m","-P 2c 2b","57","","","","- Cu0.4 La Te2 -","- Cu0.404 La Te2 -","- Cu1.616 La4 Te8 -","4","0.5","","Fu Qiang Huang; Paul Brazis; Carl R. Kannewurf; James A. Ibers","Syntheses, Structures, Physical Properties, and Theoretical Study of LaCu0.40Te2, NdCu0.37Te2, SmCu0.34Te2, GdCu0.33Te2, and DyCu0.32Te2","Journal of the American Chemical Society","2000","122","","80","86","10.1021/ja9919635","","","0.71073","MoKα","","0.0299","0.0288","","","0.0745","0.075","","","","","","1.449","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115864","7.6349","0.0007","8.398","0.0008","6.1838","0.0006","90","","90","","90","","396.49","0.07","153","2","153","2","","","","","","","","3","P b c m","-P 2c 2b","57","","","","- Cu0.37 Nd Te2 -","- Cu0.372 Nd Te2 -","- Cu1.488 Nd4 Te8 -","4","0.5","","Fu Qiang Huang; Paul Brazis; Carl R. Kannewurf; James A. Ibers","Syntheses, Structures, Physical Properties, and Theoretical Study of LaCu0.40Te2, NdCu0.37Te2, SmCu0.34Te2, GdCu0.33Te2, and DyCu0.32Te2","Journal of the American Chemical Society","2000","122","","80","86","10.1021/ja9919635","","","0.71073","MoKα","","0.0208","0.0199","","","0.0484","0.0488","","","","","","1.215","","","","has coordinates","178929","2020-10-21","18:00:00",""
"4115865","7.6003","0.001","8.3085","0.0011","6.1412","0.0008","90","","90","","90","","387.8","0.09","153","2","153","2","","","","","","","","3","P b c m","-P 2c 2b","57","","","","- Cu0.34 Sm Te2 -","- Cu0.338 Sm Te2 -","- Cu1.352 Sm4 Te8 -","4","0.5","","Fu Qiang Huang; Paul Brazis; Carl R. Kannewurf; James A. Ibers","Syntheses, Structures, Physical Properties, and Theoretical Study of LaCu0.40Te2, NdCu0.37Te2, SmCu0.34Te2, GdCu0.33Te2, and DyCu0.32Te2","Journal of the American Chemical Society","2000","122","","80","86","10.1021/ja9919635","","","0.71073","MoKα","","0.0258","0.0253","","","0.0684","0.0687","","","","","","1.341","","","","has coordinates","178929","2020-10-21","18:00:00",""
"4115866","18.4753","0.0002","24.7873","0.0005","13.8827","0.0003","90","","103.98","0.001","90","","6169.3","0.2","188","2","188","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[Cu2(OH)(BPAN)](ClO4)3 (1).","","","- C24 H27 Cl3 Cu2 N6 O13 -","- C24 H25 Cl3 Cu2 N6 O13 -","- C192 H200 Cl24 Cu16 N48 O104 -","8","2","","Chuan He; Stephen J. Lippard","Modeling Carboxylate-Bridged Dinuclear Active Sites in Metalloenzymes Using a Novel Naphthyridine-Based Dinucleating Ligand","Journal of the American Chemical Society","2000","122","","184","185","10.1021/ja993125g","","","0.71073","MoKα","","0.0984","0.0541","","","0.1382","0.1594","","","","","","0.95","","","","has coordinates","178929","2020-10-21","18:00:00",""
"4115867","21.3905","0.0004","14.6381","0.0003","25.4813","0.0002","90","","90","","90","","7978.6","0.2","188","2","188","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","[Cu2(OH){(PhO)2PO2}(BPAN)](ClO4)2 (2).","","","- C36 H37 Cl2 Cu2 N6 O13 P -","- C36 H35 Cl2 Cu2 N6 O13 P -","- C288 H280 Cl16 Cu16 N48 O104 P8 -","8","1","","Chuan He; Stephen J. Lippard","Modeling Carboxylate-Bridged Dinuclear Active Sites in Metalloenzymes Using a Novel Naphthyridine-Based Dinucleating Ligand","Journal of the American Chemical Society","2000","122","","184","185","10.1021/ja993125g","","","0.71073","MoKα","","0.0828","0.0412","","","0.1114","0.1346","","","","","","0.859","","","","has coordinates","178929","2020-10-21","18:00:00",""
"4115868","20.6472","0.0005","13.1795","0.0002","28.9832","0.001","90","","91.723","0.001","90","","7883.3","0.4","188","2","188","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","[Ni2(OAc)2(BPAN)(CH3OH)](ClO4)2 (3'.CH3OH).","","","- C31 H44 Cl2 N6 Ni2 O15 -","- C31 H33 Cl2 N6 Ni2 O15 -","- C248 H264 Cl16 N48 Ni16 O120 -","8","1","","Chuan He; Stephen J. Lippard","Modeling Carboxylate-Bridged Dinuclear Active Sites in Metalloenzymes Using a Novel Naphthyridine-Based Dinucleating Ligand","Journal of the American Chemical Society","2000","122","","184","185","10.1021/ja993125g","","","0.71073","MoKα","","0.0726","0.0472","","","0.1463","0.1598","","","","","","1.105","","","","has coordinates","178929","2020-10-21","18:00:00",""
"4115869","24.6718","0.0002","11.072","0.0002","26.8327","0.0003","90","","109.207","0.001","90","","6921.78","0.16","188","2","188","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","[Co4(OH)4(BPAN)2](ClO4)4 (4.4CH3CN).","","","- C56 H68 Cl4 Co4 N16 O20 -","- C56 H52 Cl4 Co4 N16 O20 -","- C224 H208 Cl16 Co16 N64 O80 -","4","0.5","","Chuan He; Stephen J. Lippard","Modeling Carboxylate-Bridged Dinuclear Active Sites in Metalloenzymes Using a Novel Naphthyridine-Based Dinucleating Ligand","Journal of the American Chemical Society","2000","122","","184","185","10.1021/ja993125g","","","0.71073","MoKα","","0.0999","0.0602","","","0.159","0.1769","","","","","","1.107","","","","has coordinates","178929","2020-10-21","18:00:00",""
"4115870","14.6962","0.0006","14.7253","0.0007","20.2001","0.0009","90","","108.557","0.001","90","","4144.1","0.3","188","2","188","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","[Zn2(OH)(Ph2PO2)(BPAN)](ClO4)2 (5.H2O).","","","- C36 H39 Cl2 N6 O12 P Zn2 -","- C36 H29 Cl2 N6 O12 P Zn2 -","- C144 H116 Cl8 N24 O48 P4 Zn8 -","4","1","","Chuan He; Stephen J. Lippard","Modeling Carboxylate-Bridged Dinuclear Active Sites in Metalloenzymes Using a Novel Naphthyridine-Based Dinucleating Ligand","Journal of the American Chemical Society","2000","122","","184","185","10.1021/ja993125g","","","0.71073","MoKα","","0.1001","0.077","","","0.2141","0.2237","","","","","","1.65","","","","has coordinates,has disorder","178929","2020-10-21","18:00:00",""
"4115871","13.755","0.007","13.79","0.006","11.26","0.006","97.82","0.04","104.17","0.04","75","0.03","1994.2","1.8","113.2","","","","","","","","","","","7","P -1","-P 1","2","","","","- C36 H35 Mn O5 P2 Pt S -","- C36 H2 Mn O5 P2 Pt S -","- C72 H4 Mn2 O10 P4 Pt2 S2 -","2","1","","Sanshiro Komiya; Shin-ya Muroi; Masaki Furuya; Masafumi Hirano","Regio- and Stereoselective Insertion Reactions of Thiiranes into Pt-Mn (or Re) Bond in Organoplatinum-Manganese or -Rhenium Heterodinuclear Complexes as Intermediates toward Desulfurization Reaction","Journal of the American Chemical Society","2000","122","","170","171","10.1021/ja993185m","","","0.7107","MoKα","","","0.061","","","","0.0804","","","","","","2.918","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115872","16.12","0.01","16.238","0.007","12.232","0.003","102.01","0.02","91.19","0.04","88.27","0.06","3130","2","293.2","","","","","","","","","","","6","P -1","-P 1","2","","","","- C32 H27 Mn O5 P2 Pt -","- C32 H27 Mn O5 P2 Pt -","- C128 H108 Mn4 O20 P8 Pt4 -","4","2","","Sanshiro Komiya; Shin-ya Muroi; Masaki Furuya; Masafumi Hirano","Regio- and Stereoselective Insertion Reactions of Thiiranes into Pt-Mn (or Re) Bond in Organoplatinum-Manganese or -Rhenium Heterodinuclear Complexes as Intermediates toward Desulfurization Reaction","Journal of the American Chemical Society","2000","122","","170","171","10.1021/ja993185m","","","0.7107","MoKα","","","0.044","","","","0.073","","","","","","1.205","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115873","13.09","0.06","14.23","0.07","10.79","0.05","106.7","0.4","103.9","0.4","84.8","0.4","1868","16","113.2","","113.2","","","","","","","","","7","P -1","-P 1","2","","","","- C39 H38 Mn O5 P2 Pt S -","- C39 H36 Mn O5 P2 Pt S -","- C78 H72 Mn2 O10 P4 Pt2 S2 -","2","1","","Sanshiro Komiya; Shin-ya Muroi; Masaki Furuya; Masafumi Hirano","Regio- and Stereoselective Insertion Reactions of Thiiranes into Pt-Mn (or Re) Bond in Organoplatinum-Manganese or -Rhenium Heterodinuclear Complexes as Intermediates toward Desulfurization Reaction","Journal of the American Chemical Society","2000","122","","170","171","10.1021/ja993185m","","","0.7107","MoKα","","0.0789","0.0789","","","0.1075","0.1075","","","","","","1.78","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115874","12.624","0.0005","13.4087","0.0005","20.2605","0.0007","104.679","0.001","91.826","0.001","91.535","0.001","3313.7","0.2","223","2","223","2","","","","","","","","8","P -1","-P 1","2","","","","- C33 H64 F12 N6 O24 P4 Ru2 S6 -","- C33 H64 F12 N6 O24 P4 Ru2 S6 -","- C66 H128 F24 N12 O48 P8 Ru4 S12 -","2","1","","Md. Munkir Hossain; Yong-Shou Lin; Hiroyasu Sugiyama; Kazuko Matsumoto","Allylic C-H Bond Activation on a Sulfur Center of a Disulfide-Bridged Diruthenium Complex with Concomitant Formation of C-S Bonds","Journal of the American Chemical Society","2000","122","","172","173","10.1021/ja993402j","","","0.71073","MoKα","","0.0811","0.0536","","","0.144","0.1598","","","","","","0.99","","","","has coordinates","178929","2020-10-21","18:00:00",""
"4115875","19.43","0.006","22.858","0.007","16.741","0.004","99.99","0.02","93.68","0.02","104.92","0.02","7029","4","173.2","","","","","","","","","","","9","P -1","-P 1","2","","","","- C34 H69 Ag F24 N8 O12 P8 Ru2 S2 -","- C34 Ag F24 N8 O12 P8 Ru2 S2 -","- C136 Ag4 F96 N32 O48 P32 Ru8 S8 -","4","2","","Md. Munkir Hossain; Yong-Shou Lin; Hiroyasu Sugiyama; Kazuko Matsumoto","Allylic C-H Bond Activation on a Sulfur Center of a Disulfide-Bridged Diruthenium Complex with Concomitant Formation of C-S Bonds","Journal of the American Chemical Society","2000","122","","172","173","10.1021/ja993402j","","","0.7107","MoKα","","","0.0821","","","","0.104","","","","","","1.686","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115876","16.32","0.002","22.616","0.003","14.45","0.002","89.957","0.008","89.932","0.006","90.183","0.007","5333.4","1.2","153","","153","","","","","","","","","7","P -1","-P 1","2","","","","- C48 H72 B2 F8 N8 Ni2 O8 -","- C48 H48 B2 F8 N8 Ni2 O8 -","- C192 H192 B8 F32 N32 Ni8 O32 -","4","2","","Kazushi Shiren; Seiji Ogo; Shuhei Fujinami; Hideki Hayashi; Masatatsu Suzuki; Akira Uehara; Yoshihito Watanabe; Yoshihiko Moro-oka","Synthesis, Structures, and Properties of Bis(μ-oxo)nickel(III) and Bis(μ-superoxo)nickel(II) Complexes: An Unusual Conversion of a NiIII2(μ-O)2 Core into a NiII2(μ-OO)2 Core by H2O2 and Oxygenation of Ligand","Journal of the American Chemical Society","2000","122","","254","262","10.1021/ja990311d","","","0.7107","MoKα","","","0.115","","","0.1217","","","","","1.193","1.193","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115877","13.301","0.006","15.638","0.008","13.857","0.004","90","","104.17","0.02","90","","2795","2","157","","157","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C48 H72 B2 F8 N8 Ni2 O10 -","- C48 H66 B2 F8 N8 Ni2 O10 -","- C96 H132 B4 F16 N16 Ni4 O20 -","2","0.5","","Kazushi Shiren; Seiji Ogo; Shuhei Fujinami; Hideki Hayashi; Masatatsu Suzuki; Akira Uehara; Yoshihito Watanabe; Yoshihiko Moro-oka","Synthesis, Structures, and Properties of Bis(μ-oxo)nickel(III) and Bis(μ-superoxo)nickel(II) Complexes: An Unusual Conversion of a NiIII2(μ-O)2 Core into a NiII2(μ-OO)2 Core by H2O2 and Oxygenation of Ligand","Journal of the American Chemical Society","2000","122","","254","262","10.1021/ja990311d","","","0.7107","MoKα","","","0.0836","","","0.1218","","","","","1.683","1.683","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115878","12.916","0.003","17.394","0.003","11.7","0.003","107.22","0.02","108.63","0.02","84.53","0.02","2379.2","1","157","","157","","","","","","","","","6","P -1","-P 1","2","","","","- C45 H56 Cl2 N8 Ni2 O11 -","- C45 H56 Cl2 N8 Ni2 O11 -","- C90 H112 Cl4 N16 Ni4 O22 -","2","1","","Kazushi Shiren; Seiji Ogo; Shuhei Fujinami; Hideki Hayashi; Masatatsu Suzuki; Akira Uehara; Yoshihito Watanabe; Yoshihiko Moro-oka","Synthesis, Structures, and Properties of Bis(μ-oxo)nickel(III) and Bis(μ-superoxo)nickel(II) Complexes: An Unusual Conversion of a NiIII2(μ-O)2 Core into a NiII2(μ-OO)2 Core by H2O2 and Oxygenation of Ligand","Journal of the American Chemical Society","2000","122","","254","262","10.1021/ja990311d","","","0.7107","MoKα","","","0.0557","","","0.0955","","","","","1.654","1.654","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115879","23.0808","0.0002","25.9458","0.0009","13.4593","0.0005","90","","110.503","0.002","90","","7549.5","0.4","183","2","183","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Zn2DPD 2","","","- C79 H86 Cl2 N8 O3 Zn2 -","- C79 H86 Cl2 N8 O3 Zn2 -","- C316 H344 Cl8 N32 O12 Zn8 -","4","0.5","","Yongqi Deng; Christopher J. Chang; Daniel G. Nocera","Direct Observation of the ""Pac-Man"" Effect from Dibenzofuran-Bridged Cofacial Bisporphyrins","Journal of the American Chemical Society","2000","122","","410","411","10.1021/ja992955r","","","0.71073","MoKα","","0.1439","0.089","","","0.2391","0.2655","","","","","","1.124","","","","has coordinates","178929","2020-10-21","18:00:00",""
"4115880","13.896","0.002","15.476","0.003","33.44","0.007","90","","90","","90","","7191","2","183","2","183","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","Fe2DPDO 3","","","- C81 H84 Cl3 Fe2 N8 O4 -","- C81 H84 Cl3 Fe2 N8 O4 -","- C324 H336 Cl12 Fe8 N32 O16 -","4","1","","Yongqi Deng; Christopher J. Chang; Daniel G. Nocera","Direct Observation of the ""Pac-Man"" Effect from Dibenzofuran-Bridged Cofacial Bisporphyrins","Journal of the American Chemical Society","2000","122","","410","411","10.1021/ja992955r","","","0.71073","MoKα","","0.0455","0.042","","","0.1091","0.118","","","","","","1.153","","","","has coordinates","178929","2020-10-21","18:00:00",""
"4115881","11.2396","0.0001","20.2835","0.0004","26.6935","0.0004","90","","94.643","0.001","90","","6065.57","0.16","200","1","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","bis(1,3,5-tri-tert-butylbenzene)vanadium(1+) tetraphenylborate","","- C64 H84 B O V -","- C64 H84 B O V -","- C256 H336 B4 O4 V4 -","4","1","","Douglas C. Gordon; Laura Deakin; Atta M. Arif; Joel S. Miller","Identification of [MII(Arene)2]2+ (M = V, Cr) as the Key Intermediate in the Formation of V[TCNE]x.ySolvent Magnets and Cr[TCNE]x.Solvent","Journal of the American Chemical Society","2000","122","","290","299","10.1021/ja9929741","","","0.71069","MoKα","","0.0794","0.0638","","","0.175","0.1921","","","","","","1.063","","","","has coordinates","178929","2020-10-21","18:00:00",""
"4115882","11.0332","0.0003","18.3389","0.0005","22.7485","0.0007","90","","92.8691","0.0016","90","","4597.1","0.2","200","1","200","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","bis(1,3,5-tri-tert-butylbenzene)vanadium(1+) tetracyanoethanide","","- C48 H72 N4 O1.5 V -","- C48 H72 N4 O1.5 V -","- C192 H288 N16 O6 V4 -","4","1","","Douglas C. Gordon; Laura Deakin; Atta M. Arif; Joel S. Miller","Identification of [MII(Arene)2]2+ (M = V, Cr) as the Key Intermediate in the Formation of V[TCNE]x.ySolvent Magnets and Cr[TCNE]x.Solvent","Journal of the American Chemical Society","2000","122","","290","299","10.1021/ja9929741","","","0.71073","MoKα","","0.1195","0.0733","","","0.1717","0.1992","","","","","","1.046","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4115883","10.1818","0.0014","31.962","0.003","9.4921","0.0008","90","","90","","90","","3089","0.6","297","2","297","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C32 H41 N O4 Si -","- C32 H41 N O4 Si -","- C128 H164 N4 O16 Si4 -","4","1","","Katsuhiko Tomooka; Atsuo Nakazaki; Takeshi Nakai","A Novel Aryl Migration from Silicon to Carbon: An Efficient Approach to Asymmetric Synthesis of α-Aryl β-Hydroxy Cyclic Amines and Silanols","Journal of the American Chemical Society","2000","122","","408","409","10.1021/ja993295t","","","0.7107","MoKα","","0.0596","0.0527","","","0.1244","0.1285","","","","","","1.163","","","","has coordinates","178929","2020-10-21","18:00:00",""
"4115884","12.963","0.003","9.2062","0.0015","22.415","0.01","90","","102.65","0.04","90","","2610.1","1.4","297","2","297","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H37 N O4 Si -","- C26 H37 N O4 Si -","- C104 H148 N4 O16 Si4 -","4","1","","Katsuhiko Tomooka; Atsuo Nakazaki; Takeshi Nakai","A Novel Aryl Migration from Silicon to Carbon: An Efficient Approach to Asymmetric Synthesis of α-Aryl β-Hydroxy Cyclic Amines and Silanols","Journal of the American Chemical Society","2000","122","","408","409","10.1021/ja993295t","","","0.7107","MoKα","","0.0853","0.0758","","","0.1622","0.1673","","","","","","1.228","","","","has coordinates","178929","2020-10-21","18:00:00",""
"4115885","10.701","0.002","10.206","0.002","10.912","0.002","90","","101.978","0.004","90","","1165.8","0.4","213","2","213","2","","","","","","","synthesized","5","P 1 21/n 1","-P 2yn","14","","Tetrakisacetatodiacetonitriledichromium(II)","","- C16 H24 Cr2 N4 O8 -","- C16 H24 Cr2 N4 O8 -","- C32 H48 Cr4 N8 O16 -","2","0.5","","F. Albert Cotton; Elizabeth A. Hillard; Carlos A. Murillo; Hong-Cai Zhou","After 155 Years, A Crystalline Chromium Carboxylate with a Supershort Cr-Cr Bond","Journal of the American Chemical Society","2000","122","","416","417","10.1021/ja993755i","","","0.71073","MoKα","","0.0695","0.0527","","0.1688","0.1458","","","","1.096","1.117","1.117","","","","","has coordinates","178929","2020-10-21","18:00:00",""
"4115886","9.7448","0.0006","11.7879","0.0007","14.6524","0.0011","70.899","0.001","70.691","0.001","76.115","0.001","1484.52","0.17","110","2","110","2","","","","","","","synthesized","4","P -1","-P 1","2","none","Tetrakis(2,4,6-triisopropylbenzoicactato)dichromium(II)","","- C64 H92 Cr2 O8 -","- C64 H88 Cr2 O8 -","- C64 H88 Cr2 O8 -","1","0.5","","F. Albert Cotton; Elizabeth A. Hillard; Carlos A. Murillo; Hong-Cai Zhou","After 155 Years, A Crystalline Chromium Carboxylate with a Supershort Cr-Cr Bond","Journal of the American Chemical Society","2000","122","","416","417","10.1021/ja993755i","","","0.71073","MoKα","","0.0648","0.059","","0.1597","0.1519","","","","1.135","1.167","1.167","","","","","has coordinates","178929","2020-10-21","18:00:00",""
"4115887","14.445","0.002","16.618","0.002","17.529","0.002","65.918","0.002","74.912","0.002","82.713","0.003","3708.1","0.8","213","2","213","2","","","","","","","synthesized","6","P -1","-P 1","2","","Cr2(TPB)4(CH3CN)2,1.5CH2Cl2","","- C69.5 H101 Cl3 Cr2 N2 O8 -","- C69.5 H13 Cl3 Cr2 N2 O8 -","- C139 H26 Cl6 Cr4 N4 O16 -","2","1","","F. Albert Cotton; Elizabeth A. Hillard; Carlos A. Murillo; Hong-Cai Zhou","After 155 Years, A Crystalline Chromium Carboxylate with a Supershort Cr-Cr Bond","Journal of the American Chemical Society","2000","122","","416","417","10.1021/ja993755i","","","0.71073","MoKα","","0.1191","0.0909","","0.3019","0.2656","","","","1.039","1.143","1.143","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4115888","9.8985","0.0001","14.1558","0.0002","14.4381","0.0002","90.094","0.001","99.168","0.001","92.304","0.001","1995.56","0.04","295","2","295","2","","","","","","","","7","P -1","-P 1","2","","","","- C45 H35 Fe N3 O2 P2 S -","- C45 H35 Fe N3 O2 P2 S -","- C90 H70 Fe2 N6 O4 P4 S2 -","2","1","","Wen-Feng Liaw; Nan-Hung Lee; Chien-Hong Chen; Chien-Ming Lee; Gene-Hsiang Lee; Shie-Ming Peng","Dinuclear and Mononuclear Iron(II)-Thiolate Complexes with Mixed CO/CN-Ligands: Synthetic Advances for Iron Sites of [Fe]-Only Hydrogenases","Journal of the American Chemical Society","2000","122","","488","494","10.1021/ja992300q","","","0.71073","MoKα","","0.1219","0.0859","","0.1338","0.1237","","","","1.225","1.331","1.331","","","","","has coordinates","178929","2020-10-21","18:00:00",""
"4115889","24.4494","0.0003","12.2321","0.0002","31.6646","0.0003","90","","96.737","0.001","90","","9404.5","0.2","295","2","295","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C50 H45 Fe N6 O2 P2 S2 -","- C50 H45 Fe N6 O2 P2 S2 -","- C400 H360 Fe8 N48 O16 P16 S16 -","8","1","","Wen-Feng Liaw; Nan-Hung Lee; Chien-Hong Chen; Chien-Ming Lee; Gene-Hsiang Lee; Shie-Ming Peng","Dinuclear and Mononuclear Iron(II)-Thiolate Complexes with Mixed CO/CN-Ligands: Synthetic Advances for Iron Sites of [Fe]-Only Hydrogenases","Journal of the American Chemical Society","2000","122","","488","494","10.1021/ja992300q","","","0.71073","MoKα","","0.0857","0.0578","","0.1484","0.1323","","","","1.063","1.134","1.134","","","","","has coordinates,has disorder","178929","2020-10-21","18:00:00",""
"4115890","10.8873","0.0015","17.574","0.002","24.673","0.004","90","","92.059","0.012","90","","4717.7","1.1","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C98 H86 Cl4 Fe2 N4 O4 P4 S4 -","- C98 H86 Cl4 Fe2 N4 O4 P4 S4 -","- C196 H172 Cl8 Fe4 N8 O8 P8 S8 -","2","0.5","","Wen-Feng Liaw; Nan-Hung Lee; Chien-Hong Chen; Chien-Ming Lee; Gene-Hsiang Lee; Shie-Ming Peng","Dinuclear and Mononuclear Iron(II)-Thiolate Complexes with Mixed CO/CN-Ligands: Synthetic Advances for Iron Sites of [Fe]-Only Hydrogenases","Journal of the American Chemical Society","2000","122","","488","494","10.1021/ja992300q","","","0.71073","MoKα","","0.1195","0.0698","","0.2546","0.2192","","","","1.096","1.236","1.236","","","","","has coordinates","178929","2020-10-21","18:00:00",""
"4115891","13.8327","0.0003","18.5925","0.0002","22.4398","0.0006","90","","98.962","0.001","90","","5700.7","0.2","213","2","213","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C80 H144 Cl2 N40 O50 S -","- C80 H84 Cl2 N40 O50 S -","- C160 H168 Cl4 N80 O100 S2 -","2","0.5","","Jaheon Kim; In-Sun Jung; Soo-Young Kim; Eunsung Lee; Jin-Koo Kang; Shigeru Sakamoto; Kentaro Yamaguchi; Kimoon Kim","New Cucurbituril Homologues: Syntheses, Isolation, Characterization, and X-ray Crystal Structures of Cucurbit[n]uril (n= 5, 7, and 8)","Journal of the American Chemical Society","2000","122","","540","541","10.1021/ja993376p","","","0.71073","MoKα","","0.1255","0.1023","","","0.2811","0.3113","","","","","","1.019","","","","has coordinates,has disorder","178929","2020-10-21","18:00:00",""
"4115892","13.2314","0.0008","18.8133","0.0012","14.0361","0.0009","90","","90","","90","","3494","0.4","188","2","188","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C30 H38 N20 O14 -","- C30 H34 N20 O14 -","- C120 H136 N80 O56 -","4","0.5","","Jaheon Kim; In-Sun Jung; Soo-Young Kim; Eunsung Lee; Jin-Koo Kang; Shigeru Sakamoto; Kentaro Yamaguchi; Kimoon Kim","New Cucurbituril Homologues: Syntheses, Isolation, Characterization, and X-ray Crystal Structures of Cucurbit[n]uril (n= 5, 7, and 8)","Journal of the American Chemical Society","2000","122","","540","541","10.1021/ja993376p","","","0.71073","MoKα","","0.0729","0.0543","","","0.1188","0.1303","","","","","","1.11","","","","has coordinates","178929","2020-10-21","18:00:00",""
"4115893","12.8547","0.0002","20.1325","0.0002","31.6616","0.0001","90","","92.588","0.001","90","","8185.58","0.15","188","2","188","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C46 H96 N28 O50 S4 -","- C46 H50 N28 O50 S4 -","- C184 H200 N112 O200 S16 -","4","1","","Jaheon Kim; In-Sun Jung; Soo-Young Kim; Eunsung Lee; Jin-Koo Kang; Shigeru Sakamoto; Kentaro Yamaguchi; Kimoon Kim","New Cucurbituril Homologues: Syntheses, Isolation, Characterization, and X-ray Crystal Structures of Cucurbit[n]uril (n= 5, 7, and 8)","Journal of the American Chemical Society","2000","122","","540","541","10.1021/ja993376p","","","0.71073","MoKα","","0.1495","0.1116","","","0.2859","0.3226","","","","","","1.076","","","","has coordinates,has disorder","178929","2020-10-21","18:00:00",""
"4115894","28.3805","0.0004","28.3805","0.0004","22.0986","0.0002","90","","90","","90","","17799.4","0.4","188","2","188","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C48 H112 N32 O54 S2 -","- C48 H48 N32 O53.6 S2 -","- C384 H384 N256 O428.8 S16 -","8","0.5","","Jaheon Kim; In-Sun Jung; Soo-Young Kim; Eunsung Lee; Jin-Koo Kang; Shigeru Sakamoto; Kentaro Yamaguchi; Kimoon Kim","New Cucurbituril Homologues: Syntheses, Isolation, Characterization, and X-ray Crystal Structures of Cucurbit[n]uril (n= 5, 7, and 8)","Journal of the American Chemical Society","2000","122","","540","541","10.1021/ja993376p","","","0.71073","MoKα","","0.112","0.1002","","","0.2747","0.2899","","","","","","1.042","","","","has coordinates,has disorder","178929","2020-10-21","18:00:00",""
"4115895","13.355","0.003","13.465","0.003","13.642","0.004","90.67","0.019","104.65","0.02","117.435","0.018","2082.9","1","173","2","173","2","","","","","","","","6","P -1","-P 1","2","tetrabenzo-24-crown-8-bis(1,2-dichlorethane)cesium nitrate hydrate","","","- C36 H42 Cl4 Cs N O12 -","- C36 H40 Cl4 Cs N O12.01 -","- C72 H80 Cl8 Cs2 N2 O24.02 -","2","1","","Tatiana G. Levitskaia; Jeffrey C. Bryan; Richard A. Sachleben; John D. Lamb; Bruce A. Moyer","A Surprising Host-Guest Relationship between 1,2-Dichloroethane and the Cesium Complex of Tetrabenzo-24-crown-8","Journal of the American Chemical Society","2000","122","","554","562","10.1021/ja992760j","","","0.71073","MoKα","","0.076","0.061","","","0.171","0.182","","","","","","1.07","","","","has coordinates,has disorder","178929","2020-10-21","18:00:00",""
"4115896","19.573","0.004","21.725","0.005","23.668","0.006","92.03","0.03","101.77","0.03","98.51","0.02","9722","4","293","2","220","2","","","","","","","","6","P -1","-P 1","2","","","","- C74 H135 Cl6 Mo6 N5 O16 -","- C67 Cl3 Mo6 N4.5 O16 -","- C268 Cl12 Mo24 N18 O64 -","4","2","","Joseph B. Strong; Glenn P. A. Yap; Robert Ostrander; Louise M. Liable-Sands; Arnold L. Rheingold; René Thouvenot; Pierre Gouzerh; Eric A. Maatta","A New Class of Functionalized Polyoxometalates: Synthetic, Structural, Spectroscopic, and Electrochemical Studies of Organoimido Derivatives of [Mo6O19]2-","Journal of the American Chemical Society","2000","122","","639","649","10.1021/ja9927974","","","0.71073","MoKα","","0.136","0.0965","","","0.1383","0.1507","","","","","","1.88","","","","has coordinates","178929","2020-10-21","18:00:00",""
"4115897","16.873","0.003","20.048","0.003","31.706","0.006","90","","90","","90","","10725","3","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C36 H81 Mo6 N3 O18 -","- C36 H81 Mo6 N3 O18 -","- C288 H648 Mo48 N24 O144 -","8","1","","Joseph B. Strong; Glenn P. A. Yap; Robert Ostrander; Louise M. Liable-Sands; Arnold L. Rheingold; René Thouvenot; Pierre Gouzerh; Eric A. Maatta","A New Class of Functionalized Polyoxometalates: Synthetic, Structural, Spectroscopic, and Electrochemical Studies of Organoimido Derivatives of [Mo6O19]2-","Journal of the American Chemical Society","2000","122","","639","649","10.1021/ja9927974","","","0.71073","MoKα","","0.1542","0.0695","","0.095","0.0746","","","","1.193","1.29","1.29","","","","","has coordinates","178929","2020-10-21","18:00:00",""
"4115898","59.94","0.04","15.486","0.013","28.99","0.02","90","","112.02","0.02","90","","24946","3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C96 H165 Cl4 Mo6 N7 O14 -","- C96 H165 Cl4 Mo6 N7 O14 -","- C768 H1320 Cl32 Mo48 N56 O112 -","8","1","","Joseph B. Strong; Glenn P. A. Yap; Robert Ostrander; Louise M. Liable-Sands; Arnold L. Rheingold; René Thouvenot; Pierre Gouzerh; Eric A. Maatta","A New Class of Functionalized Polyoxometalates: Synthetic, Structural, Spectroscopic, and Electrochemical Studies of Organoimido Derivatives of [Mo6O19]2-","Journal of the American Chemical Society","2000","122","","639","649","10.1021/ja9927974","","","0.71073","MoKα","","0.1818","0.117","","","0.3157","0.3839","","","","","","1.844","","","","has coordinates","178929","2020-10-21","18:00:00",""
"4115899","18.432","0.007","20.58","0.009","31.379","0.012","90","","90","","90","","11903","8","293","2","236","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C44 H89 Mo6 N3 O18 -","- C44 H89 Mo6 N3 O18 -","- C352 H712 Mo48 N24 O144 -","8","1","","Joseph B. Strong; Glenn P. A. Yap; Robert Ostrander; Louise M. Liable-Sands; Arnold L. Rheingold; René Thouvenot; Pierre Gouzerh; Eric A. Maatta","A New Class of Functionalized Polyoxometalates: Synthetic, Structural, Spectroscopic, and Electrochemical Studies of Organoimido Derivatives of [Mo6O19]2-","Journal of the American Chemical Society","2000","122","","639","649","10.1021/ja9927974","","","0.71073","MoKα","","0.1491","0.078","","0.128","0.1056","","","","1.386","1.7","1.7","","","","","has coordinates","178929","2020-10-21","18:00:00",""
"4115900","27.327","0.003","29.127","0.002","16.025","0.002","90","","90.56","0.01","90","","12755","2","298.2","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C75 H147 Cl3 N36 O36 Zn6 -","- C75 H39 Cl3 N36 O36 Zn6 -","- C300 H156 Cl12 N144 O144 Zn24 -","4","1","","Shin Aoki; Motoo Shiro; Tohru Koike; Eiichi Kimura","Three-Dimensional Supermolecules Assembled from a Tris(Zn2±cyclen) Complex and Di- and Trianionic Cyanuric Acid in Aqueous Solution (Cyclen = 1,4,7,10-Tetraazacyclododecane)","Journal of the American Chemical Society","2000","122","","576","584","10.1021/ja993352i","","","0.7107","MoKα","","","0.091","","","","0.11","","","","","","1.783","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4115901","23.43","0.004","23.43","0.004","23.43","0.004","90","","90","","90","","12862","4","298.2","","","","","","","","","","","5","I -4 3 m","I -4 2 3","217","","","","- C144 H344 N72 O88 Zn12 -","- C120 N51.215 O38.25 Zn6 -","- C240 N102.43 O76.5 Zn12 -","2","0.0416667","","Shin Aoki; Motoo Shiro; Tohru Koike; Eiichi Kimura","Three-Dimensional Supermolecules Assembled from a Tris(Zn2±cyclen) Complex and Di- and Trianionic Cyanuric Acid in Aqueous Solution (Cyclen = 1,4,7,10-Tetraazacyclododecane)","Journal of the American Chemical Society","2000","122","","576","584","10.1021/ja993352i","","","0.7107","MoKα","","","0.0677","","","","0.0864","","","","","","1.617","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4115902","18.729","0.004","11.758","0.002","12.061","0.002","90","","91.73","0.03","90","","2654.8","0.8","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H28 Br2 N2 O -","- C30 H26 Br2 N2 O -","- C120 H104 Br8 N8 O4 -","4","1","","Hormuzd R. Mulla; Arthur Cammers-Goodwin","Stability of a Minimalist, Aromatic Cluster in Aqueous Mixtures of Fluoro Alcohol","Journal of the American Chemical Society","2000","122","","738","739","10.1021/ja993363b","","","0.71073","MoKα","","0.0607","0.043","","0.0982","0.09","","","","1.059","1.11","1.11","","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115903","9.04","0.002","7.918","0.002","19.345","0.004","90","","92.17","0.03","90","","1383.7","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H30 Br2 N2 O2 -","- C30 H30 Br2 N2 O2 -","- C60 H60 Br4 N4 O4 -","2","0.5","","Hormuzd R. Mulla; Arthur Cammers-Goodwin","Stability of a Minimalist, Aromatic Cluster in Aqueous Mixtures of Fluoro Alcohol","Journal of the American Chemical Society","2000","122","","738","739","10.1021/ja993363b","","","0.71073","MoKα","","0.0404","0.0331","","0.0794","0.0762","","","","1.03","1.065","1.065","","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115904","9.628","0.002","10.144","0.004","17.6252","0.0019","81.719","0.018","84.37","0.04","68.62","0.03","1584.3","0.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C29 H30 Cl4 N3 O4 P -","- C29 H30 Cl4 N3 O4 P -","- C58 H60 Cl8 N6 O8 P2 -","2","1","","Sudha Kumaraswamy; C. Muthiah; K. C. Kumara Swamy","Characterization of Stereoisomers of Spirophosphoranes Bearing an Eight-Membered Ring: Implications on Apicophilicity in Trigonal Bipyramidal Phosphorus","Journal of the American Chemical Society","2000","122","","964","965","10.1021/ja992304v","","","0.71073","MoKα","","0.0418","0.0341","","","0.1013","0.1096","","","","","","1.11","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4115905","11.326","0.006","12.984","0.004","15.124","0.008","105.69","0.05","110.74","0.05","94.71","0.05","1963","1.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H43 Cl4 O4 P -","- C42 H43 Cl4 O4 P -","- C84 H86 Cl8 O8 P2 -","2","1","","Sudha Kumaraswamy; C. Muthiah; K. C. Kumara Swamy","Characterization of Stereoisomers of Spirophosphoranes Bearing an Eight-Membered Ring: Implications on Apicophilicity in Trigonal Bipyramidal Phosphorus","Journal of the American Chemical Society","2000","122","","964","965","10.1021/ja992304v","","","0.71073","MoKα","","0.0868","0.0509","","","0.1353","0.1604","","","","","","1.09","","","","has coordinates,has disorder","201982","2020-10-21","18:00:00",""
"4115906","11.656","0.006","12.354","0.009","13.738","0.004","82.49","0.03","79.47","0.03","85.56","0.05","1925.3","1.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C38.5 H38 Cl5 O4 P S -","- C38.5 H34 Cl5 O4 P S -","- C77 H68 Cl10 O8 P2 S2 -","2","1","","Sudha Kumaraswamy; C. Muthiah; K. C. Kumara Swamy","Characterization of Stereoisomers of Spirophosphoranes Bearing an Eight-Membered Ring: Implications on Apicophilicity in Trigonal Bipyramidal Phosphorus","Journal of the American Chemical Society","2000","122","","964","965","10.1021/ja992304v","","","0.71073","MoKα","","0.106","0.0753","","","0.1828","0.2435","","","","","","1.051","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115907","10.444","0.007","13.6216","0.0015","14.8438","0.0018","65.909","0.01","78.6","0.02","71.82","0.02","1825.5","1.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C37 H41 Cl4 O4 P -","- C37 H41 Cl4 O4 P -","- C74 H82 Cl8 O8 P2 -","2","1","","Sudha Kumaraswamy; C. Muthiah; K. C. Kumara Swamy","Characterization of Stereoisomers of Spirophosphoranes Bearing an Eight-Membered Ring: Implications on Apicophilicity in Trigonal Bipyramidal Phosphorus","Journal of the American Chemical Society","2000","122","","964","965","10.1021/ja992304v","","","0.71073","MoKα","","0.0738","0.0466","","","0.117","0.1346","","","","","","1.093","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4115908","10.841","0.002","13.382","0.003","15.039","0.003","64.55","0.03","84.89","0.03","70.72","0.03","1856","0.9","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C37 H42 Cl4 N O4 P -","- C37 H42 Cl4 N O4 P -","- C74 H84 Cl8 N2 O8 P2 -","2","1","","Sudha Kumaraswamy; C. Muthiah; K. C. Kumara Swamy","Characterization of Stereoisomers of Spirophosphoranes Bearing an Eight-Membered Ring: Implications on Apicophilicity in Trigonal Bipyramidal Phosphorus","Journal of the American Chemical Society","2000","122","","964","965","10.1021/ja992304v","","","0.71073","MoKα","","0.1542","0.0597","","","0.1523","0.2056","","","","","","1.067","","","","has coordinates,has disorder","178930","2020-10-21","18:00:00",""
"4115909","12.205","0.003","26.86","0.003","14.048","0.003","90","","91.01","0.02","90","","4604.6","1.6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C47 H45 Cl4 N O4 P2 -","- C47 H45 Cl4 N O4 P2 -","- C188 H180 Cl16 N4 O16 P8 -","4","1","","Sudha Kumaraswamy; C. Muthiah; K. C. Kumara Swamy","Characterization of Stereoisomers of Spirophosphoranes Bearing an Eight-Membered Ring: Implications on Apicophilicity in Trigonal Bipyramidal Phosphorus","Journal of the American Chemical Society","2000","122","","964","965","10.1021/ja992304v","","","0.71073","MoKα","","0.1645","0.0792","","","0.2158","0.2911","","","","","","1.04","","","","has coordinates,has disorder","201982","2020-10-21","18:00:00",""
"4115910","18.583","0.003","8.395","0.001","27.732","0.003","90","","107.69","0.01","90","","4121.7","1","203.2","","203.2","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C46 H11 Cu F20 N4 O -","- C46 H11 Cu F20 N4 O -","- C184 H44 Cu4 F80 N16 O4 -","4","1","","Hiroyuki Furuta; Hiromitsu Maeda; Atsuhiro Osuka","Doubly N-Confused Porphyrin: A New Complexing Agent Capable of Stabilizing Higher Oxidation States","Journal of the American Chemical Society","2000","122","","803","807","10.1021/ja992679g","","","0.7107","MoKα","","0.0587","0.0587","","0.0919","","0.0919","","","1.299","","","1.299","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115911","18.685","0.003","8.528","0.003","27.886","0.004","90","","107","","90","","4249.4","1.8","296.2","","296.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C46 H14 F20 N4 O -","- C46 H14 F20 N4 O -","- C184 H56 F80 N16 O4 -","4","1","","Hiroyuki Furuta; Hiromitsu Maeda; Atsuhiro Osuka","Doubly N-Confused Porphyrin: A New Complexing Agent Capable of Stabilizing Higher Oxidation States","Journal of the American Chemical Society","2000","122","","803","807","10.1021/ja992679g","","","0.7107","MoKα","","0.062","0.062","","0.056","","0.056","","","1.834","","","1.83","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115912","18.734","0.003","8.324","0.001","27.674","0.003","90","","107.84","0.01","90","","4108","1","123.2","","123.2","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C46 H11 Ag F20 N4 O -","- C46 H11 Ag F20 N4 O -","- C184 H44 Ag4 F80 N16 O4 -","4","1","","Hiroyuki Furuta; Hiromitsu Maeda; Atsuhiro Osuka","Doubly N-Confused Porphyrin: A New Complexing Agent Capable of Stabilizing Higher Oxidation States","Journal of the American Chemical Society","2000","122","","803","807","10.1021/ja992679g","","","0.7107","MoKα","","0.0706","0.071","","0.075","","0.075","","","1.613","","","1.61","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115913","24.797","0.006","8.594","0.002","5.6891","0.0009","90","","90","","90","","1212.4","0.4","293","2","293","2","","","","","","","","3","C m c m","-C 2c 2","63","","","","- Sb7 Ti2.68 Zr4.32 -","- Sb7 Ti2.68 Zr4.32 -","- Sb28 Ti10.72 Zr17.28 -","4","0.25","","Holger Kleinke","Zr1-xTixSb: A Novel Antimonide on the Quasibinary Section ZrSb-TiSb with a Complex Crystal Structure Exhibiting Linear Sb Chains and Fragments of the TiSb Structure","Journal of the American Chemical Society","2000","122","","853","860","10.1021/ja993423d","","","0.71073","MoKα","","0.1149","0.0365","","0.0787","0.0679","","","","0.592","0.838","0.838","","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115914","24.658","0.002","8.5431","0.0008","5.6754","0.0005","90","","90","","90","","1195.56","0.18","293","2","293","2","","","","","","","","3","C m c m","-C 2c 2","63","","","","- Sb7 Ti3.34 Zr3.66 -","- Sb7 Ti3.332 Zr3.668 -","- Sb28 Ti13.328 Zr14.672 -","4","0.25","","Holger Kleinke","Zr1-xTixSb: A Novel Antimonide on the Quasibinary Section ZrSb-TiSb with a Complex Crystal Structure Exhibiting Linear Sb Chains and Fragments of the TiSb Structure","Journal of the American Chemical Society","2000","122","","853","860","10.1021/ja993423d","","","0.71073","MoKα","","0.0511","0.0293","","0.0569","0.055","","","","0.748","0.914","0.914","","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115915","24.558","0.002","8.5206","0.0009","5.6669","0.0005","90","","90","","90","","1185.79","0.19","293","2","293","2","","","","","","","","3","C m c m","-C 2c 2","63","","","","- Sb7 Ti3.84 Zr3.16 -","- Sb7 Ti3.848 Zr3.152 -","- Sb28 Ti15.392 Zr12.608 -","4","0.25","","Holger Kleinke","Zr1-xTixSb: A Novel Antimonide on the Quasibinary Section ZrSb-TiSb with a Complex Crystal Structure Exhibiting Linear Sb Chains and Fragments of the TiSb Structure","Journal of the American Chemical Society","2000","122","","853","860","10.1021/ja993423d","","","0.71073","MoKα","","0.0496","0.029","","0.06","0.0579","","","","0.769","0.932","0.932","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115916","12.375","0.0006","15.0495","0.0006","15.9682","0.0007","73.682","0.001","79.643","0.001","72.099","0.001","2701.7","0.2","203","2","203","2","","","","","","","","3","P -1","-P 1","2","","","","- C64 H56 S4 -","- C64 H56 S4 -","- C128 H112 S8 -","2","1","","Michael J. Marsella; In Tae Kim; Fook Tham","Toward Conjugated Double Helical Ladder Polymers: Cyclooctatetrathiophene as a Highly Versatile Double Helical Scaffold","Journal of the American Chemical Society","2000","122","","974","975","10.1021/ja9939340","","","0.71073","MoKα","","0.0669","0.0442","","","0.1153","0.1276","","","","","","1.042","","","","has coordinates,has disorder","178930","2020-10-21","18:00:00",""
"4115917","9.641","0.001","10.608","0.001","10.587","0.001","90","","111.98","0.01","90","","1004.05","0.18","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C14 H33 N2 P Si2 -","- C14 H33 N2 P Si2 -","- C28 H66 N4 P2 Si4 -","2","1","","Tsuyoshi Kato; Heinz Gornitzka; Antoine Baceiredo; Andreas Savin; Guy Bertrand","On the Electronic Structure of (Phosphino)(silyl)carbenes: Single-Crystal X-ray Diffraction and ELF Analyses","Journal of the American Chemical Society","2000","122","","998","999","10.1021/ja9939542","","","0.71073","MoKα","","0.063","0.0354","","","0.074","0.083","","","","","","0.935","","","","has coordinates,has disorder","178930","2020-10-21","18:00:00",""
"4115918","11.507","0.007","12.917","0.002","13.209","0.005","67.93","0.05","87.42","0.04","84.94","0.06","1812.2","1.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C33 H39 Cl4 N2 O4 P -","- C33 H36 Cl4 N2 O4 P -","- C66 H72 Cl8 N4 O8 P2 -","2","1","","Sudha Kumaraswamy; C. Muthiah; K. C. Kumara Swamy","Characterization of Stereoisomers of Spirophosphoranes Bearing an Eight-Membered Ring: Implications on Apicophilicity in Trigonal Bipyramidal Phosphorus","Journal of the American Chemical Society","2000","122","","964","965","10.1021/ja992304v","","","0.71073","MoKα","","0.0621","0.0414","","","0.1222","0.1426","","","","","","1.108","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115919","19.3979","0.0004","19.3979","0.0004","11.3278","0.0003","90","","90","","90","","4262.41","0.17","125","","125","","","","","","","","","6","I 4","I 4","79","","","","- C44 H108 Cl8 N6 O33 V12 -","- C44 H108 Cl8 N6 O33 V12 -","- C88 H216 Cl16 N12 O66 V24 -","2","0.25","","N. Kawanami; T. Ozeki; A. Yagasaki","NO-Anion Trapped in a Molecular Oxide Bowl","Journal of the American Chemical Society","2000","122","","1239","1240","10.1021/ja993539+","","","0.71073","MoKα","","0.0325","0.0286","","","0.0745","0.0757","","","","","","1.084","","","","has coordinates,has disorder","178930","2020-10-21","18:00:00",""
"4115920","9.1582","0.0018","10.905","0.002","14.564","0.005","103.8","0.02","100.23","0.02","105.08","0.013","1318.6","0.6","293","2","293","2","","","","","","","synthesis","5","P -1","-P 1","2","","Pentacarbonyl[3-dimethylamino-5-(2-furyl)-1,2-dimethoxycarbonyl-2,4- pentadien-1-yliden]chromium (0)","","- C20 H17 Cr N O10 -","- C21 H17 Cl3 Cr N O10 -","- C42 H34 Cl6 Cr2 N2 O20 -","2","1","","José Barluenga; Fernando Aznar; Ignacio Gutiérrez; Alfredo Martín; Santiago García-Granda; M. Amparo Llorca-Baragaño","First Stepwise Dötz Reaction: Isolation and Characterization of a Chelated Metallatriene Intermediate. Influence of Its Pattern of Substitution in Product Partition","Journal of the American Chemical Society","2000","122","","1314","1324","10.1021/ja991865j","","","0.71073","MoKα","","0.0998","0.0429","","","0.1102","0.1226","","","","","","1.287","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115921","12.408","0.002","12.505","0.003","17.771","0.004","103.19","0.03","91.56","0.03","104.95","0.03","2582.9","1.1","173","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H44 Cl4 N20 O23 Pt3 -","- C30 H29 Cl4 N20 O23 Pt3 -","- C60 H58 Cl8 N40 O46 Pt6 -","2","1","","Ralf-Dieter Schnebeck; Eva Freisinger; Frank Glahé; Bernhard Lippert","Molecular Architecture Based on Metal Triangles Derived from 2,2'-Bipyrazine (Bpz) and EnMII (M = Pt, Pd)","Journal of the American Chemical Society","2000","122","","1381","1390","10.1021/ja9931325","","","0.71069","MoKα","","0.0875","0.0577","","","0.1423","0.153","","","","","","1.026","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115922","15.363","0.003","18.948","0.004","21.679","0.004","89.95","0.03","75.24","0.03","86","0.03","6087","2","123","2","123","2","","","","","","","","7","P -1","-P 1","2","","","","- C60 H105 F48 N40 O22.5 P8 Pt6 -","- C60 H84 F48 N40 O22.5 P8 Pt6 -","- C120 H168 F96 N80 O45 P16 Pt12 -","2","1","","Ralf-Dieter Schnebeck; Eva Freisinger; Frank Glahé; Bernhard Lippert","Molecular Architecture Based on Metal Triangles Derived from 2,2'-Bipyrazine (Bpz) and EnMII (M = Pt, Pd)","Journal of the American Chemical Society","2000","122","","1381","1390","10.1021/ja9931325","","","0.71069","MoKα","","0.125","0.0731","","0.2223","0.1872","","","","1.019","1.15","1.15","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4115923","8.878","0.002","10.223","0.002","10.313","0.002","62.44","0.03","77.18","0.03","69.93","0.03","777.2","0.4","163","2","163","2","","","","","","","","5","P -1","-P 1","2","","","","- C10 H14 N8 O6 Pt -","- C10 H14 N8 O6 Pt -","- C20 H28 N16 O12 Pt2 -","2","1","","Ralf-Dieter Schnebeck; Eva Freisinger; Frank Glahé; Bernhard Lippert","Molecular Architecture Based on Metal Triangles Derived from 2,2'-Bipyrazine (Bpz) and EnMII (M = Pt, Pd)","Journal of the American Chemical Society","2000","122","","1381","1390","10.1021/ja9931325","","","0.71069","MoKα","","0.0462","0.0313","","0.1496","0.0727","","","","1.033","1.062","1.062","","","","","has coordinates,has disorder","178930","2020-10-21","18:00:00",""
"4115924","16.992","0.003","23.817","0.005","21.944","0.004","90","","95.19","0.03","90","","8844","3","126","2","126","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C36 H74 F30 N31 O25 P5 Pt6 -","- C36 H66 F30 N31 O25 P5 Pt6 -","- C144 H264 F120 N124 O100 P20 Pt24 -","4","1","","Ralf-Dieter Schnebeck; Eva Freisinger; Frank Glahé; Bernhard Lippert","Molecular Architecture Based on Metal Triangles Derived from 2,2'-Bipyrazine (Bpz) and EnMII (M = Pt, Pd)","Journal of the American Chemical Society","2000","122","","1381","1390","10.1021/ja9931325","","","0.71073","MoKα","","0.1168","0.0774","","0.2338","0.2063","","","","1.059","1.224","1.224","","","","","has coordinates,has disorder","178930","2020-10-21","18:00:00",""
"4115925","16.977","0.003","22.705","0.005","22.734","0.005","90","","93.74","0.03","90","","8744","3","133","2","133","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C36 H76 F48 N28 O17 P8 Pd6 -","- C36 H66 F48 N28 O17 P8 Pd6 -","- C144 H264 F192 N112 O68 P32 Pd24 -","4","1","","Ralf-Dieter Schnebeck; Eva Freisinger; Frank Glahé; Bernhard Lippert","Molecular Architecture Based on Metal Triangles Derived from 2,2'-Bipyrazine (Bpz) and EnMII (M = Pt, Pd)","Journal of the American Chemical Society","2000","122","","1381","1390","10.1021/ja9931325","","","0.71069","MoKα","","0.1095","0.0506","","0.1341","0.1115","","","","0.898","1.119","1.119","","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115926","16.92","0.003","24.099","0.005","22.146","0.004","90","","95.18","0.03","90","","8993","3","143","2","143","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C36 H85.5 F30 N31 O30.75 P5 Pd3 Pt3 -","- C36 H58 F30 N31 O30.75 P5 Pd3 Pt3 -","- C144 H232 F120 N124 O123 P20 Pd12 Pt12 -","4","1","","Ralf-Dieter Schnebeck; Eva Freisinger; Frank Glahé; Bernhard Lippert","Molecular Architecture Based on Metal Triangles Derived from 2,2'-Bipyrazine (Bpz) and EnMII (M = Pt, Pd)","Journal of the American Chemical Society","2000","122","","1381","1390","10.1021/ja9931325","","","0.71069","MoKα","","0.1161","0.0937","","0.2583","0.2266","","","","1.112","1.209","1.209","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4115927","14.936","0.003","13.216","0.003","31.407","0.006","90","","95.43","0.03","90","","6172","2","114","2","114","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C30 H57.5 Ag F12 N23 O22.75 P2 Pt3 -","- C30 H42 Ag F12 N23 O22.75 P2 Pt3 -","- C120 H168 Ag4 F48 N92 O91 P8 Pt12 -","4","1","","Ralf-Dieter Schnebeck; Eva Freisinger; Frank Glahé; Bernhard Lippert","Molecular Architecture Based on Metal Triangles Derived from 2,2'-Bipyrazine (Bpz) and EnMII (M = Pt, Pd)","Journal of the American Chemical Society","2000","122","","1381","1390","10.1021/ja9931325","","","0.71073","MoKα","","0.1058","0.0528","","0.1702","0.1276","","","","0.94","1.121","1.121","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4115928","15.03","0.003","22.002","0.004","20.016","0.004","90","","99.04","0.03","90","","6537","2","123","2","123","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C30 H64 Ag2 N26 O35 Pt3 -","- C30 H36 Ag2 N26 O35 Pt3 -","- C120 H144 Ag8 N104 O140 Pt12 -","4","1","","Ralf-Dieter Schnebeck; Eva Freisinger; Frank Glahé; Bernhard Lippert","Molecular Architecture Based on Metal Triangles Derived from 2,2'-Bipyrazine (Bpz) and EnMII (M = Pt, Pd)","Journal of the American Chemical Society","2000","122","","1381","1390","10.1021/ja9931325","","","0.71069","MoKα","","0.1235","0.0801","","0.2513","0.2023","","","","1.016","1.118","1.118","","","","","has coordinates,has disorder","178930","2020-10-21","18:00:00",""
"4115929","7.418","0.001","11.056","0.002","12.63","0.002","87.225","0.004","74.044","0.003","85.097","0.003","991.9","0.3","163","2","163","2","","","","","","","","6","P -1","-P 1","2","[(N-(phosphonomethyl)-aza-18-crown-6*H2O))2*ClO4]","","","- C26 H61 Cl N2 O22 P2 -","- C26 H61 Cl N2 O22 P2 -","- C26 H61 Cl N2 O22 P2 -","1","0.5","","C. V. Krishnamohan Sharma; Abraham Clearfield","""Macrocyclic Leaflets""","Journal of the American Chemical Society","2000","122","","1558","1559","10.1021/ja9938377","","","0.71073","MoKα","","0.0567","0.0498","","","0.1322","0.1395","","","","","","1.083","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115930","17.136","0.002","20.818","0.003","20.858","0.003","90","","104.937","0.002","90","","7189.4","1.7","110","","110","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[Cd4(N-(phosphonomethyl)-aza-18-crown-6*H2O))3*(H2O)5(NO3)4][NO3]","","","- C39 H97 Cd4 N8 O47 P3 -","- C39 H81 Cd4 N8 O47 P3 -","- C156 H324 Cd16 N32 O188 P12 -","4","1","","C. V. Krishnamohan Sharma; Abraham Clearfield","""Macrocyclic Leaflets""","Journal of the American Chemical Society","2000","122","","1558","1559","10.1021/ja9938377","","","0.71073","MoKα","","0.3459","0.0687","","","0.1335","0.1982","","","","","","0.719","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115931","13.982","0.005","18.416","0.004","22.753","0.004","90","","100.19","0.02","90","","5766","3","294.2","","294.2","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C60 H57 Cl3 Mo N3 O P4 -","- C60 H57 Cl3 Mo N3 O P4 -","- C240 H228 Cl12 Mo4 N12 O4 P16 -","4","1","","Yoshiaki Tanabe; Hidetake Seino; Youichi Ishii; Masanobu Hidai","Reaction Mechanism of the C\τbN Triple Bond Cleavage of β-Ketonitriles on a Molybdenum(0) Center1","Journal of the American Chemical Society","2000","122","","1690","1699","10.1021/ja9921928","","","0.7107","MoKα","","0.0516","0.0516","","","0.035","0.035","","","","","","1.632","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115932","9.8581","0.0009","13.628","0.002","25.851","0.003","102.97","0.01","96.791","0.009","104.099","0.009","3227","0.7","294.2","","294.2","","","","","","","","","6","P -1","-P 1","2","","","","- C72 H76 Mo N2 O2 P4 -","- C72 H67 Mo N2 O2 P4 -","- C144 H134 Mo2 N4 O4 P8 -","2","1","","Yoshiaki Tanabe; Hidetake Seino; Youichi Ishii; Masanobu Hidai","Reaction Mechanism of the C\τbN Triple Bond Cleavage of β-Ketonitriles on a Molybdenum(0) Center1","Journal of the American Chemical Society","2000","122","","1690","1699","10.1021/ja9921928","","","0.7107","MoKα","","0.063","0.063","","","0.0411","0.0411","","","","","","1.974","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115933","14.983","0.002","15.11","0.003","16.682","0.003","107.7","0.02","102.01","0.01","96.98","0.02","3449.3","1.2","294.2","","294.2","","","","","","","","","9","P -1","-P 1","2","","","","- C71 H61 Cl2 F3 Mo N2 O5 P4 S -","- C71 H61 Cl2 F3 Mo N2 O5 P4 S -","- C142 H122 Cl4 F6 Mo2 N4 O10 P8 S2 -","2","1","","Yoshiaki Tanabe; Hidetake Seino; Youichi Ishii; Masanobu Hidai","Reaction Mechanism of the C\τbN Triple Bond Cleavage of β-Ketonitriles on a Molybdenum(0) Center1","Journal of the American Chemical Society","2000","122","","1690","1699","10.1021/ja9921928","","","0.7107","MoKα","","0.0689","0.0689","","","0.0557","0.0557","","","","","","2.407","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115934","12.22","0.001","12.22","","28.927","0.003","90","","90","","120","","3740.9","0.5","293","2","293","2","","","","","","","","6","R -3 :H","-R 3","148","","(K-crypt)2Bi2","","- C36 H72 Bi2 K2 N4 O12 -","- C36 H72 Bi2 K2 N4 O12 -","- C108 H216 Bi6 K6 N12 O36 -","3","0.166667","","Li Xu; Svilen Bobev; Jaouad El-Bahraoui; Slavi C. Sevov","A Naked Diatomic Molecule of Bismuth, [Bi2]2-, with a Short Bi-Bi Bond: Synthesis and Structure","Journal of the American Chemical Society","2000","122","","1838","1839","10.1021/ja992422i","","","0.71073","MoKα","","0.0341","0.0283","","","0.0682","0.0712","","","","","","1.077","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115935","10.224","0.002","10.476","0.003","10.024","0.003","116.84","0.02","93.15","0.02","83.69","0.02","952.2","0.5","298","","","","","","","","","","","4","P 1","P 1","1","","","","- C45 H47 N O5 -","- C45 H47 N O5 -","- C45 H47 N O5 -","1","1","","Hiroyuki Hosomi; Shigeru Ohba; Koichi Tanaka; Fumio Toda","The First in Situ Observation of Intramolecular Rotation and Cyclization of Anilide by an X-ray Study: Partial Single-Crystal to Single-Crystal Photocyclization of N-Methyl-N-{(E)-methylmethacryloyl}anilide in Inclusion Crystals","Journal of the American Chemical Society","2000","122","","1818","1819","10.1021/ja992437g","","","0.71073","MoKα","","","0.068","","","","0.172","","","","","","1.7","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4115936","10.283","0.001","10.295","0.001","10.141","0.001","118.29","0.01","92.79","0.01","84","0.01","940.16","0.18","300","","","","","","","","","","","4","P 1","P 1","1","","","","- C45 H47 N O5 -","- C45 H47 N O5 -","- C45 H47 N O5 -","1","1","","Hiroyuki Hosomi; Shigeru Ohba; Koichi Tanaka; Fumio Toda","The First in Situ Observation of Intramolecular Rotation and Cyclization of Anilide by an X-ray Study: Partial Single-Crystal to Single-Crystal Photocyclization of N-Methyl-N-{(E)-methylmethacryloyl}anilide in Inclusion Crystals","Journal of the American Chemical Society","2000","122","","1818","1819","10.1021/ja992437g","","","0.71073","MoKα","","","0.056","","","","0.092","","","","","","1.15","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115937","6.2674","0.0012","24.787","0.005","11.381","0.002","90","","103.639","0.003","90","","1718.2","0.6","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","8,8,9,9,10,10-hexafluoro-trans-1,2,4,14-tetramethyl-3,15-dithiatetracyclo[10 .3. pentadeca-4,6(7),11(12),13-tetraene 3-(2-(2,5-dimethyl(3-thienyl))-3,3,4,4,5,5-hexafluorocyclopent-1-enyl)-2,5-d imethylthiophene","","- C17 H14 F6 S2 -","- C17 H14 F6 S2 -","- C68 H56 F24 S8 -","4","1","","Taro Yamada; Seiya Kobatake; Keishi Muto; Masahiro Irie","X-ray Crystallographic Study on Single-Crystalline Photochromism of Bis(2,5-dimethyl-3-thienyl)perfluorocyclopentene","Journal of the American Chemical Society","2000","122","","1589","1592","10.1021/ja993289x","","","0.71073","MoKα","","0.0647","0.0433","","","0.1028","0.1106","","","","","","1.093","","","","has coordinates,has disorder","178930","2020-10-21","18:00:00",""
"4115938","6.2192","0.0009","24.52","0.004","11.3026","0.0016","90","","103.667","0.003","90","","1674.8","0.4","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","8,8,9,9,10,10-hexafluoro-trans-1,2,4,14-tetramethyl-3,15-dithiatetracyclo[10 .3.0 pentadeca-4,6(7),11(12),13-tetraene","","- C17 H14 F6 S2 -","- C17 H14 F6 S2 -","- C68 H56 F24 S8 -","4","1","","Taro Yamada; Seiya Kobatake; Keishi Muto; Masahiro Irie","X-ray Crystallographic Study on Single-Crystalline Photochromism of Bis(2,5-dimethyl-3-thienyl)perfluorocyclopentene","Journal of the American Chemical Society","2000","122","","1589","1592","10.1021/ja993289x","","","0.71073","MoKα","","0.0516","0.0395","","","0.0976","0.1022","","","","","","1.046","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115939","24.861","0.01","12.129","0.003","12.258","0.006","90","","117.482","0.019","90","","3279","2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C35 H46 N4 O4 -","- C35 H46 N4 O4 -","- C140 H184 N16 O16 -","4","0.5","","Natia L. Frank; Rodolphe Clérac; Jean-Pascal Sutter; Nathalie Daro; Olivier Kahn; Claude Coulon; Michael T. Green; Stéphane Golhen; Lahcène Ouahab","Synthesis, Crystal Structure, Magnetic, and Electron Paramagnetic Resonance Properties of a Spiroconjugated Biradical. Evidence for Spiroconjugation Exchange Pathway","Journal of the American Chemical Society","2000","122","","2053","2061","10.1021/ja993071a","","","0.71073","MoKα","","0.2025","0.0612","","","0.1232","0.1628","","","","","","0.988","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115940","10.6091","0.0003","16.4474","0.0007","10.6701","0.0004","90","","116.877","0.002","90","","1660.73","0.11","203.2","","203.2","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C36 H44 Li N O3 Si -","- C36 H44 Li N O3 Si -","- C72 H88 Li2 N2 O6 Si2 -","2","1","","Atsushi Kawachi; Kohei Tamao","Structures of [(Amino)phenylsilyl]lithiums and Related Compounds in Solution and in the Solid State","Journal of the American Chemical Society","2000","122","","1919","1926","10.1021/ja993101+","","","0.7107","MoKα","","","0.0556","","","0.0802","","","","","1.209","1.209","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115941","9.562","0.003","20.869","0.003","10.136","0.002","90","","104.42","0.02","90","","1958.9","0.8","293.2","","293.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H20 F N Si -","- C24 H20 F N Si -","- C96 H80 F4 N4 Si4 -","4","1","","Atsushi Kawachi; Kohei Tamao","Structures of [(Amino)phenylsilyl]lithiums and Related Compounds in Solution and in the Solid State","Journal of the American Chemical Society","2000","122","","1919","1926","10.1021/ja993101+","","","1.5418","CuKα","","0","0","","","0","0.058","","","","","","1.84","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115942","10.413","0.002","12.8154","0.0007","9.74","0.002","97.081","0.01","92.01","0.02","86.315","0.008","1286.7","0.4","293.2","","293.2","","","","","","","","","5","P -1","-P 1","2","","","","- C27 H29 N Si Sn -","- C27 N Si Sn -","- C54 N2 Si2 Sn2 -","2","1","","Atsushi Kawachi; Kohei Tamao","Structures of [(Amino)phenylsilyl]lithiums and Related Compounds in Solution and in the Solid State","Journal of the American Chemical Society","2000","122","","1919","1926","10.1021/ja993101+","","","1.5418","CuKα","","0.0421","0.0421","","","0.0697","0.0697","","","","","","1.547","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115943","9.4557","0.0005","20.739","0.001","10.0569","0.0006","90","","103.887","0.003","90","","1914.53","0.18","203.2","","203.2","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H21 N Si -","- C24 H N Si -","- C96 H4 N4 Si4 -","4","1","","Atsushi Kawachi; Kohei Tamao","Structures of [(Amino)phenylsilyl]lithiums and Related Compounds in Solution and in the Solid State","Journal of the American Chemical Society","2000","122","","1919","1926","10.1021/ja993101+","","","0.7107","MoKα","","0.0617","0.0617","","","0.0908","0.0908","","","","","","1.151","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115944","4.319","0.007","12.198","0.008","15.287","0.007","90","","94.6","0.1","90","","802.8","1.5","193.2","","193.2","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H14 O4 Te2 -","- C16 H14 O4 Te2 -","- C32 H28 O8 Te4 -","2","0.5","","Osamu Niyomura; Shinzi Kato; Satoshi Inagaki","An Unusual Planar Diacyl Ditelluride (2-MeOC6H4COTe)2: The Origin of Its Planarity","Journal of the American Chemical Society","2000","122","","2132","2133","10.1021/ja993120j","","","0.7107","MoKα","","0.0631","0.0631","","","0.0767","0.0767","","","","","","3.941","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115945","21.786","0.004","15.756","0.002","8.818","0.003","90","","90","","90","","3026.9","1.2","193.2","","193.2","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C16 H14 O4 S2 -","- C16 H14 O4 S2 -","- C128 H112 O32 S16 -","8","1","","Osamu Niyomura; Shinzi Kato; Satoshi Inagaki","An Unusual Planar Diacyl Ditelluride (2-MeOC6H4COTe)2: The Origin of Its Planarity","Journal of the American Chemical Society","2000","122","","2132","2133","10.1021/ja993120j","","","0.7107","MoKα","","0.0492","0.0492","","","0.0506","0.0506","","","","","","1.13","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115946","8.2734","0.0007","26.44","0.003","8.1081","0.0006","92.194","0.009","115.366","0.006","85.14","0.009","1596.9","0.3","193.2","","193.2","","","","","","","","","4","P -1","-P 1","2","","","","- C16 H14 O4 Se2 -","- C16 H14 O4 Se2 -","- C64 H56 O16 Se8 -","4","2","","Osamu Niyomura; Shinzi Kato; Satoshi Inagaki","An Unusual Planar Diacyl Ditelluride (2-MeOC6H4COTe)2: The Origin of Its Planarity","Journal of the American Chemical Society","2000","122","","2132","2133","10.1021/ja993120j","","","0.7107","MoKα","","0.0333","0.0333","","","0.0332","0.0331","","","","","","1.377","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115947","14.3274","0.0007","14.8789","0.0008","17.3698","0.0009","75.701","0.003","85.431","0.003","68.56","0.003","3339.6","0.3","150","2","150","2","","","","","","","","8","P -1","-P 1","2","","","","- C68 H45 B Cl3 F24 Fe3 N Si -","- C68 H45 B Cl3 F24 Fe3 N Si -","- C136 H90 B2 Cl6 F48 Fe6 N2 Si2 -","2","1","","Mark J. MacLachlan; Sara C. Bourke; Alan J. Lough; Ian Manners","Ring-Opening Protonolysis of Strained Silicon-Containing Rings: A New Approach to Ions with Silylium Character","Journal of the American Chemical Society","2000","122","","2126","2127","10.1021/ja993602v","","","0.71073","MoKα","","0.0893","0.0595","","0.1623","0.142","","","","1.017","1.082","1.082","","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115948","6.8294","0.0004","13.6781","0.0009","17.5898","0.0012","90","","90.666","0.001","90","","1643.01","0.18","173","2","173","2","","","","","","","Prof. P. Kaszynski - Vanderbilt University","4","P 1 21/n 1","-P 2yn","14","99003a","","","- C17 H17 N5 S -","- C17 H17 N5 S -","- C68 H68 N20 S4 -","4","1","","Piotr Kaszynski; Victor G. Young","Nucleophile-Induced Intramolecular Dipole 1,5-Transfer and 1,6-Cyclization: Experimental and ab Initio Studies of Formation, Thermolysis, and Molecular and Electronic Structures of 3,6-Diphenyl-1-propanesulfenimido-1,2,4,5-tetrazine","Journal of the American Chemical Society","2000","122","","2087","2095","10.1021/ja993884z","","","0.71073","MoKα","","0.0498","0.0323","","0.0819","0.0775","","","","1.031","1.14","1.14","","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115949","10.013","0.005","19.02","0.01","15.34","0.01","90","","106.32","0.03","90","","2804","3","135.2","","135.2","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C65 H70 Ga Li O10 -","- C65 H68 Ga Li O10 -","- C130 H136 Ga2 Li2 O20 -","2","1","","Shigeki Matsunaga; Jagattaran Das; Jochen Roels; Erasmus M. Vogl; Noriyoshi Yamamoto; Takehiko Iida; Kentaro Yamaguchi; Masakatsu Shibasaki","Catalytic Enantioselectivemeso-Epoxide Ring Opening Reaction with Phenolic Oxygen Nucleophile Promoted by Gallium Heterobimetallic Multifunctional Complexes","Journal of the American Chemical Society","2000","122","","2252","2260","10.1021/ja993650f","","","0.7107","MoKα","","0.0665","0.0665","","","0.0771","0.077","","","","","","2.842","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115950","11.325","0.001","20.915","0.002","19.786","0.001","90","","92.951","0.006","90","","4680.3","0.7","300","2","300","2","","","","","","","synthesis","7","P 1 21/n 1","-P 2yn","14","","","","- C41.125 H34.25 B Cl4.25 Co3 F4 N12 -","- C41.13 H32.26 B Cl4.26 Co3 F4 N12 -","- C164.52 H129.04 B4 Cl17.04 Co12 F16 N48 -","4","1","","Rodolphe Clérac; F. Albert Cotton; Kim R. Dunbar; Tongbu Lu; Carlos A. Murillo; Xiaoping Wang","A New Linear Tricobalt Compound with Di(2-pyridyl)amide (dpa) Ligands: Two-Step Spin Crossover of [Co3(dpa)4Cl2][BF4]","Journal of the American Chemical Society","2000","122","","2272","2278","10.1021/ja994051b","","","0.71073","MoKα","","0.0846","0.0666","","0.1715","0.1541","","","","1.054","1.093","1.093","","","","","has coordinates,has disorder","178930","2020-10-21","18:00:00",""
"4115951","11.3249","0.0007","20.759","0.001","19.422","0.001","90","","93.061","0.001","90","","4559.5","0.4","100","2","113","2","","","","","","","synthesis","7","P 1 21/n 1","-P 2yn","14","","","","- C41.5 H35 B Cl5 Co3 F4 N12 -","- C41.5 H32 B Cl5 Co3 F4 N12 -","- C166 H128 B4 Cl20 Co12 F16 N48 -","4","1","","Rodolphe Clérac; F. Albert Cotton; Kim R. Dunbar; Tongbu Lu; Carlos A. Murillo; Xiaoping Wang","A New Linear Tricobalt Compound with Di(2-pyridyl)amide (dpa) Ligands: Two-Step Spin Crossover of [Co3(dpa)4Cl2][BF4]","Journal of the American Chemical Society","2000","122","","2272","2278","10.1021/ja994051b","","","0.71073","MoKα","","0.0828","0.0609","","0.1484","0.1337","","","","1.107","1.248","1.248","","","","","has coordinates,has disorder","198632","2020-10-21","18:00:00",""
"4115952","11.3999","0.0007","20.913","0.001","19.752","0.001","90","","92.954","0.003","90","","4702.7","0.4","213","2","213","2","","","","","","","synthesis","7","P 1 21/n 1","-P 2yn","14","","","","- C42 H36 B Cl6 Co3 F4 N12 -","- C42 H32 B Cl6 Co3 F4 N12 -","- C168 H128 B4 Cl24 Co12 F16 N48 -","4","1","","Rodolphe Clérac; F. Albert Cotton; Kim R. Dunbar; Tongbu Lu; Carlos A. Murillo; Xiaoping Wang","A New Linear Tricobalt Compound with Di(2-pyridyl)amide (dpa) Ligands: Two-Step Spin Crossover of [Co3(dpa)4Cl2][BF4]","Journal of the American Chemical Society","2000","122","","2272","2278","10.1021/ja994051b","","","0.71073","MoKα","","0.0695","0.0573","","0.1443","0.1317","","","","1.067","1.076","1.076","","","","","has coordinates,has disorder","178930","2020-10-21","18:00:00",""
"4115953","8.358","0.002","17.716","0.003","20.249","0.003","90","","98.83","0.02","90","","2962.7","1","298.2","","298.2","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H18 F12 Mn N3 O5 -","- C24 H18 F12 Mn N3 O5 -","- C96 H72 F48 Mn4 N12 O20 -","4","1","","Tetsuji Itoh; Kenji Matsuda; Hiizu Iwamura; Kenzi Hori","Tris[p-(N-oxyl-N-tert-butylamino)phenyl]amine, -methyl, and -borane Have Doublet, Triplet, and Doublet Ground States, Respectively","Journal of the American Chemical Society","2000","122","","2567","2576","10.1021/ja9920819","","","1.5418","CuKα","","0.0741","0.0741","","","0.0759","0.0759","","","","","","2.79","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115954","18.4189","0.001","18.4189","0.001","16.2309","0.0009","90","","90","","120","","4768.7","0.5","105","1","105","1","","","","","","","see text","7","P 3","P 3","143","","Λ‒Tris(2,2'-bibpyridyl)ruthenium(II)Δ‒Tris(2,2'-bibpyridyl)osmium(II) Tetra(hexafluorophosphate)","","- C180 H144 F72 N36 Os3 P12 Ru3 -","- C180 H144 F72 N36 Os3 P12 Ru3 -","- C180 H144 F72 N36 Os3 P12 Ru3 -","1","0.333333","","Josef Breu; Cornelius Kratzer; Hartmut Yersin","Crystal Engineering as a Tool for Directed Radiationless Energy Transfer in Layered {Λ-[Ru(bpy)3]Δ-[Os(bpy)3]}(PF6)4","Journal of the American Chemical Society","2000","122","","2548","2555","10.1021/ja993104m","","","0.71069","MoKα","","0.0299","0.0243","","","0.0503","0.0513","","","","","","0.947","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115955","10.7012","0.0005","10.7012","0.0005","16.349","0.001","90","","90","","120","","1621.39","0.15","203","","203","2","","","","","","","see text","7","P 3 2 1","P 3 2""","150","","Λambda‒Tris(2,2'-bibpyridyl)ruthenium(II) Δelta‒Tris(2,2'-bibpyridyl)osmium(II) Tetra(hexafluorophosphate)","","- C60 H48 F24 N12 Os P4 Ru -","- C60 H48 F24 N12 Os P4 Ru -","- C60 H48 F24 N12 Os P4 Ru -","1","0.166667","","Josef Breu; Cornelius Kratzer; Hartmut Yersin","Crystal Engineering as a Tool for Directed Radiationless Energy Transfer in Layered {Λ-[Ru(bpy)3]Δ-[Os(bpy)3]}(PF6)4","Journal of the American Chemical Society","2000","122","","2548","2555","10.1021/ja993104m","","","0.71069","MoKα","","0.0313","0.0252","","","0.047","0.048","","","","","","0.862","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115956","19.579","0.003","20.88","0.004","40.705","0.008","90","","103.673","0.009","90","","16169","5","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C120 H124 N48 O36 Pd6 -","- C175 H124 N40 O12 Pd6 -","- C700 H496 N160 O48 Pd24 -","4","1","","Shu-Yan Yu; Takahiro Kusukawa; Kumar Biradha; Makoto Fujita","Hydrophobic Assembling of a Coordination Nanobowl into a Dimeric Capsule Which Can Accommodate up to Six Large Organic Molecules","Journal of the American Chemical Society","2000","122","","2665","2666","10.1021/ja994014k","","","0.71073","MoKα","","0.3558","0.1127","","","0.2368","0.3239","","","","","","1.025","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115957","20.182","0.007","36.508","0.013","25.441","0.009","90","","100.079","0.007","90","","18456","11","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C126 H132 N48 O36 Pd6 -","- C175 H132 N38 O6 Pd6 -","- C700 H528 N152 O24 Pd24 -","4","1","","Shu-Yan Yu; Takahiro Kusukawa; Kumar Biradha; Makoto Fujita","Hydrophobic Assembling of a Coordination Nanobowl into a Dimeric Capsule Which Can Accommodate up to Six Large Organic Molecules","Journal of the American Chemical Society","2000","122","","2665","2666","10.1021/ja994014k","","","0.71073","MoKα","","0.2554","0.1471","","","0.322","0.3508","","","","","","1.558","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115958","21.048","0.011","21.23","0.011","24.507","0.012","83.098","0.011","73.547","0.011","74.541","0.011","10111","9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C120 H124 N48 O36 Pd6 -","- C157 N39 O19 Pd6 -","- C314 N78 O38 Pd12 -","2","1","","Shu-Yan Yu; Takahiro Kusukawa; Kumar Biradha; Makoto Fujita","Hydrophobic Assembling of a Coordination Nanobowl into a Dimeric Capsule Which Can Accommodate up to Six Large Organic Molecules","Journal of the American Chemical Society","2000","122","","2665","2666","10.1021/ja994014k","","","0.71073","MoKα","","0.2747","0.118","","","0.3124","0.3513","","","","","","1.374","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115959","9.7438","0.0003","16.3262","0.0006","12.3331","0.0004","90","","97.117","0.001","90","","1946.82","0.11","173","2","173","2","","","","","","","synthetic","7","P 1 21/n 1","-P 2yn","14","","","","- C6 H32 Co2 N6 O16 Re6 S8 -","- C6 Co2 N6 O16 Re6 S8 -","- C12 Co4 N12 O32 Re12 S16 -","2","0.5","","Laurance G. Beauvais; Matthew P. Shores; Jeffrey R. Long","Cyano-Bridged Re~6~Q~8~ (Q = S, Se) Cluster-Cobalt(II) Framework Materials: Versatile Solid Chemical Sensors","Journal of the American Chemical Society","2000","122","","2763","2772","10.1021/ja994186h","","","0.71073","MoKα","","0.0433","0.0267","","0.0544","0.0514","","","","0.993","1.062","1.062","","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115960","26.546","0.0011","27.3516","0.0009","18.2899","0.0008","90","","91.178","0.002","90","","13277","0.9","293","2","293","2","","","","","","","synthetic","7","C 1 2/c 1","-C 2yc","15","","","","- C18 H120 Co6 N18 O60 Re18 Se24 -","- C18 Co6 N18 O60 Re18 Se24 -","- C72 Co24 N72 O240 Re72 Se96 -","4","0.5","","Laurance G. Beauvais; Matthew P. Shores; Jeffrey R. Long","Cyano-Bridged Re~6~Q~8~ (Q = S, Se) Cluster-Cobalt(II) Framework Materials: Versatile Solid Chemical Sensors","Journal of the American Chemical Society","2000","122","","2763","2772","10.1021/ja994186h","","","0.71073","MoKα","","0.1746","0.0731","","0.1587","0.1237","","","","0.998","1.13","1.13","","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115961","6.4383","0.001","10.498","0.002","19.571","0.003","90","","90","","90","","1322.8","0.4","150","","150","","","","","","","","see text","5","P 21 21 21","P 2ac 2ab","19","","","","- C11 H13 Cl2 O3 P -","- C11 H13 Cl2 O3 P -","- C44 H52 Cl8 O12 P4 -","4","1","","Ron Hulst; Johanna M. Visser; Robert W. J. Zijlstra; Huub Kooijman; Wilberth Smeets; Anthony L. Spek; Ben L. Feringa","Formation of Diphosphates. A NMR Study on the Mechanism and Stereochemistry of Diphosphate Formation from Chiral Dioxaphosphorinanes","Journal of the American Chemical Society","2000","122","","3135","3150","10.1021/ja992770k","","","0.71073","MoKα","","0.0241","0.0228","","","0.0582","0.059","","","","","","1.059","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115962","6.4799","0.001","17.165","0.002","17.189","0.002","90","","90","","90","","1911.9","0.4","295","","295","","","","","","","","see text","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H25 O4 P -","- C20 H25 O4 P -","- C80 H100 O16 P4 -","4","1","","Ron Hulst; Johanna M. Visser; Robert W. J. Zijlstra; Huub Kooijman; Wilberth Smeets; Anthony L. Spek; Ben L. Feringa","Formation of Diphosphates. A NMR Study on the Mechanism and Stereochemistry of Diphosphate Formation from Chiral Dioxaphosphorinanes","Journal of the American Chemical Society","2000","122","","3135","3150","10.1021/ja992770k","","","0.71073","MoKα","","0.1531","0.0511","","","0.0867","0.1001","","","","","","0.923","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115963","12.417","0.0012","12.417","0.0012","10.912","0.002","90","","90","","120","","1457","0.3","295","","295","","","","","","","","see text","5","P 31","P 31","144","","","","- C19 H24 N O3 P -","- C19 H24 N O3 P -","- C57 H72 N3 O9 P3 -","3","1","","Ron Hulst; Johanna M. Visser; Robert W. J. Zijlstra; Huub Kooijman; Wilberth Smeets; Anthony L. Spek; Ben L. Feringa","Formation of Diphosphates. A NMR Study on the Mechanism and Stereochemistry of Diphosphate Formation from Chiral Dioxaphosphorinanes","Journal of the American Chemical Society","2000","122","","3135","3150","10.1021/ja992770k","","","1.54184","CuKα","","0.0907","0.0631","","","0.152","0.1678","","","","","","0.983","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115964","11.6187","0.0007","12.1293","0.0008","13.932","0.0011","78.198","0.008","67.611","0.008","63.935","0.007","1629.1","0.2","293","","","","","","","","","","see text","5","P -1","-P 1","2","","","","- C34 H40 Lu N Si3 -","- C34 H40 Lu N Si3 -","- C68 H80 Lu2 N2 Si6 -","2","1","","Jörg Eppinger; Michael Spiegler; Wolfgang Hieringer; Wolfgang A. Herrmann; Reiner Anwander","C2-Symmetric ansa-Lanthanidocene Complexes. Synthesis via Silylamine Elimination and β-SiH Agostic Rigidity","Journal of the American Chemical Society","2000","122","","3080","3096","10.1021/ja992786a","","","0.71073","MoKα","","0.0459","0.0332","","","0.0744","0.0769","","","","","","0.916","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115965","9.529","0.001","11.145","0.001","13.573","0.001","79.68","0.01","83.26","0.01","77.61","0.01","1380.4","0.2","193","","193","","","","","","","","see text","5","P -1","-P 1","2","","","","- C24 H44 La N Si3 -","- C24 H44 La N Si3 -","- C48 H88 La2 N2 Si6 -","2","1","","Jörg Eppinger; Michael Spiegler; Wolfgang Hieringer; Wolfgang A. Herrmann; Reiner Anwander","C2-Symmetric ansa-Lanthanidocene Complexes. Synthesis via Silylamine Elimination and β-SiH Agostic Rigidity","Journal of the American Chemical Society","2000","122","","3080","3096","10.1021/ja992786a","","","0.71073","MoKα","","0.0291","0.0247","","","0.0594","0.0605","","","","","","1.037","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115966","15.11","0.004","11.731","0.002","15.699","0.005","90","","108.55","0.01","90","","2638.2","1.2","163","","163","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C26 H36 N Si3 Y -","- C26 H36 N Si3 Y -","- C104 H144 N4 Si12 Y4 -","4","0.5","","Jörg Eppinger; Michael Spiegler; Wolfgang Hieringer; Wolfgang A. Herrmann; Reiner Anwander","C2-Symmetric ansa-Lanthanidocene Complexes. Synthesis via Silylamine Elimination and β-SiH Agostic Rigidity","Journal of the American Chemical Society","2000","122","","3080","3096","10.1021/ja992786a","","","0.71073","MoKα","","0.0318","0.0318","","0.0742","0.0742","","","","1.048","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115967","15.0153","0.0004","11.8938","0.0005","15.7695","0.0005","90","","108.145","0.002","90","","2676.21","0.16","273","","273","","","","","","","","see text","5","C 1 2/c 1","-C 2yc","15","","","","- C26 H36 Lu N Si3 -","- C26 H36 Lu N Si3 -","- C104 H144 Lu4 N4 Si12 -","4","0.5","","Jörg Eppinger; Michael Spiegler; Wolfgang Hieringer; Wolfgang A. Herrmann; Reiner Anwander","C2-Symmetric ansa-Lanthanidocene Complexes. Synthesis via Silylamine Elimination and β-SiH Agostic Rigidity","Journal of the American Chemical Society","2000","122","","3080","3096","10.1021/ja992786a","","","0.71073","MoKα","","0.0223","0.0206","","","0.0469","0.0474","","","","","","1.094","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115968","11.1193","0.0006","11.9449","0.0005","14.8399","0.0008","72.396","0.005","75.824","0.006","69.896","0.005","1742.24","0.17","193","","193","","","","","","","","","5","P -1","-P 1","2","","","","- C75 H88 N2 Si6 Y2 -","- C75 H88 N2 Si6 Y2 -","- C75 H88 N2 Si6 Y2 -","1","0.5","","Jörg Eppinger; Michael Spiegler; Wolfgang Hieringer; Wolfgang A. Herrmann; Reiner Anwander","C2-Symmetric ansa-Lanthanidocene Complexes. Synthesis via Silylamine Elimination and β-SiH Agostic Rigidity","Journal of the American Chemical Society","2000","122","","3080","3096","10.1021/ja992786a","","","0.71073","MoKα","","0.0358","0.0358","","0.0944","0.0944","","","","0.973","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115969","12.601","0.001","7.572","0.005","14.497","0.002","90","","102.83","0.03","90","","1348.7","0.9","293","2","293","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C22 H28 Cl4 N4 O4 Pt -","- C22 H28 Cl4 N4 O4 Pt -","- C44 H56 Cl8 N8 O8 Pt2 -","2","0.5","","Gabriele Wagner; Armando J. L. Pombeiro; Vadim Yu. Kukushkin","Platinum(IV)-Assisted [2 + 3] Cycloaddition of Nitrones to Coordinated Organonitriles. Synthesis of Δ4-1,2,4-Oxadiazolines","Journal of the American Chemical Society","2000","122","","3106","3111","10.1021/ja993564f","","","0.71073","MoKα","","0.0288","0.0287","","","0.0755","0.0756","","","","","","1.155","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115970","11.4456","0.0002","18.5241","0.0002","14.3865","0.0002","90","","103.141","0.0008","90","","2970.35","0.07","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C68 H48 Cl N O3 P4 Pd2 -","- C68 H48 Cl N O3 P4 Pd2 -","- C136 H96 Cl2 N2 O6 P8 Pd4 -","2","0.5","","Nicole L. Coalter; Thomas E. Concolino; William E. Streib; Chris G. Hughes; Arnold L. Rheingold; Jeffrey M. Zaleski","Structure and Thermal Reactivity of a Novel Pd(0) Metalloenediyne","Journal of the American Chemical Society","2000","122","","3112","3117","10.1021/ja9944094","","","0.71073","MoKα","","0.1338","0.1277","","","0.4027","0.4067","","","","","","3.54","","","","has coordinates,has disorder","178930","2020-10-21","18:00:00",""
"4115971","18.158","0.003","9.0659","0.0013","9.6297","0.0011","90","","92.14","0.01","90","","1584.1","0.4","293","2","293","2","","","","","","","","3","C 1 2 1","C 2y","5","","tetranaphthalene acetonitrile solvent","","- C42 H27 N -","- C42 H24 N -","- C84 H48 N2 -","2","0.5","","Andrzej Rajca; Andrej Safronov; Suchada Rajca; Jirawat Wongsriratanakul","D2-Symmetric Dimer of 1,1'-Binaphthyl and Its Chiral π-Conjugated Carbodianion","Journal of the American Chemical Society","2000","122","","3351","3357","10.1021/ja993286k","","","0.71073","MoKα","","0.0662","0.0456","","","0.1183","0.1318","","","","","","1.012","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115972","10.929","0.003","15.212","0.007","25.523","0.009","90","","101.033","0.013","90","","4165","3","263","2","263","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H45 Eu N16 O13 -","- C28 H45 Eu N16 O13 -","- C112 H180 Eu4 N64 O52 -","4","1","","Myrtil L. Kahn; Jean-Pascal Sutter; Stéphane Golhen; Philippe Guionneau; Lahcène Ouahab; Olivier Kahn; Daniel Chasseau","Systematic Investigation of the Nature of The Coupling between a Ln(III) Ion (Ln = Ce(III) to Dy(III)) and Its Aminoxyl Radical Ligands. Structural and Magnetic Characteristics of a Series of {Ln(organic radical)2} Compounds and the Related {Ln(Nitrone)2} Derivatives","Journal of the American Chemical Society","2000","122","","3413","3421","10.1021/ja994175o","","","0.71073","MoKα","","0.0728","0.0406","","","0.1055","0.133","","","","","","1.042","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115973","10.199","0.002","10.63","0.002","14.062","0.002","82.49","","69.36","","83.35","","1410.4","0.4","293","2","293","2","","","","","","","","5","P 1","P 1","1","","","","- C18 H32 N11 O11 Pr -","- C18 H32 N11 O11 Pr -","- C36 H64 N22 O22 Pr2 -","2","2","","Myrtil L. Kahn; Jean-Pascal Sutter; Stéphane Golhen; Philippe Guionneau; Lahcène Ouahab; Olivier Kahn; Daniel Chasseau","Systematic Investigation of the Nature of The Coupling between a Ln(III) Ion (Ln = Ce(III) to Dy(III)) and Its Aminoxyl Radical Ligands. Structural and Magnetic Characteristics of a Series of {Ln(organic radical)2} Compounds and the Related {Ln(Nitrone)2} Derivatives","Journal of the American Chemical Society","2000","122","","3413","3421","10.1021/ja994175o","","","0.71069","MoKα","","0.0986","0.03","","","0.0615","0.0725","","","","","","1.004","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115974","10.1856","0.001","12.0125","0.0008","13.0143","0.001","103.671","0.006","92.809","0.007","111.622","0.007","1422","0.2","296.2","","296.2","","","","","","","","","4","P -1","-P 1","2","","","","- C18 H42 O Si6 -","- C18 H42 O Si6 -","- C36 H84 O2 Si12 -","2","1","","Yoshio Kabe; Kenichi Ohkubo; Hitomi Ishikawa; Wataru Ando","1,4-Disila(Dewar-benzene) and 1,4-Disilabenzene: Valence Isomerization of Bis(alkylsilacyclopropenyl)s","Journal of the American Chemical Society","2000","122","","3775","3776","10.1021/ja9930061","","","0.7107","MoKα","","0.0567","0.057","","0.064","","0.064","","","3.282","","","3.28","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115975","17.7265","0.0013","10.5224","0.0006","15.627","0.002","90","","102.627","0.002","90","","2844.3","0.5","296.2","","296.2","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C18 H42 Si6 -","- C18 H42 Si6 -","- C72 H168 Si24 -","4","1","","Yoshio Kabe; Kenichi Ohkubo; Hitomi Ishikawa; Wataru Ando","1,4-Disila(Dewar-benzene) and 1,4-Disilabenzene: Valence Isomerization of Bis(alkylsilacyclopropenyl)s","Journal of the American Chemical Society","2000","122","","3775","3776","10.1021/ja9930061","","","0.7107","MoKα","","0.072","0.072","","0.077","","0.077","","","3.766","","","3.77","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115976","11.7382","0.0005","9.7384","0.0004","18.6132","0.0008","90","","99.906","0.001","90","","2095.98","0.15","193","","193","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C15 H8 Fe3 N2 O9 P2 -","- C15 H8 Fe3 N2 O9 P2 -","- C60 H32 Fe12 N8 O36 P8 -","4","1","","Caryn C. Borg-Breen; Maria T. Bautista; Cynthia K. Schauer; Peter S. White","Synthesis of the Bifunctional Phosphinidene Cluster, Fe3(CO)9(μ3-PH)2, and a Systematic Study of the Reactivity of the Cluster-Bound P-H Functional Group","Journal of the American Chemical Society","2000","122","","3952","3962","10.1021/ja993811f","","","0.7093","MolybdenumKα","","0.027","0.023","","0.03","0.029","","","","","2.66","2.66","","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115977","16.8779","0.0007","14.4419","0.0006","21.1256","0.0009","90","","107.633","0.001","90","","4907.4","0.4","193","","193","","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C45 H30 Au2 Fe3 O9 P4 S2 -","- C45 H30 Au2 Fe3 O9 P4 S2 -","- C180 H120 Au8 Fe12 O36 P16 S8 -","4","1","","Caryn C. Borg-Breen; Maria T. Bautista; Cynthia K. Schauer; Peter S. White","Synthesis of the Bifunctional Phosphinidene Cluster, Fe3(CO)9(μ3-PH)2, and a Systematic Study of the Reactivity of the Cluster-Bound P-H Functional Group","Journal of the American Chemical Society","2000","122","","3952","3962","10.1021/ja993811f","","","0.7093","MolybdenumKα","","0.026","0.022","","0.033","0.032","","","","","1.36","1.36","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115978","12.986","0.01","11.792","0.01","20.659","0.03","90","","100.896","0.0004","90","","3106","6","50","1","50","1","","","","","","","Synthesis","6","P 1 21/n 1","-P 2yn","14","Bis-(m-[tris(2-thio-3-trimethylsilylphenyl-1k2S;1:2k4S;2k2S)phosphine-1kP,2k P]-diiron","Bis-(m-[tris(2-thio-3-trimethylsilylphenyl-1k2S;1:2k4S;2k2S)phosphine-1kP,2k P]-diiron","","- C54 H72 Fe2 P2 S6 Si6 -","- C54 H72 Fe2 P2 S6 Si6 -","- C108 H144 Fe4 P4 S12 Si12 -","2","0.5","","Jodi D. Niemoth-Anderson; Kerry A. (Fusie) Clark; T. Adrian George; Charles R. Ross","Five-Coordinate Diamagnetic Iron(IV) Complexes With A Trigonal Planar Arrangement of Thiolate Ligand Atoms: Synthesis and Crystal Structure of [FeX(PS3)] (X = Cl, Br or I; PS3H3= [P(C'''6H3-3-Me3Si-2-SH)3])","Journal of the American Chemical Society","2000","122","","3977","3978","10.1021/ja993988+","","","0.5608","AgKα","","0.0784","0.0583","","0.0732","0.066","","","","","1.521","1.521","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115979","20.623","","20.623","","20.623","","90","","90","","90","","8771.13","","293","2","293","2","","","","","","","","7","I -4 3 m","I -4 2 3","217","Bromo[tris(2-thio-3-trimethylsilylphenyl-kS)phosphine-kP]iron","Bromo[tris(2-thio-3-trimethylsilylphenyl-kS)phosphine-kP]iron","","- C37.25 H46.25 Br Fe P S3 Si3 -","- C37.2 H36 Br Fe P S3 Si3 -","- C297.6 H288 Br8 Fe8 P8 S24 Si24 -","8","0.166667","","Jodi D. Niemoth-Anderson; Kerry A. (Fusie) Clark; T. Adrian George; Charles R. Ross","Five-Coordinate Diamagnetic Iron(IV) Complexes With A Trigonal Planar Arrangement of Thiolate Ligand Atoms: Synthesis and Crystal Structure of [FeX(PS3)] (X = Cl, Br or I; PS3H3= [P(C'''6H3-3-Me3Si-2-SH)3])","Journal of the American Chemical Society","2000","122","","3977","3978","10.1021/ja993988+","","","0.71073","MoKα","","0.0673","0.0604","","","0.1528","0.1624","","","","","","1.115","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115980","31.317","0.006","16.919","0.003","21.301","0.004","90","","112.21","0.03","90","","10449","4","293","2","293","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","Iodo[tris(2-thio-3-trimethylsilylphenyl-kS)phosphine-kP]iron","Iodo[tris(2-thio-3-trimethylsilylphenyl-kS)phosphine-kP]iron","","- C90 H96 Cl12 Fe2 I2 P2 S6 Si6 -","- C84 H88 Cl10 Fe2 I2 P2 S6 Si6 -","- C336 H352 Cl40 Fe8 I8 P8 S24 Si24 -","4","0.5","","Jodi D. Niemoth-Anderson; Kerry A. (Fusie) Clark; T. Adrian George; Charles R. Ross","Five-Coordinate Diamagnetic Iron(IV) Complexes With A Trigonal Planar Arrangement of Thiolate Ligand Atoms: Synthesis and Crystal Structure of [FeX(PS3)] (X = Cl, Br or I; PS3H3= [P(C'''6H3-3-Me3Si-2-SH)3])","Journal of the American Chemical Society","2000","122","","3977","3978","10.1021/ja993988+","","","0.71073","MoKα","","0.0922","0.0709","","","0.1899","0.2083","","","","","","1.094","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115981","20.471","0.001","20.471","0.001","20.471","0.001","90","","90","","90","","8578.6","0.7","293","2","293","2","","","","","","","Synthesis","7","I -4 3 m","I -4 2 3","217","Chloro[tris(2-thio-3-trimethylsilylphenyl-kS)phosphine-kP]iron","Chloro[tris(2-thio-3-trimethylsilylphenyl-kS)phosphine-kP]iron","","- C27 H36 Cl Fe P S3 Si3 -","- C37.68 H36 Cl Fe P S3 Si3 -","- C301.44 H288 Cl8 Fe8 P8 S24 Si24 -","8","0.166667","","Jodi D. Niemoth-Anderson; Kerry A. (Fusie) Clark; T. Adrian George; Charles R. Ross","Five-Coordinate Diamagnetic Iron(IV) Complexes With A Trigonal Planar Arrangement of Thiolate Ligand Atoms: Synthesis and Crystal Structure of [FeX(PS3)] (X = Cl, Br or I; PS3H3= [P(C'''6H3-3-Me3Si-2-SH)3])","Journal of the American Chemical Society","2000","122","","3977","3978","10.1021/ja993988+","","","0.71073","MoKα","","0.0374","0.0336","","0.0924","0.09","","","","1.086","1.113","1.113","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115982","23.723","0.004","7.1323","0.0009","15.452","0.002","90","","90","","90","","2614.5","0.6","296","1","296","1","","","","","","","Synthesized in the laboratory of J. P. Selegue","6","P n a 21","P 2c -2n","33","","endo-pentahapto-pentamethylcyclopentadienyl-hexahapto-7bH- indeno[1,2,3-jk]fluoreneruthenium(II) trifluoromethanesulfonate","","- C30 H27 F3 O3 Ru S -","- C30 H27 F3 O3 Ru S -","- C120 H108 F12 O12 Ru4 S4 -","4","1","","Aibing Xia; John P. Selegue; Alberto Carrillo; Carolyn P. Brock","Stereochemical Inversion of a Coordinated, Curved Hydrocarbon: Syntheses and Structures of exo- and endo-[Ru(η6-fluoradene)(η-C5Me5)][CF3SO3]","Journal of the American Chemical Society","2000","122","","3973","3974","10.1021/ja994266l","","","0.71073","MoKα","","0.056","0.0317","","0.0862","0.0772","","","","1.085","1.102","1.102","","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115983","7.3776","0.0006","23.7473","0.0017","15.4796","0.0013","90","","90.17","0.03","90","","2712","0.4","296","1","296","1","","","","","","","Synthesized in the laboratory of J. P. Selegue","6","C 1 c 1","C -2yc","9","","exo-pentahapto-pentamethylcyclopentadienyl-hexahapto-7bH- indeno[1,2,3-jk]fluoreneruthenium(II) trifluoromethanesulfonate","","- C30 H27 F3 O3 Ru S -","- C30 H27 F3 O3 Ru S -","- C120 H108 F12 O12 Ru4 S4 -","4","1","","Aibing Xia; John P. Selegue; Alberto Carrillo; Carolyn P. Brock","Stereochemical Inversion of a Coordinated, Curved Hydrocarbon: Syntheses and Structures of exo- and endo-[Ru(η6-fluoradene)(η-C5Me5)][CF3SO3]","Journal of the American Chemical Society","2000","122","","3973","3974","10.1021/ja994266l","","","0.71073","MoKα","","0.0419","0.0285","","0.0827","0.0681","","","","1.065","1.105","1.105","","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115984","19.46","0.02","24.2","0.03","13.81","0.02","90","","121.17","0.13","90","","5565","14","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","{[Cd2(4-pytz)3(NO3)4(MeOH)0.5]}","3,6-bis(pyrid-4-yl)-1,2,4,5-tetrazine Cadmium Nitrate Dichloromethane Toluene Solvate","","- C22.33 H12.78 Cd Cl0.67 N11 O6.5 -","- C22.835 H12 Cd Cl0.66 N11 O6.5 -","- C182.68 H96 Cd8 Cl5.28 N88 O52 -","8","1","","Matthew A. Withersby; Alexander J. Blake; Neil R. Champness; Paul A. Cooke; Peter Hubberstey; Martin Schröder","Assembly of a Three-Dimensional Polyknotted Coordination Polymer","Journal of the American Chemical Society","2000","122","","4044","4046","10.1021/ja991698n","","","0.71073","MoKα","","0.1538","0.0971","","","0.2333","0.2977","","","","","","1.028","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4115985","19.835","0.007","23.936","0.005","13.841","0.006","90","","122.48","0.04","90","","5543","4","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","{[Cd2(4-pytz)3(NO3)3(OH)(MeOH)]}","3,6-bis(pyrid-4-yl)-1,2,4,5-tetrazine Cadmium Nitrate hydroxide Dichloromethane Toluene Methanol Solvate","","- C21.47 H12.88 Cd Cl0.5 N10.5 O5.83 -","- C21.39 H12 Cd Cl0.5 N10.5 O5.82 -","- C171.12 H96 Cd8 Cl4 N84 O46.56 -","8","1","","Matthew A. Withersby; Alexander J. Blake; Neil R. Champness; Paul A. Cooke; Peter Hubberstey; Martin Schröder","Assembly of a Three-Dimensional Polyknotted Coordination Polymer","Journal of the American Chemical Society","2000","122","","4044","4046","10.1021/ja991698n","","","0.71073","MoKα","","0.0948","0.0668","","","0.1706","0.1946","","","","","","1.026","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4115986","27.314","0.006","15.701","0.004","15.514","0.005","90","","116.7","0.02","90","","5944","3","220","2","220","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","tris(3,6-bis(pyridin-4-yl)-1,2,4,5-tetrazine)dicadmium(II) nitrate diethylether adduct (1/1)","","- C20 H17 Cd N11 O6.5 -","- C20 H12 Cd N11 O6.5 -","- C160 H96 Cd8 N88 O52 -","8","1","","Matthew A. Withersby; Alexander J. Blake; Neil R. Champness; Paul A. Cooke; Peter Hubberstey; Martin Schröder","Assembly of a Three-Dimensional Polyknotted Coordination Polymer","Journal of the American Chemical Society","2000","122","","4044","4046","10.1021/ja991698n","","","0.71069","MoKα","","0.0984","0.0854","","0.1078","0.0925","","","","1.0844","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115987","7.887","0.001","11.114","0.002","35.472","0.005","90","","94.68","0.01","90","","3099","0.8","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tris(tetrahydofuran)(iodo)(2,6-(diphenyl)phenyl)ytterbium(II) hemi tetrahydrofuran solvate","","- C32 H41 I O3.5 Yb -","- C32 H41 I O3.5 Yb -","- C128 H164 I4 O14 Yb4 -","4","1","","Gernot Heckmann; Mark Niemeyer","Synthesis and First Structural Characterization of Lanthanide(II) Aryls: Observation of a Schlenk Equilibrium in Europium(II) and Ytterbium(II) Chemistry","Journal of the American Chemical Society","2000","122","","4227","4228","10.1021/ja993494c","","","0.71073","MoKα","","0.056","0.0378","","","0.0842","0.0917","","","","","","1.243","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4115988","9.607","0.004","11.65","0.004","19.47","0.007","102.788","0.019","91.34","0.019","113.65","0.02","1931.2","1.3","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","Bis(tetrahydofuran)(Bis)(2,6-(diphenyl)phenyl)europium(II) tetrahydrofuran solvate","","- C48 H50 Eu O3 -","- C48 H50 Eu O3 -","- C96 H100 Eu2 O6 -","2","1","","Gernot Heckmann; Mark Niemeyer","Synthesis and First Structural Characterization of Lanthanide(II) Aryls: Observation of a Schlenk Equilibrium in Europium(II) and Ytterbium(II) Chemistry","Journal of the American Chemical Society","2000","122","","4227","4228","10.1021/ja993494c","","","0.71073","MoKα","","0.0551","0.0394","","","0.088","0.091","","","","","","0.924","","","","has coordinates,has disorder","178930","2020-10-21","18:00:00",""
"4115989","23.163","0.006","26.096","0.005","23.981","0.006","90","","111.093","0.019","90","","13524","6","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Pentakis(tetrahydofuran)diiodoeuropium(II)","","- C80 H160 Eu4 I8 O20 -","- C80 H160 Eu4 I8 O20 -","- C320 H640 Eu16 I32 O80 -","4","1","","Gernot Heckmann; Mark Niemeyer","Synthesis and First Structural Characterization of Lanthanide(II) Aryls: Observation of a Schlenk Equilibrium in Europium(II) and Ytterbium(II) Chemistry","Journal of the American Chemical Society","2000","122","","4227","4228","10.1021/ja993494c","","","0.71073","MoKα","","0.1501","0.0746","","","0.1627","0.1986","","","","","","0.981","","","","has coordinates,has disorder","178930","2020-10-21","18:00:00",""
"4115990","11.455","0.002","13.859","0.003","14.101","0.004","98.5","0.02","98.87","0.01","92.52","0.02","2182.4","0.9","289","2","289","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H51 N6 Nd O15 -","- C36 H51 N6 Nd O15 -","- C72 H102 N12 Nd2 O30 -","2","1","","Koen Binnemans; Yury G. Galyametdinov; Rik Van Deun; Duncan W. Bruce; Simon R. Collinson; Arkadiy P. Polishchuk; Ildar Bikchantaev; Wolfgang Haase; Andrey V. Prosvirin; Larisa Tinchurina; Igor Litvinov; Ajdar Gubajdullin; Ajdar Rakhmatullin; Koen Uytterhoeven; Luc Van Meervelt","Rare-Earth-Containing Magnetic Liquid Crystals","Journal of the American Chemical Society","2000","122","","4335","4344","10.1021/ja993351q","","","0.71073","MoKα","","0.0467","0.0376","","","0.0911","0.0971","","","","","","1.039","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115991","11.38","0.001","13.8","0.005","14.03","0.005","98.7","0.03","98.15","0.02","92.67","0.02","2150.8","1.1","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H51 Dy N6 O15 -","- C36 H51 Dy N6 O15 -","- C72 H102 Dy2 N12 O30 -","2","1","","Koen Binnemans; Yury G. Galyametdinov; Rik Van Deun; Duncan W. Bruce; Simon R. Collinson; Arkadiy P. Polishchuk; Ildar Bikchantaev; Wolfgang Haase; Andrey V. Prosvirin; Larisa Tinchurina; Igor Litvinov; Ajdar Gubajdullin; Ajdar Rakhmatullin; Koen Uytterhoeven; Luc Van Meervelt","Rare-Earth-Containing Magnetic Liquid Crystals","Journal of the American Chemical Society","2000","122","","4335","4344","10.1021/ja993351q","","","0.71073","MoKα","","","0.025","","","0.03","","","","","0.995","0.995","","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115992","7.1731","0.0009","11.566","0.001","13.807","0.002","70.627","0.002","84.071","0.002","81.72","0.002","1067.5","0.2","110","","110","","","","","","","","","5","P -1","-P 1","2","[Nitrilotri(methylphosphonic acid)*1,7-Phenanthroline]*2H2O","","","- C15 H24 N3 O11 P3 -","- C15 H24 N3 O11 P3 -","- C30 H48 N6 O22 P6 -","2","1","","C. V. Krishnamohan Sharma; Abraham Clearfield","Three-Dimensional Hexagonal Structures from a Novel Self-Complementary Molecular Building Block","Journal of the American Chemical Society","2000","122","","4394","4402","10.1021/ja9935512","","","0.71073","MoKα","","0.0743","0.0441","","","0.0961","0.1052","","","","","","0.913","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115993","8.1519","0.0005","11.255","0.0007","11.3742","0.0007","72.239","0.001","74.563","0.001","85.809","0.001","957.95","0.1","110","","123","2","","","","","","","","5","P -1","-P 1","2","[Nitrilotri(methylphosphonic acid)*1,10-Phenanthroline]","","","- C15 H20 N3 O9 P3 -","- C15 H20 N3 O9 P3 -","- C30 H40 N6 O18 P6 -","2","1","","C. V. Krishnamohan Sharma; Abraham Clearfield","Three-Dimensional Hexagonal Structures from a Novel Self-Complementary Molecular Building Block","Journal of the American Chemical Society","2000","122","","4394","4402","10.1021/ja9935512","","","0.71073","MoKα","","0.0578","0.0527","","","0.1387","0.1454","","","","","","1.116","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115994","7.4491","0.0004","13.7121","0.0008","15.1279","0.0009","86.543","0.001","89.146","0.001","76.255","0.001","1498.22","0.15","110","","110","","","","","","","","","5","P -1","-P 1","2","[Nitrilotri(methylphosphonic acid)*1,7-Phenanthroline]*3H2O","","","- C27 H34 N5 O12 P3 -","- C27 H34 N5 O12 P3 -","- C54 H68 N10 O24 P6 -","2","1","","C. V. Krishnamohan Sharma; Abraham Clearfield","Three-Dimensional Hexagonal Structures from a Novel Self-Complementary Molecular Building Block","Journal of the American Chemical Society","2000","122","","4394","4402","10.1021/ja9935512","","","0.71073","MoKα","","0.04","0.0352","","","0.1017","0.1054","","","","","","1.042","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115995","20.049","0.006","13.635","0.003","20.125","0.006","90","","90","","90","","5502","3","293","2","293","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C28 H28 Cl2 N O P2 Tc -","- C28 H28 Cl2 N O P2 Tc -","- C224 H224 Cl16 N8 O8 P16 Tc8 -","8","1","","Cristina Bolzati; Alessandra Boschi; Adriano Duatti; Sushumna Prakash; Licia Uccelli; Fiorenzo Refosco; Francesco Tisato; Giuliano Bandoli","Geometrically Controlled Selective Formation of Nitrido Technetium(V) Asymmetrical Heterocomplexes with Bidentate Ligands","Journal of the American Chemical Society","2000","122","","4510","4511","10.1021/ja993834u","","","0.71073","MoKα","","0.0774","0.0452","","0.1145","0.0976","","","","1.036","1.071","1.071","","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115996","13.01","0.002","10.853","0.001","23.692","0.004","90","","90","","90","","3345.3","0.8","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C10 H24 Cl2 Fe N5 O5 -","- C10 H24 Cl2 Fe N5 O5 -","- C80 H192 Cl16 Fe8 N40 O40 -","8","1","","Christina Hauser; Thorsten Glaser; Eckhard Bill; Thomas Weyhermüller; Karl Wieghardt","The Electronic Structures of an Isostructural Series of Octahedral Nitrosyliron Complexes {Fe-NO}6,7,8 Elucidated by Mössbauer Spectroscopy","Journal of the American Chemical Society","2000","122","","4352","4365","10.1021/ja994161i","","","0.71073","MoKα","","0.079","0.0536","","0.1242","0.1127","","","","1.047","1.108","1.108","","","","","has coordinates","178930","2020-10-21","18:00:00",""
"4115997","13.45","0.002","8.1261","0.0008","13.478","0.002","90","","109.43","0.02","90","","1389.2","0.4","100","2","100","2","","","","","","","","6","P 1 n 1","P -2yac","7","","","","- C6 H15 Cl Fe N6 O9 -","- C6 H15 Cl Fe N6 O9 -","- C24 H60 Cl4 Fe4 N24 O36 -","4","2","","Christina Hauser; Thorsten Glaser; Eckhard Bill; Thomas Weyhermüller; Karl Wieghardt","The Electronic Structures of an Isostructural Series of Octahedral Nitrosyliron Complexes {Fe-NO}6,7,8 Elucidated by Mössbauer Spectroscopy","Journal of the American Chemical Society","2000","122","","4352","4365","10.1021/ja994161i","","","0.71073","MoKα","","0.0746","0.0462","","0.1207","0.108","","","","0.991","1.132","1.132","","","","","has coordinates,has disorder","178930","2020-10-21","18:00:00",""
"4115998","11.986","0.001","11.9379","0.0005","19.3898","0.0007","90","","98.802","0.001","90","","2741.8","0.3","273.2","","273.2","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C31 H40 O6 -","- C31 H40 O6 -","- C124 H160 O24 -","4","2","","Yoshihiko Yamamoto; Hideaki Kitahara; Ryuji Ogawa; Hiroyuki Kawaguchi; Kazuyuki Tatsumi; Kenji Itoh","Ru(II)-Catalyzed Cycloadditions of 1,6-Heptadiynes with Alkenes: New Synthetic Potential of Ruthenacyclopentatrienes as Biscarbenoids in Tandem Cyclopropanation of Bicycloalkenes and Heteroatom-Assisted Cyclocotrimerization of 1,6-Heptadiynes with Heterocyclic Alkenes","Journal of the American Chemical Society","2000","122","","4310","4319","10.1021/ja9942890","","","0.7107","MoKα","","0.074","0.0536","","","0.0533","0.0545","","","","","","1.879","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115999","7.912","0.001","16.578","0.003","7.7275","0.0002","90","","120.253","0.0006","90","","875.54","0.19","273.2","","273.2","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C19 H20 O8 -","- C19 H20 O8 -","- C38 H40 O16 -","2","1","","Yoshihiko Yamamoto; Hideaki Kitahara; Ryuji Ogawa; Hiroyuki Kawaguchi; Kazuyuki Tatsumi; Kenji Itoh","Ru(II)-Catalyzed Cycloadditions of 1,6-Heptadiynes with Alkenes: New Synthetic Potential of Ruthenacyclopentatrienes as Biscarbenoids in Tandem Cyclopropanation of Bicycloalkenes and Heteroatom-Assisted Cyclocotrimerization of 1,6-Heptadiynes with Heterocyclic Alkenes","Journal of the American Chemical Society","2000","122","","4310","4319","10.1021/ja9942890","","","0.7107","MoKα","","0.0504","0.0464","","","0.0625","0.063","","","","","","2.425","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116000","5.8709","0.0008","9.8771","0.0008","10.491","0.003","90","","104.408","0.007","90","","589.21","0.19","133","2","133","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","O-Trifluorosilyl-N,N-dimethylhydroxylamine","","- C2 H6 F3 N O Si -","- C2 H6 F3 N O Si -","- C8 H24 F12 N4 O4 Si4 -","4","1","","Norbert W. Mitzel; Udo Losehand; Anan Wu; Dieter Cremer; David W. H. Rankin","(N,N-Dimethylaminoxy)trifluorosilane: Strong, Dipole Moment Driven Changes in the Molecular Geometry Studied by Experiment and Theory in Solid, Gas, and Solution Phases","Journal of the American Chemical Society","2000","122","","4471","4482","10.1021/ja994542w","","","0.71073","MoKα","","0.0847","0.0466","","","0.121","0.1382","","","","","","1.021","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116001","24.7269","0.0014","24.7269","0.0014","24.7269","0.0014","90","","90","","90","","15118.5","1.5","293","2","293","2","","","","","","","","7","P n -3 n :2","-P 4a 2bc 3","222","C168 H144 Cl12 N48 Ni6 S12 24DMF 13H2O","","","- C240 H338 Cl12 N72 Ni6 O37 S24 -","- C206.4 H144 Cl12 N68 Ni6 O12.52 S24 -","- C412.8 H288 Cl24 N136 Ni12 O25.04 S48 -","2","0.0416667","","Maochun Hong; Yingjun Zhao; Weiping Su; Rong Cao; Makoto Fujita; Zhongyuan Zhou; Albert S. C. Chan","A Nanometer-Sized Metallosupramolecular Cube with Oh Symmetry","Journal of the American Chemical Society","2000","122","","4819","4820","10.1021/ja000247w","","","0.71073","MoKα","","0.1633","0.0778","","","0.1941","0.2932","","","","","","0.891","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116002","11.9775","0.0004","22.9899","0.0006","9.9059","0.0004","95.675","0.002","107.604","0.0007","76.798","0.002","2529.94","0.15","93.2","","","","","","","","","","","3","P -1","-P 1","2","","","","- C45 H80 Si7 -","- C45 H80 Si7 -","- C90 H160 Si14 -","2","1","","Ken Hatano; Norihiro Tokitoh; Nozomi Takagi; Shigeru Nagase","The First Stable Heteracyclopropabenzene: Synthesis and Crystal Structure of a Silacyclopropabenzene","Journal of the American Chemical Society","2000","122","","4829","4830","10.1021/ja000501k","","","0.7107","MoKα","","","0.053","","","","0.1507","","","","","","0.983","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116003","15.703","0.01","6.639","0.003","42.24","0.03","90","","100.25","0.04","90","","4333","5","213","2","213","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(3R,6S,7R,10S,11R,14S,15R,18S,19R,22S)-2,23-bis(4'-bromobenzoyloxy)-2,6,10,1 5,19,23-hexamethyl-3,7,11,15,19-penta(oxacyclopentyl)tetracosane","","- C44 H58 Br2 O9 -","- C44 H58 Br2 O9 -","- C176 H232 Br8 O36 -","4","1","","Zhaoming Xiong; E. J. Corey","Simple Total Synthesis of the Pentacyclic Cs-Symmetric Structure Attributed to the Squalenoid Glabrescol and Three Cs-Symmetric Diastereomers Compel Structural Revision","Journal of the American Chemical Society","2000","122","","4831","4832","10.1021/ja000842y","","","0.71073","MoKα","","0.3532","0.1159","","","0.1908","0.2851","","","","","","0.979","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116004","14.95","0.002","22.361","0.002","9.6966","0.0003","90","","104.854","0.005","90","","3133.2","0.5","130","2","130","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[FE(II)(OEP)(NO)]","NITROSYL-IRON(II)-2,3,7,8,12,13,17,18-OCTAETHYLPORPHYRIN","","- C36 H44 Fe N5 O -","- C36 H44 Fe N5 O -","- C144 H176 Fe4 N20 O4 -","4","1","","W. Robert Scheidt; Hugues F. Duval; Teresa J. Neal; Mary K. Ellison","Intrinsic Structural Distortions in Five-Coordinate (Nitrosyl)iron(II) Porphyrinate Derivatives","Journal of the American Chemical Society","2000","122","","4651","4659","10.1021/ja993995y","","","0.71073","MoKα","","0.0523","0.0421","","0.1561","0.1515","","","","1.283","1.332","1.332","","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116005","10.4204","0.0001","10.5562","0.0007","14.0425","0.0007","79.83","0.005","89.585","0.004","80.264","0.004","1498.1","0.13","130","2","130","2","","","","","","","","5","P -1","-P 1","2","[FE(II)(OEP)(NO)]","NITROSYL-IRON(II)-2,3,7,8,12,13,17,18-OCTAETHYLPORPHYRIN","","- C36 H44 Fe N5 O -","- C36 H44 Fe N5 O -","- C72 H88 Fe2 N10 O2 -","2","1","","W. Robert Scheidt; Hugues F. Duval; Teresa J. Neal; Mary K. Ellison","Intrinsic Structural Distortions in Five-Coordinate (Nitrosyl)iron(II) Porphyrinate Derivatives","Journal of the American Chemical Society","2000","122","","4651","4659","10.1021/ja993995y","","","0.71073","MoKα","","0.0535","0.0412","","0.1128","0.1059","","","","1.024","1.057","1.057","","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116006","8.8435","0.0006","14.1716","0.0013","15.6651","0.0018","69.946","0.012","83.063","0.007","86.647","0.011","1830.4","0.3","130","2","130","2","","","","","","","","6","P -1","-P 1","2","[Fe(oxoOEC)(NO)]","NITROSYL-IRON(II)-3,3,7,8,12,13,17,18-OCTAETHYL-3(H)-PORPHIN-2-ONATO(2-)","","- C37 H45 Cl3 Fe N5 O2 -","- C37 H45 Cl3 Fe N5 O2 -","- C74 H90 Cl6 Fe2 N10 O4 -","2","1","","W. Robert Scheidt; Hugues F. Duval; Teresa J. Neal; Mary K. Ellison","Intrinsic Structural Distortions in Five-Coordinate (Nitrosyl)iron(II) Porphyrinate Derivatives","Journal of the American Chemical Society","2000","122","","4651","4659","10.1021/ja993995y","","","0.71073","MoKα","","0.1082","0.0781","","","0.2082","0.2351","","","","","","1.062","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116007","16.75","0.003","15.293","0.003","17.608","0.004","90","","107.77","0.03","90","","4295.2","1.7","130","2","130","2","","","","","","","","7","P 1 21/m 1","-P 2yb","11","[Fe(TPPBr4)(NO)]","Nitrosyl-iron(II)-2,3,12,13-tetrabromo-5,10,15,20-tetraphenylporphyrin","","- C45.5 H24 Br4 Cl4.5 Fe N5 O -","- C45.5 H24 Br4 Cl4.5 Fe N5 O -","- C182 H96 Br16 Cl18 Fe4 N20 O4 -","4","1","","W. Robert Scheidt; Hugues F. Duval; Teresa J. Neal; Mary K. Ellison","Intrinsic Structural Distortions in Five-Coordinate (Nitrosyl)iron(II) Porphyrinate Derivatives","Journal of the American Chemical Society","2000","122","","4651","4659","10.1021/ja993995y","","","0.71073","MoKα","","0.1204","0.0755","","","0.1878","0.2321","","","","","","1.042","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116008","17.623","0.004","10.522","0.002","19.457","0.004","90","","90.78","0.03","90","","3607.6","1.3","295","2","295","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","[FE(II)(TPPBr4)(NO)]","Nitrosyl-iron(II)-2,3,12,13-tetrabromo-5,10,15,20-tetraphenylporphyrin","","- C44 H24 Br4 Fe N5 O -","- C44 H24 Br4 Fe N5 O -","- C176 H96 Br16 Fe4 N20 O4 -","4","0.5","","W. Robert Scheidt; Hugues F. Duval; Teresa J. Neal; Mary K. Ellison","Intrinsic Structural Distortions in Five-Coordinate (Nitrosyl)iron(II) Porphyrinate Derivatives","Journal of the American Chemical Society","2000","122","","4651","4659","10.1021/ja993995y","","","0.71073","MoKα","","0.1474","0.0982","","","0.2538","0.3373","","","","","","1.054","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116009","13.7989","0.0011","13.8385","0.0009","13.959","0.002","103.581","0.01","97.433","0.009","106.352","0.006","2431","0.5","158","2","158","2","","","","","","","","7","P -1","-P 1","2","","","","- C45 H38 B11 Cl6 Fe N4 O2 -","- C45 H37.882 B11 Cl5.41 Fe N4 O2 -","- C90 H75.764 B22 Cl10.82 Fe2 N8 O4 -","2","1","","Daniel R. Evans; Christopher A. Reed","Reversal of H2O and OH-Ligand Field Strength on the Magnetochemical Series Relative to the Spectrochemical Series. Novel 1-equiv Water Chemistry of Iron(III) Tetraphenylporphyrin Complexes","Journal of the American Chemical Society","2000","122","","4660","4667","10.1021/ja994478i","","","1.54178","CuKα","","0.0689","0.0606","","","0.1566","0.1604","","","","","","1.082","","","","has coordinates,has disorder","178931","2020-10-21","18:00:00",""
"4116010","12.378","0.004","16.097","0.008","24.458","0.003","90","","97.94","0.02","90","","4827","3","163","2","163","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Ferric Tetraphenylporphryin Hexabromocarborane","","","- C45 H34 B11 Br6 Fe N4 -","- C45 H34 B11 Br6 Fe N4 -","- C180 H136 B44 Br24 Fe4 N16 -","4","1","","Daniel R. Evans; Christopher A. Reed","Reversal of H2O and OH-Ligand Field Strength on the Magnetochemical Series Relative to the Spectrochemical Series. Novel 1-equiv Water Chemistry of Iron(III) Tetraphenylporphyrin Complexes","Journal of the American Chemical Society","2000","122","","4660","4667","10.1021/ja994478i","","","1.54178","CuKα","","0.1013","0.0757","","0.2113","0.1904","","","","1.374","1.466","1.466","","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116011","14.9525","0.0014","14.1601","0.0014","16.0276","0.0016","90","","103.55","0.002","90","","3299.1","0.6","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","1,2-bis(2-methyl-5-(4-(tert-butyl)phenyl)-3-thienyl)perfluorocyclopentene","5-(4-(tert-butyl)phenyl)-3-(2-(5-(4-(tert-butyl)phenyl)-2-methyl(3-thienyl)) -3,3,4,4,5,5-hexafluorocyclopent-1-enyl)-2-methylthiophene","","- C35 H34 F6 S2 -","- C35 H34 F6 S2 -","- C140 H136 F24 S8 -","4","1","","Masahiro Irie; Thorsten Lifka; Seiya Kobatake; Nobuo Kato","Photochromism of 1,2-Bis(2-methyl-5-phenyl-3-thienyl)perfluorocyclopentene in a Single-Crystalline Phase","Journal of the American Chemical Society","2000","122","","4871","4876","10.1021/ja993181h","","","0.71073","MoKα","","0.0822","0.0655","","","0.1854","0.2017","","","","","","1.068","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4116012","18.786","0.002","11.7616","0.0014","21.675","0.003","90","","96.323","0.002","90","","4760","1","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","1,2-bis(2-methyl-5-phenyl-3-thienyl)perfluorocyclopentene","3-(3,3,4,4,5,5-hexafluoro-2-(2-methyl-5-phenyl(3-thienyl))cyclopent-1- enyl)-2-methyl-5-phenylthiophene","","- C27 H18 F6 S2 -","- C27 H18 F6 S2 -","- C216 H144 F48 S16 -","8","2","","Masahiro Irie; Thorsten Lifka; Seiya Kobatake; Nobuo Kato","Photochromism of 1,2-Bis(2-methyl-5-phenyl-3-thienyl)perfluorocyclopentene in a Single-Crystalline Phase","Journal of the American Chemical Society","2000","122","","4871","4876","10.1021/ja993181h","","","0.71073","MoKα","","0.0806","0.0485","","","0.1328","0.1516","","","","","","1.023","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116013","11.77","0.004","12.023","0.005","9.626","0.003","94.45","0.03","95.89","0.03","60.07","0.03","1173.7","0.8","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","4,4,5,5,6,6-Hexafluoro-9α,9β- dimethyl-2,8-diphenyl-5,6,9a,9b-tetrahydro- 4H-cyclopenta[e]benzo[2,1-b:3,4-b']dithiophene","","- C27 H18 F6 S2 -","- C27 H18 F6 S2 -","- C54 H36 F12 S4 -","2","1","","Masahiro Irie; Thorsten Lifka; Seiya Kobatake; Nobuo Kato","Photochromism of 1,2-Bis(2-methyl-5-phenyl-3-thienyl)perfluorocyclopentene in a Single-Crystalline Phase","Journal of the American Chemical Society","2000","122","","4871","4876","10.1021/ja993181h","","","1.54184","MoKα","","0.0905","0.0504","","0.1538","0.1263","","","","1.065","1.112","1.112","","","","","has coordinates,has disorder","178931","2020-10-21","18:00:00",""
"4116014","25.978","0.004","9.2508","0.0015","10.7141","0.0018","90","","102.708","0.003","90","","2511.7","0.7","296","2","296","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","1,2-bis(2-methyl-5-tolyl-3-thienyl)perfluorocyclopentene","3-(3,3,4,4,5,5-hexafluoro-2-(2-methyl-5-(4-methylphenyl)(3-thienyl))cyclopent- 1-enyl)-2-methyl-5-(4-methylphenyl)thiophene","","- C29 H22 F6 S2 -","- C29 H22 F6 S2 -","- C116 H88 F24 S8 -","4","0.5","","Masahiro Irie; Thorsten Lifka; Seiya Kobatake; Nobuo Kato","Photochromism of 1,2-Bis(2-methyl-5-phenyl-3-thienyl)perfluorocyclopentene in a Single-Crystalline Phase","Journal of the American Chemical Society","2000","122","","4871","4876","10.1021/ja993181h","","","0.71073","MoKα","","0.0668","0.0504","","","0.1365","0.1492","","","","","","1.033","","","","has coordinates,has disorder","178931","2020-10-21","18:00:00",""
"4116015","14.639","0.005","14.886","0.005","19.796","0.005","87.55","0.005","70.66","0.005","89.361","0.005","4067","2","293","2","188","2","","","","","","","","8","P -1","-P 1","2","[Fe2(m-O2CArTol)4(py)2](OTf)","","","- C96 H78 Cl2 F3 Fe2 N2 O11 S -","- C96 H78 Cl1.982 F3 Fe2 N2 O11 S -","- C192 H156 Cl3.964 F6 Fe4 N4 O22 S2 -","2","1","","Dongwhan Lee; Carsten Krebs; Boi Hanh Huynh; Michael P. Hendrich; Stephen J. Lippard","Valence-Delocalized Diiron(II,III) Cores Supported by Carboxylate-Only Bridging Ligands","Journal of the American Chemical Society","2000","122","","5000","5001","10.1021/ja994448f","","","0.71069","MoKα","","0.1203","0.0588","","","0.1285","0.1443","","","","","","0.906","","","","has coordinates,has disorder","178931","2020-10-21","18:00:00",""
"4116016","15.454","0.005","17.759","0.005","19.679","0.005","69.225","0.005","81.798","0.005","70.115","0.005","4747","2","293","2","188","2","","","","","","","","7","P -1","-P 1","2","[Fe2(m-O2CArTol)4(THF)2](PF6)","","","- C110 H91 Cl3 F6 Fe2 O10 P -","- C110 H91 Cl3 F6 Fe2 O10 P -","- C220 H182 Cl6 F12 Fe4 O20 P2 -","2","1","","Dongwhan Lee; Carsten Krebs; Boi Hanh Huynh; Michael P. Hendrich; Stephen J. Lippard","Valence-Delocalized Diiron(II,III) Cores Supported by Carboxylate-Only Bridging Ligands","Journal of the American Chemical Society","2000","122","","5000","5001","10.1021/ja994448f","","","0.71069","MoKα","","0.0843","0.0572","","","0.1447","0.1555","","","","","","1.057","","","","has coordinates,has disorder","178931","2020-10-21","18:00:00",""
"4116017","8.4433","0.0006","10.2522","0.0008","13.1711","0.001","108.578","0.001","97.064","0.001","89.743","0.001","1071.78","0.14","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Alq3 - beta","","","- C27 H18 Al N3 O3 -","- C27 H18 Al N3 O3 -","- C54 H36 Al2 N6 O6 -","2","1","","Martin Brinkmann; Gregory Gadret; Michele Muccini; Carlo Taliani; Norberto Masciocchi; Angelo Sironi","Correlation between Molecular Packing and Optical Properties in Different Crystalline Polymorphs and Amorphous Thin Films of mer-Tris(8-hydroxyquinoline)aluminum(III)","Journal of the American Chemical Society","2000","122","","5147","5157","10.1021/ja993608k","","","0.71073","MoKα","","0.1243","0.0594","","","0.1033","0.1209","","","","","","0.985","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116018","7.1808","0.0007","8.317","0.001","12.725","0.002","93.87","0.01","98.78","0.01","105.75","0.01","718.11","0.17","293","2","293","2","","","","","","","","7","P -1","-P 1","2","fac-trichloro{1C,N-(1'-ethanone, 1'-phenylato, oxime)} (S-methylthiomethane)platinum(IV)","","","- C10 H14 Cl3 N O Pt S -","- C10 Cl3 N O Pt S -","- C20 Cl6 N2 O2 Pt2 S2 -","2","1","","Larissa Alexandrova; Oleg G. D'yachenko; Grigory M. Kazankov; Vladimir A. Polyakov; Pavel V. Samuleev; Enrique Sansores; Alexander D. Ryabov","Mechanism of Biologically Relevant Deoxygenation of Dimethyl Sulfoxide Coupled with Pt(II) to Pt(IV) Oxidation of Orthoplatinated Oximes. Synthetic, Kinetic, Electrochemical, X-ray Structural, and Density Functional Study","Journal of the American Chemical Society","2000","122","","5189","5200","10.1021/ja994342k","","","0.71069","MoKα","","0.0371","0.0355","","","0.0389","0.0389","","","","","","0.963","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116019","13.888","0.002","15.866","0.002","17.869","0.002","77.632","0.002","73.91","0.002","77.116","0.002","3638.8","0.8","173.2","","173.2","","","","","","","","","4","P -1","-P 1","2","","","","- C80 H86 N4 O17 -","- C80 H86 N4 O17 -","- C160 H172 N8 O34 -","2","1","","Yukitami Mizuno; Takuzo Aida; Kentaro Yamaguchi","Chirality-Memory Molecule: Crystallographic and Spectroscopic Studies on Dynamic Molecular Recognition Events by Fully Substituted Chiral Porphyrins","Journal of the American Chemical Society","2000","122","","5278","5285","10.1021/ja000052o","","","0.7107","MoKα","","0.0663","0.066","","0.086","","0.086","","","1.969","","","1.97","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116020","10.6688","0.0002","15.2337","0.0003","42.5078","0.0006","90","","90","","90","","6908.6","0.2","213","2","213","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C30 H49 F3 N3 O3 P S -","- C30 H49 F3 N3 O3 P S -","- C240 H392 F24 N24 O24 P8 S8 -","8","1","","Neil Burford; T. Stanley Cameron; Daren J. LeBlanc; Andrew D. Phillips; Thomas E. Concolino; Kin-Chung Lam; Arnold L. Rheingold","Iminophosphide Bonding Environments from Carbene Complexes of Iminophosphines","Journal of the American Chemical Society","2000","122","","5413","5414","10.1021/ja000432+","","","0.71073","MoKα","","0.136","0.0892","","","0.1502","0.1699","","","","","","1.215","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4116021","21.8062","0.0003","8.5184","0.0001","17.8511","0.0002","90","","110.892","0.001","90","","3097.91","0.07","213","2","213","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H49 Cl N3 P -","- C29 H49 Cl N3 P -","- C116 H196 Cl4 N12 P4 -","4","1","","Neil Burford; T. Stanley Cameron; Daren J. LeBlanc; Andrew D. Phillips; Thomas E. Concolino; Kin-Chung Lam; Arnold L. Rheingold","Iminophosphide Bonding Environments from Carbene Complexes of Iminophosphines","Journal of the American Chemical Society","2000","122","","5413","5414","10.1021/ja000432+","","","0.71073","MoKα","","0.1075","0.085","","","0.2371","0.2753","","","","","","1.082","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4116022","19.588","0.002","12.1805","0.0015","19.823","0.003","90.025","0.015","98.066","0.015","89.96","0.015","4682.8","1","160","2","160","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H80 P4 Ru2 Si -","- C18 H40 P2 Ru Si0.5 -","- C144 H320 P16 Ru8 Si4 -","8","1","","Isabelle Atheaux; Bruno Donnadieu; V. Rodriguez; Sylviane Sabo-Etienne; Bruno Chaudret; Khansaa Hussein; Jean-Claude Barthelat","A Unique Coordination of SiH4: Isolation, Characterization, and Theoretical Study of (PR3)2H2Ru(SiH4)RuH2(PR3)2","Journal of the American Chemical Society","2000","122","","5664","5665","10.1021/ja000223p","","","0.71073","MoKα","","0.0281","0.0225","","","0.0587","0.0608","","","","","","1.034","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116023","10.0439","0.0006","10.7647","0.0007","35.262","0.002","90","","90","","90","","3812.5","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C24 H25 N O -","- C24 H25 N O -","- C192 H200 N8 O8 -","8","2","","David R. Spring; Shyam Krishnan; Stuart L. Schreiber","Towards Diversity-Oriented, Stereoselective Syntheses of Biaryl- or Bis(aryl)metal-Containing Medium Rings","Journal of the American Chemical Society","2000","122","","5656","5657","10.1021/ja0010507","","","0.71073","MoKα","","0.1214","0.0592","","","0.1123","0.1366","","","","","","1.03","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116024","10.0869","0.0006","10.8633","0.0006","35.817","0.002","90","","90","","90","","3924.7","0.4","213","2","213","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C24 H24 F N O -","- C24 H24 F N O -","- C192 H192 F8 N8 O8 -","8","2","","David R. Spring; Shyam Krishnan; Stuart L. Schreiber","Towards Diversity-Oriented, Stereoselective Syntheses of Biaryl- or Bis(aryl)metal-Containing Medium Rings","Journal of the American Chemical Society","2000","122","","5656","5657","10.1021/ja0010507","","","0.71073","MoKα","","0.0731","0.045","","","0.0937","0.1062","","","","","","1","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116025","9.4192","0.0001","10.1201","0.0001","11.8636","0.0003","90","","106.668","0.002","90","","1083.36","0.03","213","2","213","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C26 H29 N O3 -","- C26 H29 N O3 -","- C52 H58 N2 O6 -","2","1","","David R. Spring; Shyam Krishnan; Stuart L. Schreiber","Towards Diversity-Oriented, Stereoselective Syntheses of Biaryl- or Bis(aryl)metal-Containing Medium Rings","Journal of the American Chemical Society","2000","122","","5656","5657","10.1021/ja0010507","","","0.71073","MoKα","","0.0452","0.0424","","","0.1127","0.1144","","","","","","1.086","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116026","9.4494","0.0009","9.702","0.001","13.061","0.001","90","","110.371","0.002","90","","1122.52","0.18","213","2","213","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C26 H34 N O3 -","- C26 H34 N O3 -","- C52 H68 N2 O6 -","2","1","","David R. Spring; Shyam Krishnan; Stuart L. Schreiber","Towards Diversity-Oriented, Stereoselective Syntheses of Biaryl- or Bis(aryl)metal-Containing Medium Rings","Journal of the American Chemical Society","2000","122","","5656","5657","10.1021/ja0010507","","","0.71073","MoKα","","0.0463","0.0426","","","0.1096","0.1137","","","","","","1.068","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4116027","8.4546","0.0007","22.244","0.002","32.612","0.002","90","","90","","90","","6133.1","0.8","213","2","213","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C23 H30.67 N O3 -","- C23 H30.6667 N O3 -","- C276 H368 N12 O36 -","12","3","","David R. Spring; Shyam Krishnan; Stuart L. Schreiber","Towards Diversity-Oriented, Stereoselective Syntheses of Biaryl- or Bis(aryl)metal-Containing Medium Rings","Journal of the American Chemical Society","2000","122","","5656","5657","10.1021/ja0010507","","","0.71073","MoKα","","0.1093","0.0735","","","0.1948","0.2281","","","","","","1","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116028","9.9023","0.0009","10.6217","0.0009","18.945","0.001","90","","90","","90","","1992.6","0.3","213","2","213","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C26 H23 N O -","- C26 H23 N O -","- C104 H92 N4 O4 -","4","1","","David R. Spring; Shyam Krishnan; Stuart L. Schreiber","Towards Diversity-Oriented, Stereoselective Syntheses of Biaryl- or Bis(aryl)metal-Containing Medium Rings","Journal of the American Chemical Society","2000","122","","5656","5657","10.1021/ja0010507","","","0.71073","MoKα","","0.0661","0.0413","","","0.0823","0.094","","","","","","1.055","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116029","10.3574","0.0006","10.6801","0.0006","19.388","0.001","90","","90","","90","","2144.7","0.2","213","2","213","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C28 H26 N O -","- C28 H26 N O -","- C112 H104 N4 O4 -","4","1","","David R. Spring; Shyam Krishnan; Stuart L. Schreiber","Towards Diversity-Oriented, Stereoselective Syntheses of Biaryl- or Bis(aryl)metal-Containing Medium Rings","Journal of the American Chemical Society","2000","122","","5656","5657","10.1021/ja0010507","","","0.71073","MoKα","","0.0712","0.0483","","","0.1169","0.1296","","","","","","1.036","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4116030","10.0281","0.0004","11.4783","0.0005","16.8217","0.0007","90","","95.653","0.01","90","","1926.85","0.14","213","2","213","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C24 H25 N O -","- C24 H25 N O -","- C96 H100 N4 O4 -","4","2","","David R. Spring; Shyam Krishnan; Stuart L. Schreiber","Towards Diversity-Oriented, Stereoselective Syntheses of Biaryl- or Bis(aryl)metal-Containing Medium Rings","Journal of the American Chemical Society","2000","122","","5656","5657","10.1021/ja0010507","","","0.71073","MoKα","","0.0558","0.0414","","","0.0925","0.0983","","","","","","1.036","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116031","17.988","0.002","7.0987","0.0008","17.823","0.002","90","","109.749","0.008","90","","2142","0.4","293","2","293","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C24 H23 Cl2 N O -","- C24 H23 Cl2 N O -","- C96 H92 Cl8 N4 O4 -","4","1","","David R. Spring; Shyam Krishnan; Stuart L. Schreiber","Towards Diversity-Oriented, Stereoselective Syntheses of Biaryl- or Bis(aryl)metal-Containing Medium Rings","Journal of the American Chemical Society","2000","122","","5656","5657","10.1021/ja0010507","","","0.71073","MoKα","","0.0573","0.0517","","","0.1257","0.1278","","","","","","1.031","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116032","10.23","0.0003","9.0097","0.0003","12.3888","0.0003","90","","108.482","0.001","90","","1082.97","0.06","213","2","213","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C26 H29 N O3 -","- C26 H29 N O3 -","- C52 H58 N2 O6 -","2","1","","David R. Spring; Shyam Krishnan; Stuart L. Schreiber","Towards Diversity-Oriented, Stereoselective Syntheses of Biaryl- or Bis(aryl)metal-Containing Medium Rings","Journal of the American Chemical Society","2000","122","","5656","5657","10.1021/ja0010507","","","0.71073","MoKα","","0.0445","0.0327","","","0.0714","0.0746","","","","","","1.003","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116033","8.3269","0.0004","8.4131","0.0004","29.128","0.002","90","","90","","90","","2040.6","0.2","213","2","213","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C25 H27 N O3 -","- C25 H27 N O3 -","- C100 H108 N4 O12 -","4","1","","David R. Spring; Shyam Krishnan; Stuart L. Schreiber","Towards Diversity-Oriented, Stereoselective Syntheses of Biaryl- or Bis(aryl)metal-Containing Medium Rings","Journal of the American Chemical Society","2000","122","","5656","5657","10.1021/ja0010507","","","0.71073","MoKα","","0.0658","0.0465","","","0.0931","0.102","","","","","","1.015","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116034","8.4524","0.0007","8.0786","0.0007","13.8705","0.0012","90","","98.816","0.002","90","","935.94","0.14","213","2","213","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C21 H27 N O3 -","- C21 H27 N O3 -","- C42 H54 N2 O6 -","2","1","","David R. Spring; Shyam Krishnan; Stuart L. Schreiber","Towards Diversity-Oriented, Stereoselective Syntheses of Biaryl- or Bis(aryl)metal-Containing Medium Rings","Journal of the American Chemical Society","2000","122","","5656","5657","10.1021/ja0010507","","","0.71073","MoKα","","0.0412","0.0403","","","0.1094","0.1107","","","","","","1.021","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116035","10.555","0.002","10.119","0.002","26.478","0.004","90","","99.201","0.002","90","","2791.6","0.9","213","2","213","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C22 H23 N O S -","- C22 H23 N O S -","- C132 H138 N6 O6 S6 -","6","3","","David R. Spring; Shyam Krishnan; Stuart L. Schreiber","Towards Diversity-Oriented, Stereoselective Syntheses of Biaryl- or Bis(aryl)metal-Containing Medium Rings","Journal of the American Chemical Society","2000","122","","5656","5657","10.1021/ja0010507","","","0.71073","MoKα","","0.0991","0.0918","","","0.2415","0.2466","","","","","","1.073","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116036","10.0585","0.0005","10.4847","0.0005","34.977","0.002","90","","90","","90","","3688.7","0.3","213","2","213","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C22 H23 N O S -","- C22 H23 N O S -","- C176 H184 N8 O8 S8 -","8","2","","David R. Spring; Shyam Krishnan; Stuart L. Schreiber","Towards Diversity-Oriented, Stereoselective Syntheses of Biaryl- or Bis(aryl)metal-Containing Medium Rings","Journal of the American Chemical Society","2000","122","","5656","5657","10.1021/ja0010507","","","0.71073","MoKα","","0.0895","0.0544","","","0.0919","0.103","","","","","","1.059","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116037","5.2688","0.0003","21.7645","0.0012","9.7497","0.0006","90","","93.748","0.001","90","","1115.63","0.11","213","2","213","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C26 H24 Cl N O S -","- C26 H24 Cl N O S -","- C52 H48 Cl2 N2 O2 S2 -","2","1","","David R. Spring; Shyam Krishnan; Stuart L. Schreiber","Towards Diversity-Oriented, Stereoselective Syntheses of Biaryl- or Bis(aryl)metal-Containing Medium Rings","Journal of the American Chemical Society","2000","122","","5656","5657","10.1021/ja0010507","","","0.71073","MoKα","","0.0369","0.0318","","","0.0796","0.0823","","","","","","1.034","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116038","5.2543","0.0004","10.236","0.0008","11.3852","0.0009","71.562","0.001","87.505","0.001","80.018","0.001","572.06","0.08","213","2","213","2","","","","","","","","5","P 1","P 1","1","","","","- C26 H29 Hg N O3 -","- C26 H29 Hg N O3 -","- C26 H29 Hg N O3 -","1","1","","David R. Spring; Shyam Krishnan; Stuart L. Schreiber","Towards Diversity-Oriented, Stereoselective Syntheses of Biaryl- or Bis(aryl)metal-Containing Medium Rings","Journal of the American Chemical Society","2000","122","","5656","5657","10.1021/ja0010507","","","0.71073","MoKα","","0.0316","0.0315","","","0.0751","0.0752","","","","","","1.053","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116039","13.3079","0.0003","13.5922","0.0004","16.1716","0.0004","90","","108.582","0.0002","90","","2772.68","0.12","300","2","300","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C18 H30 Cl2 Fe N12 O8 -","- C18 H30 Cl2 Fe N12 O8 -","- C72 H120 Cl8 Fe4 N48 O32 -","4","0.5","","Justine P. Roth; Scott Lovell; James M. Mayer","Intrinsic Barriers for Electron and Hydrogen Atom Transfer Reactions of Biomimetic Iron Complexes","Journal of the American Chemical Society","2000","122","","5486","5498","10.1021/ja9941328","","","0.7107","MoKα","","0.0988","0.0742","","","0.2144","0.2315","","","","","","1.096","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116040","13.214","0.0002","13.407","0.0003","15.731","0.0003","90","","90","","90","","2786.91","0.09","298","2","298","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C18 H29 Cl2 Fe N12 O8 -","- C18 H29 Cl2 Fe N12 O8 -","- C72 H116 Cl8 Fe4 N48 O32 -","4","1","","Justine P. Roth; Scott Lovell; James M. Mayer","Intrinsic Barriers for Electron and Hydrogen Atom Transfer Reactions of Biomimetic Iron Complexes","Journal of the American Chemical Society","2000","122","","5486","5498","10.1021/ja9941328","","","0.7107","MoKα","","0.0904","0.0504","","","0.1412","0.1619","","","","","","1.03","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116041","17.5362","0.0015","14.1422","0.001","12.58","0.002","90","","90.45","0.004","90","","3119.7","0.6","161","2","161","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H30 Cl3 Fe N12 O12 -","- C18 H30 Cl3 Fe N12 O12 -","- C72 H120 Cl12 Fe4 N48 O48 -","4","1","","Justine P. Roth; Scott Lovell; James M. Mayer","Intrinsic Barriers for Electron and Hydrogen Atom Transfer Reactions of Biomimetic Iron Complexes","Journal of the American Chemical Society","2000","122","","5486","5498","10.1021/ja9941328","","","0.7107","MoKα","","0.0896","0.0635","","","0.1646","0.1845","","","","","","1.154","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116042","16.315","0.001","14.444","0.001","19.452","0.001","90","","105.52","0.005","90","","4416.8","0.5","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C36 H64 B10 Dy Na O5 -","- C36 H63 B10 Dy Na O5 -","- C144 H252 B40 Dy4 Na4 O20 -","4","1","","Kwoli Chui; Qingchuan Yang; Thomas C. W. Mak; Wai Han Lam; Zhenyang Lin; Zuowei Xie","Synthesis, Structure, and Bonding of d0/fn Metallacarboranes Incorporating the η7-Carboranyl Ligand","Journal of the American Chemical Society","2000","122","","5758","5764","10.1021/ja000188m","","","0.71073","MoKα","","0.0606","0.0537","","","0.1396","0.1453","","","","","","1.068","","","","has coordinates,has disorder","178931","2020-10-21","18:00:00",""
"4116043","16.354","0.002","14.331","0.0019","19.469","0.003","90","","105.59","0.008","90","","4395.1","1.1","294","2","294","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C72 H128 B20 Na2 O10 Y2 -","- C72 H126 B20 Na2 O10 Y2 -","- C144 H252 B40 Na4 O20 Y4 -","2","0.5","","Kwoli Chui; Qingchuan Yang; Thomas C. W. Mak; Wai Han Lam; Zhenyang Lin; Zuowei Xie","Synthesis, Structure, and Bonding of d0/fn Metallacarboranes Incorporating the η7-Carboranyl Ligand","Journal of the American Chemical Society","2000","122","","5758","5764","10.1021/ja000188m","","","0.71073","MoKα","","0.0918","0.0758","","","0.2015","0.2165","","","","","","1.1","","","","has coordinates","183806","2020-10-21","18:00:00",""
"4116044","16.315","0.001","14.444","0.001","19.452","0.001","90","","105.52","0.005","90","","4416.8","0.5","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C36 H64 B10 Er Na O5 -","- C36 H63 B10 Er Na O5 -","- C144 H252 B40 Er4 Na4 O20 -","4","1","","Kwoli Chui; Qingchuan Yang; Thomas C. W. Mak; Wai Han Lam; Zhenyang Lin; Zuowei Xie","Synthesis, Structure, and Bonding of d0/fn Metallacarboranes Incorporating the η7-Carboranyl Ligand","Journal of the American Chemical Society","2000","122","","5758","5764","10.1021/ja000188m","","","0.71073","MoKα","","0.05","0.0453","","","0.1366","0.1421","","","","","","1.04","","","","has coordinates,has disorder","178931","2020-10-21","18:00:00",""
"4116045","9.5966","0.0015","14.867","0.003","16.246","0.003","114.37","0.011","102.23","0.008","90.44","0.01","2051.6","0.7","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C56 H108 B20 Er2 Na2 O12 -","- C56 H108 B20 Er2 Na2 O12 -","- C56 H108 B20 Er2 Na2 O12 -","1","0.5","","Kwoli Chui; Qingchuan Yang; Thomas C. W. Mak; Wai Han Lam; Zhenyang Lin; Zuowei Xie","Synthesis, Structure, and Bonding of d0/fn Metallacarboranes Incorporating the η7-Carboranyl Ligand","Journal of the American Chemical Society","2000","122","","5758","5764","10.1021/ja000188m","","","0.71073","MoKα","","0.0694","0.0646","","","0.1711","0.1759","","","","","","1.028","","","","has coordinates","183806","2020-10-21","18:00:00",""
"4116046","16.724","0.003","14.249","0.003","18.53","0.004","90","","103.83","0.03","90","","4287.7","1.6","294","2","294","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C36 H64 B10 Li O5 Y -","- C36 H64 B10 Li O5 Y -","- C144 H256 B40 Li4 O20 Y4 -","4","1","","Kwoli Chui; Qingchuan Yang; Thomas C. W. Mak; Wai Han Lam; Zhenyang Lin; Zuowei Xie","Synthesis, Structure, and Bonding of d0/fn Metallacarboranes Incorporating the η7-Carboranyl Ligand","Journal of the American Chemical Society","2000","122","","5758","5764","10.1021/ja000188m","","","0.71073","MoKα","","0.1269","0.0869","","","0.1619","0.1797","","","","","","1.168","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"4116047","16.742","0.003","14.225","0.003","18.483","0.004","90","","103.95","0.03","90","","4272","1.6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C36 H64 B10 Er Li O5 -","- C36 H64 B10 Er Li O5 -","- C144 H256 B40 Er4 Li4 O20 -","4","1","","Kwoli Chui; Qingchuan Yang; Thomas C. W. Mak; Wai Han Lam; Zhenyang Lin; Zuowei Xie","Synthesis, Structure, and Bonding of d0/fn Metallacarboranes Incorporating the η7-Carboranyl Ligand","Journal of the American Chemical Society","2000","122","","5758","5764","10.1021/ja000188m","","","0.71073","MoKα","","0.0556","0.0483","","","0.1237","0.1286","","","","","","1.077","","","","has coordinates,has disorder","178931","2020-10-21","18:00:00",""
"4116048","6.0733","0.0003","13.5299","0.001","17.704","0.0013","84.051","0.003","87.394","0.004","82.095","0.004","1432.45","0.17","100","1","100","1","","","","","","","","5","P -1","-P 1","2","","","","- C16 H20 B Fe N -","- C16 H22 B Fe N -","- C64 H88 B4 Fe4 N4 -","4","2","","Andrea Berenbaum; Holger Braunschweig; Regina Dirk; Ulli Englert; Jennifer C. Green; Frieder Jäkle; Alan J. Lough; Ian Manners","Synthesis, Electronic Structure, and Novel Reactivity of Strained, Boron-Bridged [1]Ferrocenophanes","Journal of the American Chemical Society","2000","122","","5765","5774","10.1021/ja000311+","","","0.71073","MoKα","","0.0944","0.0511","","","0.1181","0.1314","","","","","","0.957","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116049","14.475","0.002","14.554","0.002","12.27","0.001","108.474","0.008","107.348","0.008","89.14","0.01","2331.1","0.5","296.2","","296.2","","","","","","","","","6","P -1","-P 1","2","","","","- C35 H44 Cl3 Cu2 N11 O15 -","- C35 Cl3 Cu2 N11 O15 -","- C70 Cl6 Cu4 N22 O30 -","2","1","","Hideki Ohtsu; Yuichi Shimazaki; Akira Odani; Osamu Yamauchi; Wasuke Mori; Shinobu Itoh; Shunichi Fukuzumi","Synthesis and Characterization of Imidazolate-Bridged Dinuclear Complexes as Active Site Models of Cu,Zn-SOD","Journal of the American Chemical Society","2000","122","","5733","5741","10.1021/ja994050j","","","1.5418","CuKα","","0.1558","0.073","","0.1506","0.109","","","","1.028","1.02","1.02","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116050","9.843","0.002","18.361","0.002","25.111","0.003","90","","97.84","0.02","90","","4495.8","1.2","296.2","","296.2","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C33 H49 Cl3 Cu2 N8 O18 -","- C33 Cl3 Cu2 N8 O18 -","- C132 Cl12 Cu8 N32 O72 -","4","1","","Hideki Ohtsu; Yuichi Shimazaki; Akira Odani; Osamu Yamauchi; Wasuke Mori; Shinobu Itoh; Shunichi Fukuzumi","Synthesis and Characterization of Imidazolate-Bridged Dinuclear Complexes as Active Site Models of Cu,Zn-SOD","Journal of the American Chemical Society","2000","122","","5733","5741","10.1021/ja994050j","","","1.5418","CuKα","","0.1907","0.0838","","0.1865","0.1321","","","","1.135","1.21","1.21","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116051","14.861","0.005","10.784","0.005","35.597","0.004","90","","90.57","0.02","90","","5705","3","296.2","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H25 Cl2 Cu N7 O8 -","- C21 Cl2 Cu N7 O8 -","- C168 Cl16 Cu8 N56 O64 -","8","2","","Hideki Ohtsu; Yuichi Shimazaki; Akira Odani; Osamu Yamauchi; Wasuke Mori; Shinobu Itoh; Shunichi Fukuzumi","Synthesis and Characterization of Imidazolate-Bridged Dinuclear Complexes as Active Site Models of Cu,Zn-SOD","Journal of the American Chemical Society","2000","122","","5733","5741","10.1021/ja994050j","","","0.7107","MoKα","","","0.075","","","","0.1053","","","","","","1.219","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116052","12.51","0.002","9.959","0.003","16.949","0.005","90","","90","","90","","2111.6","1","20","","20","","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C26 H16 Fe N6 S2 -","- C26 H16 Fe N6 S2 -","- C104 H64 Fe4 N24 S8 -","4","0.5","","Jey-Jau Lee; Hwo-shuenn Sheu; Chi-Rung Lee; Jin-Ming Chen; Jyh-Fu Lee; Chih-Chieh Wang; Chun-Hsun Huang; Yu Wang","X-ray Absorption Spectroscopic Studies on Light-Induced Excited Spin State Trapping of an Fe(II) Complex","Journal of the American Chemical Society","2000","122","","5742","5747","10.1021/ja9943290","","","0.642","Synchrotron","","0.069","0.069","","0.064","0.064","","","","","3.29","3.29","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116053","9.982","0.006","10","0.001","9.576","0.004","97.96","0.03","114.87","0.03","107.67","0.02","786.2","0.7","288.2","","","","","","","","","","","7","P -1","-P 1","2","","","","- C6 H15 Ge N2 O12 P3 Zn -","- C6 H15 Ge N2 O12 P3 Zn -","- C12 H30 Ge2 N4 O24 P6 Zn2 -","2","1","","Jianmin Li; Yanxiong Ke; Yugen Zhang; Gaofei He; Zheng Jiang; Masayoshi Nishiura; Tsuneo Imamoto","((DABCO).ZnGe(HPO4)3: The First Zinco-Germanophosphate with a Unique Asymmetric Cage","Journal of the American Chemical Society","2000","122","","6110","6111","10.1021/ja000107m","","","0.7107","MoKα","","","0.0685","","","","0.1251","","","","","","3.192","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116054","10.797","0.002","22.824","0.004","8.768","0.003","90","","90","","90","","2160.7","0.9","173","1","173","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(2S,3R,4S)-5,5-diphenyl-2-methoxycarbonyl-3-(4-methoxyphenyl)- 4-nitropyrrolidine","","- C25 H24 N2 O5 -","- C25 H24 N2 O5 -","- C100 H96 N8 O20 -","4","1","","Silvia Vivanco; Begoña Lecea; Ana Arrieta; Pilar Prieto; Iñaki Morao; Anthony Linden; Fernando P. Cossío","Origins of the Loss of Concertedness in Pericyclic Reactions: Theoretical Prediction and Direct Observation of Stepwise Mechanisms in [3 + 2] Thermal Cycloadditions","Journal of the American Chemical Society","2000","122","","6078","6092","10.1021/ja9945360","","","0.71069","MoKα","","","0.0399","","","","0.0359","","","","","","1.767","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4116055","10.6","0.001","15.514","0.002","10.014","0.002","90","","111.58","0.01","90","","1531.4","0.4","173","1","173","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(2S*,3R*)-Methyl 2-acetamido-3-(4-methoxyphenyl)-4-nitrobutyrate","","- C14 H18 N2 O6 -","- C14 H18 N2 O6 -","- C56 H72 N8 O24 -","4","1","","Silvia Vivanco; Begoña Lecea; Ana Arrieta; Pilar Prieto; Iñaki Morao; Anthony Linden; Fernando P. Cossío","Origins of the Loss of Concertedness in Pericyclic Reactions: Theoretical Prediction and Direct Observation of Stepwise Mechanisms in [3 + 2] Thermal Cycloadditions","Journal of the American Chemical Society","2000","122","","6078","6092","10.1021/ja9945360","","","0.71069","MoKα","","0.1642","0.0589","","0.0549","0.0463","0.0463","","","1.392","","","1.686","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116056","18.2411","0.0008","22.9074","0.0008","24.7429","0.0012","90.442","0.002","77.707","0.002","78.95","0.002","9901.9","0.7","175","","","","","","","","","","Local laboratory","6","P -1","-P 1","2","","","","- C176 H220 Cl4 N14 O32 Zn2 -","- C174 Cl4 N14 O32 Zn2 -","- C348 Cl8 N28 O64 Zn4 -","2","1","","Olivier Sénèque; Marie-Noëlle Rager; Michel Giorgi; Olivia Reinaud","Calix[6]arenes and Zinc: Biomimetic Receptors for Neutral Molecules","Journal of the American Chemical Society","2000","122","","6183","6189","10.1021/ja000185+","","","0.71073","xray","","","0.125","","","0.1339","","","","","5.09","5.09","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116057","14.5244","0.0004","15.819","0.0005","23.3483","0.0006","90.34","0.001","104.163","0.001","108.724","0.001","4905.3","0.2","298","","","","","","","","","","Local laboratory","6","P -1","-P 1","2","","","","- C97 H134 Cl2 N10 O14 Zn -","- C97 H115 Cl2 N10 O15.5 Zn -","- C194 H230 Cl4 N20 O31 Zn2 -","2","1","","Olivier Sénèque; Marie-Noëlle Rager; Michel Giorgi; Olivia Reinaud","Calix[6]arenes and Zinc: Biomimetic Receptors for Neutral Molecules","Journal of the American Chemical Society","2000","122","","6183","6189","10.1021/ja000185+","","","0.71073","xray","","","0.054","","","0.092","","","","","2.408","2.408","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116058","12.5434","0.001","18.0749","0.0014","14.1236","0.0011","90","","109.767","0.001","90","","3013.4","0.4","233","2","233","2","","","","","","","","8","P 1 21 1","P 2yb","4","","","","- C30.5 H32.5 Cl F3 N O5 Pt S -","- C28.5 H32.5 Cl F3 N3 O5 Pt S -","- C114 H130 Cl4 F12 N12 O20 Pt4 S4 -","4","2","","James A. Johnson; Dalibor Sames","C-H Bond Activation of Hydrocarbon Segments in Complex Organic Molecules: Total Synthesis of the Antimitotic Rhazinilam","Journal of the American Chemical Society","2000","122","","6321","6322","10.1021/ja0003223","","","0.71073","MoKα","","0.0397","0.0374","","","0.1023","0.105","","","","","","1.052","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116059","10.024","0.003","10.22","0.003","10.727","0.004","74.42","0.03","74.58","0.02","84.77","0.03","1020.2","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H14 Cu2 N2 O6 -","- C22 H14 Cu2 N2 O6 -","- C44 H28 Cu4 N4 O12 -","2","1","","Samuel M-F. Lo; Stephen S-Y. Chui; Lai-Yung Shek; Zhenyang Lin; Xi Xiang Zhang; Ge-hei Wen; Ian D. Williams","Solvothermal Synthesis of a Stable Coordination Polymer with Copper-I-Copper-II Dimer Units: [Cu4{1,4-C6H4(COO)2}3(4,4'-bipy)2]n","Journal of the American Chemical Society","2000","122","","6293","6294","10.1021/ja000416c","","","0.71073","MoKα","","0.0516","0.0408","","","0.1025","0.1094","","","","","","1.047","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116060","27.004","0.004","27.004","0.004","12.23","0.002","90","","90","","90","","8918","2","20","2","20","2","","","","","","","synthesis","5","I -4","I -4","82","","","","- C42 H36 Cl6 Co3 N12 -","- C42 H33.8 Cl6 Co3 N12 -","- C336 H270.4 Cl48 Co24 N96 -","8","1","","Rodolphe Clérac; F. Albert Cotton; Lee M. Daniels; Kim R. Dunbar; Kristin Kirschbaum; Carlos A. Murillo; A. Alan Pinkerton; Arthur J. Schultz; Xiaoping Wang","Linear Tricobalt Compounds with Di(2-pyridyl)amide (dpa) Ligands: Temperature Dependence of the Structural and Magnetic Properties of Symmetrical and Unsymmetrical Forms of Co3(dpa)4Cl2 in the Solid State","Journal of the American Chemical Society","2000","122","","6226","6236","10.1021/ja000515q","","","0.56086","AgKα","","0.056","0.0416","","0.0952","0.0903","","","","1.055","1.102","1.102","","","","","has coordinates,has disorder","178931","2020-10-21","18:00:00",""
"4116061","12.9014","0.0006","14.0313","0.0006","11.2384","0.0001","90","","90","","90","","2034.41","0.13","296","2","296","2","","","","","","","synthesis","5","P n n 2","P 2 -2n","34","","","","- C41 H34 Cl4 Co3 N12 -","- C41 H34 Cl4 Co3 N12 -","- C82 H68 Cl8 Co6 N24 -","2","0.5","","Rodolphe Clérac; F. Albert Cotton; Lee M. Daniels; Kim R. Dunbar; Kristin Kirschbaum; Carlos A. Murillo; A. Alan Pinkerton; Arthur J. Schultz; Xiaoping Wang","Linear Tricobalt Compounds with Di(2-pyridyl)amide (dpa) Ligands: Temperature Dependence of the Structural and Magnetic Properties of Symmetrical and Unsymmetrical Forms of Co3(dpa)4Cl2 in the Solid State","Journal of the American Chemical Society","2000","122","","6226","6236","10.1021/ja000515q","","","0.71073","MoKα","","0.0379","0.036","","0.092","0.0902","","","","1.097","1.097","1.097","","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116062","11.176","0.002","13.92","0.002","12.74","0.002","90","","90.056","0.009","90","","1982","0.6","109","2","109","2","","","","","","","synthesis","5","P 1 n 1","P -2yac","7","","","","- C41 H34 Cl4 Co3 N12 -","- C41 H34 Cl4 Co3 N12 -","- C82 H68 Cl8 Co6 N24 -","2","1","","Rodolphe Clérac; F. Albert Cotton; Lee M. Daniels; Kim R. Dunbar; Kristin Kirschbaum; Carlos A. Murillo; A. Alan Pinkerton; Arthur J. Schultz; Xiaoping Wang","Linear Tricobalt Compounds with Di(2-pyridyl)amide (dpa) Ligands: Temperature Dependence of the Structural and Magnetic Properties of Symmetrical and Unsymmetrical Forms of Co3(dpa)4Cl2 in the Solid State","Journal of the American Chemical Society","2000","122","","6226","6236","10.1021/ja000515q","","","0.71073","MOKα","","0.0327","0.0311","","0.0804","0.0794","","","","1.097","1.094","1.094","","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116063","27.378","0.002","27.378","0.002","12.318","0.001","90","","90","","90","","9233","1.2","298","2","298","2","","","","","","","synthesis","5","I -4","I -4","82","","","","- C42 H36 Cl6 Co3 N12 -","- C42 H34 Cl6.01 Co3 N12 -","- C336 H272 Cl48.08 Co24 N96 -","8","1","","Rodolphe Clérac; F. Albert Cotton; Lee M. Daniels; Kim R. Dunbar; Kristin Kirschbaum; Carlos A. Murillo; A. Alan Pinkerton; Arthur J. Schultz; Xiaoping Wang","Linear Tricobalt Compounds with Di(2-pyridyl)amide (dpa) Ligands: Temperature Dependence of the Structural and Magnetic Properties of Symmetrical and Unsymmetrical Forms of Co3(dpa)4Cl2 in the Solid State","Journal of the American Chemical Society","2000","122","","6226","6236","10.1021/ja000515q","","","0.71073","MoKα","","0.0439","0.0406","","0.1044","0.1008","","","","1.077","1.071","1.071","","","","","has coordinates,has disorder","178931","2020-10-21","18:00:00",""
"4116064","27.2558","0.0008","27.2558","0.0008","12.2451","0.0007","90","","90","","90","","9096.6","0.6","213","2","213","2","","","","","","","synthesis","5","I -4","I -4","82","","","","- C42 H36 Cl6 Co3 N12 -","- C42 H34 Cl6.01 Co3 N12 -","- C336 H272 Cl48.08 Co24 N96 -","8","1","","Rodolphe Clérac; F. Albert Cotton; Lee M. Daniels; Kim R. Dunbar; Kristin Kirschbaum; Carlos A. Murillo; A. Alan Pinkerton; Arthur J. Schultz; Xiaoping Wang","Linear Tricobalt Compounds with Di(2-pyridyl)amide (dpa) Ligands: Temperature Dependence of the Structural and Magnetic Properties of Symmetrical and Unsymmetrical Forms of Co3(dpa)4Cl2 in the Solid State","Journal of the American Chemical Society","2000","122","","6226","6236","10.1021/ja000515q","","","0.71073","MoKα","","0.0405","0.0383","","0.093","0.091","","","","1.136","1.138","1.138","","","","","has coordinates,has disorder","178931","2020-10-21","18:00:00",""
"4116065","27.189","0.001","27.189","0.001","12.2293","0.0007","90","","90","","90","","9040.4","0.7","173","2","173","2","","","","","","","synthesis","5","I -4","I -4","82","","","","- C42 H36 Cl6 Co3 N12 -","- C42 H34 Cl6.01 Co3 N12 -","- C336 H272 Cl48.08 Co24 N96 -","8","1","","Rodolphe Clérac; F. Albert Cotton; Lee M. Daniels; Kim R. Dunbar; Kristin Kirschbaum; Carlos A. Murillo; A. Alan Pinkerton; Arthur J. Schultz; Xiaoping Wang","Linear Tricobalt Compounds with Di(2-pyridyl)amide (dpa) Ligands: Temperature Dependence of the Structural and Magnetic Properties of Symmetrical and Unsymmetrical Forms of Co3(dpa)4Cl2 in the Solid State","Journal of the American Chemical Society","2000","122","","6226","6236","10.1021/ja000515q","","","0.71073","MoKα","","0.0395","0.0378","","0.092","0.0902","","","","1.022","1.02","1.02","","","","","has coordinates,has disorder","178931","2020-10-21","18:00:00",""
"4116066","27.128","0.001","27.128","0.001","12.2094","0.0009","90","","90","","90","","8985.2","0.8","133","2","133","2","","","","","","","synthesis","5","I -4","I -4","82","","","","- C42 H36 Cl6 Co3 N12 -","- C42 H34 Cl6.01 Co3 N12 -","- C336 H272 Cl48.08 Co24 N96 -","8","1","","Rodolphe Clérac; F. Albert Cotton; Lee M. Daniels; Kim R. Dunbar; Kristin Kirschbaum; Carlos A. Murillo; A. Alan Pinkerton; Arthur J. Schultz; Xiaoping Wang","Linear Tricobalt Compounds with Di(2-pyridyl)amide (dpa) Ligands: Temperature Dependence of the Structural and Magnetic Properties of Symmetrical and Unsymmetrical Forms of Co3(dpa)4Cl2 in the Solid State","Journal of the American Chemical Society","2000","122","","6226","6236","10.1021/ja000515q","","","0.71073","MoKα","","0.0386","0.037","","0.0962","0.0944","","","","1.084","1.081","1.081","","","","","has coordinates,has disorder","178931","2020-10-21","18:00:00",""
"4116067","13.477","0.002","21.479","0.001","9.863","0.001","90","","90","","90","","2855.1","0.5","296.2","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C27 H43 B Br O2 P -","- C27 H43 B Br O2 P -","- C108 H172 B4 Br4 O8 P4 -","4","1","","Tsuneo Imamoto; Hideaki Morishita","An Enantiomerically Pure Tetracoordinate Boron Compound: Stereochemistry of Substitution Reactions at the Chirogenic Boron Atom","Journal of the American Chemical Society","2000","122","","6329","6330","10.1021/ja0011764","","","1.5418","CuKα","","","0.0948","","","","0.1321","","","","","","2.771","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116068","7.666","0.002","17.2","0.002","8.955","0.002","90","","109.84","0.02","90","","1110.7","0.4","296.2","","","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C20 H37 B Br O2 P -","- C20 H37 B Br O2 P -","- C40 H74 B2 Br2 O4 P2 -","2","1","","Tsuneo Imamoto; Hideaki Morishita","An Enantiomerically Pure Tetracoordinate Boron Compound: Stereochemistry of Substitution Reactions at the Chirogenic Boron Atom","Journal of the American Chemical Society","2000","122","","6329","6330","10.1021/ja0011764","","","1.5418","CuKα","","","0.0955","","","","0.1288","","","","","","1.866","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116069","7.611","0.002","17.309","0.002","8.95","0.002","90","","110.24","0.01","90","","1106.3","0.4","296.2","","","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C21 H37 B N O2 P -","- C21 H37 B N O2 P -","- C42 H74 B2 N2 O4 P2 -","2","1","","Tsuneo Imamoto; Hideaki Morishita","An Enantiomerically Pure Tetracoordinate Boron Compound: Stereochemistry of Substitution Reactions at the Chirogenic Boron Atom","Journal of the American Chemical Society","2000","122","","6329","6330","10.1021/ja0011764","","","1.5418","CuKα","","","0.0545","","","","0.0847","","","","","","1.901","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116070","8.9674","0.0005","11.8249","0.0006","37.037","0.002","90","","92.577","0.001","90","","3923.4","0.4","173","2","173","2","","","","","","","Patrick Holland","6","P 1 21/n 1","-P 2yn","14","00104","A(iPr)CuSCPh2(CH2OCH3)","","- C44 H56 Cu N2 O S -","- C44 H56 Cu N2 O S -","- C176 H224 Cu4 N8 O4 S4 -","4","1","","Patrick L. Holland; William B. Tolman","A Structural Model of the Type 1 Copper Protein Active Site: N2S(thiolate)S(thioether) Ligation in a Cu(II) Complex","Journal of the American Chemical Society","2000","122","","6331","6332","10.1021/ja001328v","","","0.71073","MoKα","","0.1083","0.0648","","","0.1263","0.14","","","","","","1.042","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116071","31.7444","0.0015","31.7444","0.0015","23.6164","0.0011","90","","90","","120","","20610","1.7","173","2","173","2","","","","","","","Patrick Holland","5","R -3 :H","-R 3","148","00122","L(iPr)Cu(SCPh2CH2SCH3) * (C2H5)2O","","- C44 H56 Cu N2 S2 -","- C44 H56 Cu N2 S2 -","- C792 H1008 Cu18 N36 S36 -","18","1","","Patrick L. Holland; William B. Tolman","A Structural Model of the Type 1 Copper Protein Active Site: N2S(thiolate)S(thioether) Ligation in a Cu(II) Complex","Journal of the American Chemical Society","2000","122","","6331","6332","10.1021/ja001328v","","","0.71073","MoKα","","0.12","0.0578","","","0.1083","0.1271","","","","","","1.026","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116072","12.866","0.003","15.594","0.003","18.197","0.004","67.33","0.03","76.78","0.03","73.38","0.03","3199","1.4","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C34 H48 Ti -","- C34 H48 Ti -","- C136 H192 Ti4 -","4","2","","Paul-Michael Pellny; Vladimir V. Burlakov; Perdita Arndt; Wolfgang Baumann; Anke Spannenberg; Uwe Rosenthal","Reactions of Hexatriynes with Permethyltitanocene and -zirconocene Complexes: First NMR Observation of a Metallocene Sliding along a Polyyne Chain","Journal of the American Chemical Society","2000","122","","6317","6318","10.1021/ja994393h","","","0.71073","MoKα","","0.0961","0.0525","","0.1332","0.1203","","","","0.879","1.083","1.083","","","","","has coordinates,has disorder","178931","2020-10-21","18:00:00",""
"4116073","9.093","0.002","30.743","0.006","11.625","0.002","90","","106.23","0.03","90","","3120.2","1.2","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C34 H48 Zr -","- C34 H48 Zr -","- C136 H192 Zr4 -","4","1","","Paul-Michael Pellny; Vladimir V. Burlakov; Perdita Arndt; Wolfgang Baumann; Anke Spannenberg; Uwe Rosenthal","Reactions of Hexatriynes with Permethyltitanocene and -zirconocene Complexes: First NMR Observation of a Metallocene Sliding along a Polyyne Chain","Journal of the American Chemical Society","2000","122","","6317","6318","10.1021/ja994393h","","","0.71073","MoKα","","0.0534","0.0367","","0.0859","0.0821","","","","0.939","1.055","1.055","","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116074","14.075","0.002","17.906","0.007","23.885","0.003","90","","106.455","0.017","90","","5773","3","220","2","220","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Na(H2O)(bicyclicbenzocrown)Cl.(2.62CHCl3).(0.31C6H14).(1.14H2O)","","- C48.48 H53.24 Cl8.86 N4 Na O12.14 -","- C48.48 H44.62 Cl8.86 N4 Na O12.14 -","- C193.92 H178.48 Cl35.44 N16 Na4 O48.56 -","4","1","","Martin J. Deetz; Maoyu Shang; Bradley D. Smith","A Macrobicyclic Receptor with Versatile Recognition Properties: Simultaneous Binding of an Ion Pair and Selective Complexation of Dimethylsulfoxide","Journal of the American Chemical Society","2000","122","","6201","6207","10.1021/ja994487r","","","0.71073","MoKα","","0.1393","0.0925","","","0.2408","0.2782","","","","","","1.056","","","","has coordinates,has disorder","178931","2020-10-21","18:00:00",""
"4116075","38.531","0.003","14.1236","0.001","17.5199","0.0017","90","","102.88","0.003","90","","9294.4","1.3","220","2","220","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(dicarboxamidedibenzocrown).2.0H2O.1.5Me2SO","","- C47 H55 N4 O13.5 S1.5 -","- C47.008 H55 N4 O13.5 S1.5 -","- C376.064 H440 N32 O108 S12 -","8","1","","Martin J. Deetz; Maoyu Shang; Bradley D. Smith","A Macrobicyclic Receptor with Versatile Recognition Properties: Simultaneous Binding of an Ion Pair and Selective Complexation of Dimethylsulfoxide","Journal of the American Chemical Society","2000","122","","6201","6207","10.1021/ja994487r","","","0.71073","MoKα","","0.1256","0.0856","","","0.2165","0.2462","","","","","","0.989","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4116076","17.254","0.004","15.452","0.005","24.427","0.006","90","","106.28","0.01","90","","6251","3","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C63 H79 F3 Fe2 N8 O8 S -","- C63 H79 F3 Fe2 N8 O8 S -","- C252 H316 F12 Fe8 N32 O32 S4 -","4","1","","Sonha C. Payne; Karl S. Hagen","Steric Control of Reactivity of Non-Heme μ-Hydroxo Diiron(II) Complexes with Oxygen: Isolation of a Strongly Coupled μ-Oxo Fe(II)Fe(III) Dimer","Journal of the American Chemical Society","2000","122","","6399","6410","10.1021/ja991885l","","","0.71073","MoKα","","0.0834","0.0604","","0.1847","0.1609","","","","1.038","1.055","1.055","","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116077","20.418","0.002","19.2789","0.0014","37.606","0.002","90","","90","","90","","14803","2","173","2","173","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C84 H96 B Fe2 N7 O5 -","- C84 H96 B Fe2 N7 O5 -","- C672 H768 B8 Fe16 N56 O40 -","8","1","","Sonha C. Payne; Karl S. Hagen","Steric Control of Reactivity of Non-Heme μ-Hydroxo Diiron(II) Complexes with Oxygen: Isolation of a Strongly Coupled μ-Oxo Fe(II)Fe(III) Dimer","Journal of the American Chemical Society","2000","122","","6399","6410","10.1021/ja991885l","","","1.54178","CuKα","","0.1226","0.0816","","0.3213","0.2153","","","","1.021","1.012","1.012","","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116078","20.7008","0.0003","19.6161","0.0001","30.3179","0.0005","90","","90","","90","","12311.2","0.3","173","2","173","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C63 H67 F3 Fe2 N6 O9 S -","- C61 H60 F3 Fe2 N6 O8.5 S -","- C488 H480 F24 Fe16 N48 O68 S8 -","8","1","","Sonha C. Payne; Karl S. Hagen","Steric Control of Reactivity of Non-Heme μ-Hydroxo Diiron(II) Complexes with Oxygen: Isolation of a Strongly Coupled μ-Oxo Fe(II)Fe(III) Dimer","Journal of the American Chemical Society","2000","122","","6399","6410","10.1021/ja991885l","","","0.71073","MoKα","","0.1087","0.0887","","0.2409","0.2261","","","","1.165","1.216","1.216","","","","","has coordinates,has disorder","178931","2020-10-21","18:00:00",""
"4116079","20.5573","0.0009","19.3176","0.0008","37.7437","0.0014","90","","90","","90","","14988.7","1.1","296","2","296","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C84 H95 B Fe2 N7 O5 -","- C84 H95 B Fe2 N7 O5 -","- C672 H760 B8 Fe16 N56 O40 -","8","1","","Sonha C. Payne; Karl S. Hagen","Steric Control of Reactivity of Non-Heme μ-Hydroxo Diiron(II) Complexes with Oxygen: Isolation of a Strongly Coupled μ-Oxo Fe(II)Fe(III) Dimer","Journal of the American Chemical Society","2000","122","","6399","6410","10.1021/ja991885l","","","1.54178","CuKα","","0.1304","0.0716","","0.2175","0.1729","","","","1.022","1.113","1.113","","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116080","16.171","0.005","15.182","0.002","27.989","0.006","90","","105.23","0.02","90","","6630","3","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C64 H82 F6 Fe2 N6 O13 S2 -","- C64 H82 F6 Fe2 N6 O13 S2 -","- C256 H328 F24 Fe8 N24 O52 S8 -","4","1","","Sonha C. Payne; Karl S. Hagen","Steric Control of Reactivity of Non-Heme μ-Hydroxo Diiron(II) Complexes with Oxygen: Isolation of a Strongly Coupled μ-Oxo Fe(II)Fe(III) Dimer","Journal of the American Chemical Society","2000","122","","6399","6410","10.1021/ja991885l","","","1.54178","CuKα","","0.1463","0.0802","","0.2191","0.179","","","","1.02","1.13","1.13","","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116081","12.937","0.002","14.977","0.003","25.627","0.005","93.84","0.01","91.12","0.01","96.26","0.01","4922.9","1.6","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C112 H119 B2 Fe2 N8 O7 -","- C112 H119 B2 Fe2 N8 O7 -","- C224 H238 B4 Fe4 N16 O14 -","2","1","","Sonha C. Payne; Karl S. Hagen","Steric Control of Reactivity of Non-Heme μ-Hydroxo Diiron(II) Complexes with Oxygen: Isolation of a Strongly Coupled μ-Oxo Fe(II)Fe(III) Dimer","Journal of the American Chemical Society","2000","122","","6399","6410","10.1021/ja991885l","","","1.54178","CuKα","","0.0954","0.0657","","0.2025","0.1753","","","","1.015","1.074","1.074","","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116082","10.4432","0.0004","8.7916","0.0004","29.4646","0.0012","90","","97.298","0.001","90","","2683.3","0.19","188","2","188","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H38 N6 O8 Zn2 -","- C20 H38 N6 O8 Zn2 -","- C80 H152 N24 O32 Zn8 -","4","1","","Natalia V. Kaminskaia; Bernhard Spingler; Stephen J. Lippard","Hydrolysis of β-Lactam Antibiotics Catalyzed by Dinuclear Zinc(II) Complexes: Functional Mimics of Metallo-β-lactamases","Journal of the American Chemical Society","2000","122","","6411","6422","10.1021/ja993704l","","","0.71073","MoKα","","0.0809","0.0433","","","0.1209","0.1382","","","","","","0.844","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116083","14.017","0.005","11.416","0.005","16.931","0.005","90","0.005","111.462","0.005","90","0.005","2521.4","1.6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Zn2L1(OH)(NO3)2","","","- C19 H36 N6 O8 Zn2 -","- C19 H36 N6 O8 Zn2 -","- C76 H144 N24 O32 Zn8 -","4","0.5","","Natalia V. Kaminskaia; Bernhard Spingler; Stephen J. Lippard","Hydrolysis of β-Lactam Antibiotics Catalyzed by Dinuclear Zinc(II) Complexes: Functional Mimics of Metallo-β-lactamases","Journal of the American Chemical Society","2000","122","","6411","6422","10.1021/ja993704l","","","0.71069","MoKα","","0.0625","0.035","","","0.0738","0.081","","","","","","0.976","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116084","8.6489","0.0001","17.2821","0.0002","19.5061","0.0005","90","","97.583","0.001","90","","2890.1","0.09","188","2","188","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H28 Br N7 O10 Zn2 -","- C20 H18 Br N7 O10 Zn2 -","- C80 H72 Br4 N28 O40 Zn8 -","4","1","","Natalia V. Kaminskaia; Bernhard Spingler; Stephen J. Lippard","Hydrolysis of β-Lactam Antibiotics Catalyzed by Dinuclear Zinc(II) Complexes: Functional Mimics of Metallo-β-lactamases","Journal of the American Chemical Society","2000","122","","6411","6422","10.1021/ja993704l","","","0.71073","MoKα","","0.0459","0.0381","","","0.1384","0.1453","","","","","","1.19","","","","has coordinates,has disorder","178931","2020-10-21","18:00:00",""
"4116085","25.0187","0.0003","25.0187","0.0003","8.6641","0.0002","90","","90","","90","","5423.17","0.16","188","2","188","2","","","","","","","","5","P -4 21 c","P -4 2n","114","","","","- C19 H35 N7 O10 Zn2 -","- C19 H35 N7 O10 Zn2 -","- C152 H280 N56 O80 Zn16 -","8","1","","Natalia V. Kaminskaia; Bernhard Spingler; Stephen J. Lippard","Hydrolysis of β-Lactam Antibiotics Catalyzed by Dinuclear Zinc(II) Complexes: Functional Mimics of Metallo-β-lactamases","Journal of the American Chemical Society","2000","122","","6411","6422","10.1021/ja993704l","","","0.71073","MoKα","","0.0761","0.0409","","","0.0772","0.0842","","","","","","1.009","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116086","12.571","0.006","14.418","0.007","9.414","0.004","100.63","0.04","95.88","0.04","112.38","0.04","1522.4","1.4","298.2","","298.2","","","","","","","","","5","P -1","-P 1","2","","","","- C62 H60 Cl8 N4 O10 -","- C62 H60 Cl8 N4 O10 -","- C62 H60 Cl8 N4 O10 -","1","0.5","","Hidemitsu Uno; Takashi Inoue; Yumiko Fumoto; Motoo Shiro; Noboru Ono","meso-Unsubstituted Porphyrinogens and Hexaphyrinogens: The First X-ray Characterization","Journal of the American Chemical Society","2000","122","","6773","6774","10.1021/ja000482e","","","1.5418","CuKα","","0.0529","0.053","","0.069","","0.069","","","1.978","","","1.98","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116087","43.981","0.002","43.981","0.001","17.017","0.001","90","","90","","120","","28506","2","143.2","","143.2","","","","","","","","","5","R -3 :H","-R 3","148","","","","- C103 H115 Cl3 N6 O12 -","- C103.001 H114.75 Cl2.833 N6 O12 -","- C1236.01 H1377 Cl33.996 N72 O144 -","12","0.666667","","Hidemitsu Uno; Takashi Inoue; Yumiko Fumoto; Motoo Shiro; Noboru Ono","meso-Unsubstituted Porphyrinogens and Hexaphyrinogens: The First X-ray Characterization","Journal of the American Chemical Society","2000","122","","6773","6774","10.1021/ja000482e","","","0.7107","MoKα","","","0.0756","","","","0.0941","","","","","","1.739","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116088","17.0867","0.0013","17.0867","0.0013","49.643","0.006","90","","90","","120","","12552","2","293","2","293","2","","","","","","","synthetic","8","R -3 c :H","-R 3 2""c","167","","","","- C12 H48 N12 Na2 O24 Re12 Se16 Zn3 -","- C12 N12 Na1.98 O23.6 Re12 Se16 Zn3 -","- C72 N72 Na11.88 O141.6 Re72 Se96 Zn18 -","6","0.166667","","Miriam V. Bennett; Matthew P. Shores; Laurance G. Beauvais; Jeffrey R. Long","Expansion of the Porous Solid Na2Zn3[Fe(CN)6]2.9H2O: Enhanced Ion-Exchange Capacity in Na2Zn3[Re6Se8(CN)6]2.24H2O","Journal of the American Chemical Society","2000","122","","6664","6668","10.1021/ja000593d","","","0.71073","MoKα","","0.1091","0.0446","","0.0973","0.0811","","","","0.99","1.116","1.116","","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116089","17.1915","0.0012","17.1915","0.0012","49.369","0.005","90","","90","","120","","12636.1","1.8","293","2","293","2","","","","","","","synthetic","7","R -3 c :H","-R 3 2""c","167","","","","- C12 H48 N12 O24 Re12 Se16 Zn4 -","- C12 N12 O24 Re12 Se16 Zn4 -","- C72 N72 O144 Re72 Se96 Zn24 -","6","0.166667","","Miriam V. Bennett; Matthew P. Shores; Laurance G. Beauvais; Jeffrey R. Long","Expansion of the Porous Solid Na2Zn3[Fe(CN)6]2.9H2O: Enhanced Ion-Exchange Capacity in Na2Zn3[Re6Se8(CN)6]2.24H2O","Journal of the American Chemical Society","2000","122","","6664","6668","10.1021/ja000593d","","","0.71073","MoKα","","0.0525","0.0278","","0.0732","0.0687","","","","0.949","1.102","1.102","","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116090","18.9899","0.0002","10.8806","0.0003","8.5788","0.0003","90","","108.218","0.002","90","","1683.71","0.08","293","2","293","2","","","","","","","synthetic","7","C 1 2/m 1","-C 2y","12","","","","- C6 H34 N6 O15 Re6 Se8 Zn2 -","- C6 N6 O17 Re6 Se8 Zn2 -","- C12 N12 O34 Re12 Se16 Zn4 -","2","0.25","","Miriam V. Bennett; Matthew P. Shores; Laurance G. Beauvais; Jeffrey R. Long","Expansion of the Porous Solid Na2Zn3[Fe(CN)6]2.9H2O: Enhanced Ion-Exchange Capacity in Na2Zn3[Re6Se8(CN)6]2.24H2O","Journal of the American Chemical Society","2000","122","","6664","6668","10.1021/ja000593d","","","0.71073","MoKα","","0.0667","0.0399","","0.099","0.0891","","","","1.02","1.101","1.101","","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116091","15.232","0.003","25.028","0.005","19.142","0.004","90","","110.7","0.02","90","","6826","3","140","2","140","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C65 H74 B F24 N O P2 Ru -","- C65 H74 B F24 N O P2 Ru -","- C260 H296 B4 F96 N4 O4 P8 Ru4 -","4","1","","Andrew J. Toner; Stephan Gründemann; Eric Clot; Hans-Heinrich Limbach; Bruno Donnadieu; Sylviane Sabo-Etienne; Bruno Chaudret","Ruthenium Assisted Reversible Proton Transfer from an Aromatic Carbon to a Hydride","Journal of the American Chemical Society","2000","122","","6777","6778","10.1021/ja9943997","","","0.71073","MoKα","","0.0403","0.0357","","","0.0915","0.0949","","","","","","1.031","","","","has coordinates,has disorder","178931","2020-10-21","18:00:00",""
"4116092","7.7846","0.001","17.781","0.003","13.173","0.003","90","","91.534","0.013","90","","1822.7","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H20 Ag N7 O3 -","- C14 H20 Ag N7 O3 -","- C56 H80 Ag4 N28 O12 -","4","1","","Kil Sik Min; Myunghyun Paik Suh","Silver(I)-Polynitrile Network Solids for Anion Exchange: Anion-Induced Transformation of Supramolecular Structure in the Crystalline State","Journal of the American Chemical Society","2000","122","","6834","6840","10.1021/ja000642m","","","0.71069","MoKα","","0.0562","0.0387","","","0.0925","0.0982","","","","","","0.977","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116093","10.5634","0.0007","17.186","0.002","11.4697","0.0007","90","","90.142","0.005","90","","2082.2","0.3","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C15 H20 Ag F3 N6 O3 S -","- C15 H20 Ag F3 N6 O3 S -","- C60 H80 Ag4 F12 N24 O12 S4 -","4","1","","Kil Sik Min; Myunghyun Paik Suh","Silver(I)-Polynitrile Network Solids for Anion Exchange: Anion-Induced Transformation of Supramolecular Structure in the Crystalline State","Journal of the American Chemical Society","2000","122","","6834","6840","10.1021/ja000642m","","","0.71069","MoKα","","0.0602","0.0471","","","0.117","0.1237","","","","","","0.969","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116094","11.05","0.003","11.414","0.003","14.79","0.004","90","","90","","90","","1865.4","0.9","293","2","293","2","","","","","","","","6","P c c n","-P 2ab 2ac","56","","","","- C7 H10 Ag0.5 Cl0.5 N3 O2 -","- C7 H10 Ag0.5 Cl0.5 N3 O2 -","- C56 H80 Ag4 Cl4 N24 O16 -","8","1","","Kil Sik Min; Myunghyun Paik Suh","Silver(I)-Polynitrile Network Solids for Anion Exchange: Anion-Induced Transformation of Supramolecular Structure in the Crystalline State","Journal of the American Chemical Society","2000","122","","6834","6840","10.1021/ja000642m","","","0.71069","MoKα","","0.0611","0.0545","","","0.1455","0.1506","","","","","","1.007","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116095","18.51","0.003","13.4478","0.0018","7.6928","0.001","90","","101.552","0.003","90","","1876.1","0.5","290","2","290","2","","","","","","","","6","I 1 m 1","I -2y","8","ITQ4","","","- C28 H34 F2 N2 O66 Si32 -","- C28 H34 F2 N2 O66 Si32 -","- C28 H34 F2 N2 O66 Si32 -","1","0.25","","Ivor Bull; Luis A. Villaescusa; Simon J. Teat; Miguel A. Camblor; Paul A. Wright; Philip Lightfoot; Russell E. Morris","Imposition of Polarity on a Centrosymmetric Zeolite Host: The Effect of Fluoride Ions on Template Ordering in Zeolite IFR","Journal of the American Chemical Society","2000","122","","7128","7129","10.1021/ja000885e","","","0.6994","","","0.0577","0.0525","","","0.1316","0.135","","","","","","1.05","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116096","18.571","0.0008","13.4943","0.0006","7.7153","0.0003","90","","102.302","0.001","90","","1889.08","0.14","30","2","30","2","","","","","","","","6","I 1 m 1","I -2y","8","","","","- C28 H34 F2 N2 O66 Si32 -","- C28 H34 F2 N2 O66 Si32 -","- C28 H34 F2 N2 O66 Si32 -","1","0.25","","Ivor Bull; Luis A. Villaescusa; Simon J. Teat; Miguel A. Camblor; Paul A. Wright; Philip Lightfoot; Russell E. Morris","Imposition of Polarity on a Centrosymmetric Zeolite Host: The Effect of Fluoride Ions on Template Ordering in Zeolite IFR","Journal of the American Chemical Society","2000","122","","7128","7129","10.1021/ja000885e","","","0.6448","","","0.0505","0.0479","","","0.1294","0.1325","","","","","","1.096","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116097","5.5295","0.0004","7.6073","0.0005","16.6967","0.0012","89.053","0.001","80.533","0.001","69.071","0.001","646.39","0.08","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H16 Au N S -","- C12 H16 Au N S -","- C24 H32 Au2 N2 S2 -","2","1","","Robert E. Bachman; Sheri A. Bodolosky-Bettis; Shana C. Glennon; Scott A. Sirchio","Formation of a Novel Luminescent Form of Gold(I) Phenylthiolate via Self-Assembly and Decomposition of Isonitrilegold(I) Phenylthiolate Complexes","Journal of the American Chemical Society","2000","122","","7146","7147","10.1021/ja000973z","","","0.71073","MoKα","","0.0615","0.0433","","","0.0966","0.1055","","","","","","1.035","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116098","5.4405","0.0004","7.5603","0.0005","18.7189","0.0012","87.657","0.001","87.101","0.001","70.421","0.001","724.26","0.09","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H20 Au N S -","- C14 H20 Au N S -","- C28 H40 Au2 N2 S2 -","2","1","","Robert E. Bachman; Sheri A. Bodolosky-Bettis; Shana C. Glennon; Scott A. Sirchio","Formation of a Novel Luminescent Form of Gold(I) Phenylthiolate via Self-Assembly and Decomposition of Isonitrilegold(I) Phenylthiolate Complexes","Journal of the American Chemical Society","2000","122","","7146","7147","10.1021/ja000973z","","","0.71073","MoKα","","0.0429","0.0324","","","0.0674","0.0686","","","","","","0.865","","","","has coordinates","178931","2020-10-21","18:00:00",""
"4116099","10.947","0.006","11.741","0.006","10.054","0.005","107.12","0.03","91.96","0.01","80.51","0.03","1217.9","1.1","296.2","","","","","","","","","","","6","P -1","-P 1","2","","","","- C24 H20 Cl Fe N4 O7 -","- C24 H18 Cl Fe N4 O7 -","- C48 H36 Cl2 Fe2 N8 O14 -","2","1","","Shinya Hayami; Zhong-ze Gu; Motoo Shiro; Yasuaki Einaga; Akira Fujishima; Osamu Sato","First Observation of Light-Induced Excited Spin State Trapping for an Iron(III) Complex","Journal of the American Chemical Society","2000","122","","7126","7127","10.1021/ja001406e","","","0.7107","MoKα","","","0.0725","","","","0.1004","","","","","","1.183","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116100","13.43","0.003","18.333","0.004","17.118","0.003","90","","94.86","0.03","90","","4199.5","1.5","203","2","200","2","","","","","","","","5","I 1 2/m 1","-I 2y","12","","","","- C76 H110 Al14 Cl Si -","- C76 H110.12 Al14 Cl Si -","- C152 H220.24 Al28 Cl2 Si2 -","2","0.25","","Andreas Purath; Carsten Dohmeier; Achim Ecker; Ralf Köppe; Harald Krautscheid; Hansgeorg Schnöckel; Reinhart Ahlrichs; Carsten Stoermer; Jochen Friedrich; Peter Jutzi","Synthesis and Structure of a Neutral SiAl14 Cluster","Journal of the American Chemical Society","2000","122","","6955","6959","10.1021/ja991890p","","","0.71073","MoKa=20","","0.098","0.0654","","0.1721","0.156","","","","0.985","1.108","1.108","","","","","has coordinates,has disorder","178932","2020-10-21","18:00:00",""
"4116101","7.827","0.001","12.774","0.001","17.353","0.001","90","","90","","90","","1735","0.3","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2(S)-amino-3-(1H-imidazol-4(5)-yl)propyl cyclohexylmethyl ether dihydrochloride","","- C13 H25 Cl2 N3 O -","- C13 H25 Cl2 N3 O -","- C52 H100 Cl8 N12 O4 -","4","1","","Jari T. Kovalainen; Johannes A. M. Christiaans; Risto Ropponen; Antti Poso; Mikael Peräkylä; Jouko Vepsäläinen; Reino Laatikainen; Jukka Gynther","A Proton Relay Process as the Mechanism of Activation of the Histamine H3-Receptor Determined by 1H NMR and ab Initio Quantum Mechanical Calculations","Journal of the American Chemical Society","2000","122","","6989","6996","10.1021/ja993322f","","","0.71073","MoKα","","0.0932","0.0492","","","0.081","0.0923","","","","","","1.025","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116102","7.554","0.001","12.998","0.001","17.782","0.001","90","","90","","90","","1746","0.3","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","2(S)-amino-3-(1H-imidazol-4(5)-yl)propyl 4-bromobenzyl ether dihydrochloride","","- C13 H18 Br Cl2 N3 O -","- C13 H18 Br Cl2 N3 O -","- C52 H72 Br4 Cl8 N12 O4 -","4","1","","Jari T. Kovalainen; Johannes A. M. Christiaans; Risto Ropponen; Antti Poso; Mikael Peräkylä; Jouko Vepsäläinen; Reino Laatikainen; Jukka Gynther","A Proton Relay Process as the Mechanism of Activation of the Histamine H3-Receptor Determined by 1H NMR and ab Initio Quantum Mechanical Calculations","Journal of the American Chemical Society","2000","122","","6989","6996","10.1021/ja993322f","","","0.71073","MoKα","","0.0875","0.0496","","","0.0806","0.0914","","","","","","1.058","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116103","13.2095","0.0005","23.9347","0.0005","25.5398","0.001","90","","90","","90","","8074.8","0.5","183","2","183","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C34 H26 B Cl8 Cu F4 N4 -","- C34 H26 B Cl8 Cu F4 N4 -","- C272 H208 B8 Cl64 Cu8 F32 N32 -","8","1","","Christopher J. Sanders; Kevin M. Gillespie; David Bell; Peter Scott","Structural Origins of a Dramatic Variation in Catalyst Efficiency in Enantioselective Alkene Aziridination: Implications for Design of Ligands Based on Chiral Biaryldiamines","Journal of the American Chemical Society","2000","122","","7132","7133","10.1021/ja994353d","","","0.71073","MoKα","","0.102","0.0895","","","0.264","0.2723","","","","","","2.131","","","","has coordinates,has disorder","178932","2020-10-21","18:00:00",""
"4116104","11.4466","0.0006","18.114","0.0009","19.5085","0.0006","69.387","0.001","78.246","0.001","82.443","0.001","3698.7","0.3","180","2","180","2","","","","","","","","8","P -1","-P 1","2","","","","- C75 H82 Cl2 Cu2 F6 N4 O6 S2 -","- C75 H82 Cl2 Cu2 F6 N4 O6 S2 -","- C150 H164 Cl4 Cu4 F12 N8 O12 S4 -","2","1","","Christopher J. Sanders; Kevin M. Gillespie; David Bell; Peter Scott","Structural Origins of a Dramatic Variation in Catalyst Efficiency in Enantioselective Alkene Aziridination: Implications for Design of Ligands Based on Chiral Biaryldiamines","Journal of the American Chemical Society","2000","122","","7132","7133","10.1021/ja994353d","","","0.71073","MoKα","","0.0686","0.0536","","","0.1247","0.1387","","","","","","1.07","","","","has coordinates,has disorder","178932","2020-10-21","18:00:00",""
"4116105","11.537","0.005","12.256","0.005","14.568","0.006","85.023","0.008","72.66","0.008","71.03","0.007","1859.4","1.4","297","2","297","2","","","","","","","","6","P -1","-P 1","2","2a","1,2-bis[6-(1-oxyl-3-oxide-4,4,5,5-tetramethylimidazolin -2-yl)-2-methyl-1-benzothiophen-3-yl]hexafluorocyclopentene","","- C37 H36 F6 N4 O4 S2 -","- C37 H36 F6 N4 O4 S2 -","- C74 H72 F12 N8 O8 S4 -","2","1","","Kenji Matsuda; Masahiro Irie","A Diarylethene with Two Nitronyl Nitroxides: Photoswitching of Intramolecular Magnetic Interaction","Journal of the American Chemical Society","2000","122","","7195","7201","10.1021/ja000605v","","","0.71073","MoKα","","0.2136","0.0859","","","0.2112","0.2704","","","","","","0.929","","","","has coordinates,has disorder","178932","2020-10-21","18:00:00",""
"4116106","12.2767","0.0018","23.85","0.004","26.549","0.004","90","","90.513","0.003","90","","7773","2","111","2","111","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","2b","3,3,4,4,5,5-hexafluoro-11,20-bis(1-oxyl-3-oxide-4,4,5,5-tetramethylimidazolin-2-yl)-15,16-dimethyl-14,17-dithiahexacyclo[14.7.0.0^2,6^.0^7,15^.0^8,13^.0^18,23^]tricosa-1(2),6(7),8(13),9,11,18(23),19,21-octane","","- C38 H38 Cl2 F6 N4 O4 S2 -","- C38 H38 Cl2 F6 N4 O4 S2 -","- C304 H304 Cl16 F48 N32 O32 S16 -","8","2","","Kenji Matsuda; Masahiro Irie","A Diarylethene with Two Nitronyl Nitroxides: Photoswitching of Intramolecular Magnetic Interaction","Journal of the American Chemical Society","2000","122","","7195","7201","10.1021/ja000605v","","","0.71073","MoKα","","0.1375","0.1153","","","0.2893","0.3026","","","","","","1.177","","","","has coordinates,has disorder","211399","2020-10-21","18:00:00",""
"4116107","11.113","0.001","4.1207","0.0006","19.5511","0.0008","90","","101.064","0.001","90","","878.67","0.15","295.2","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C24 H16 O2 -","- C24 H16 O2 -","- C48 H32 O4 -","2","0.5","","Yoshihiro Yamaguchi; Shigeya Kobayashi; Tateaki Wakamiya; Yoshio Matsubara; Zen-ichi Yoshida","A Simple Hybrid Cyclyne Consisting of 1,3-Diethynylbenzene and Ether Units: Synthesis and Novel Ag±Induced Cyclization Leading to the Perylene Skeleton Formation","Journal of the American Chemical Society","2000","122","","7404","7405","10.1021/ja000822w","","","0.7107","MoKα","","","0.0512","","","","0.1548","","","","","","1.204","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116108","9.344","0.002","6.3811","0.0009","13.484","0.001","90","","102.601","0.008","90","","784.6","0.2","293.2","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C24 H16 O2 -","- C24 H16 O2 -","- C48 H32 O4 -","2","0.5","","Yoshihiro Yamaguchi; Shigeya Kobayashi; Tateaki Wakamiya; Yoshio Matsubara; Zen-ichi Yoshida","A Simple Hybrid Cyclyne Consisting of 1,3-Diethynylbenzene and Ether Units: Synthesis and Novel Ag±Induced Cyclization Leading to the Perylene Skeleton Formation","Journal of the American Chemical Society","2000","122","","7404","7405","10.1021/ja000822w","","","0.7107","MoKα","","","0.0501","","","","0.1458","","","","","","1.202","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116109","8.394","0.001","14.177","0.002","8.089","0.002","93.2","0.02","96.77","0.02","98.74","0.01","942.1","0.3","296.2","","296.2","","","","","","","","","4","P -1","-P 1","2","","","","- C30 H42 Ir2 O12 -","- C76 H104 Ir4 O24 -","- C76 H104 Ir4 O24 -","1","0.5","","Takaya Matsumoto; Douglas J. Taube; Roy A. Periana; Henry Taube; Hajime Yoshida","Anti-Markovnikov Olefin Arylation Catalyzed by an Iridium Complex","Journal of the American Chemical Society","2000","122","","7414","7415","10.1021/ja0009830","","","0.7107","MoKα","","0.0349","0.0349","","","0.0375","0.0375","","","","","","0.741","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116110","9.0244","0.0006","13.3106","0.0009","17.907","0.001","90","","102.505","0.001","90","","2100","0.2","213","2","213","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H19 Cl Fe N4 O2 -","- C21 H19 Cl Fe N4 O2 -","- C84 H76 Cl4 Fe4 N16 O8 -","4","1","","Salma Kiani; Amy Tapper; Richard J. Staples; Pericles Stavropoulos","Functional Aspects of Gif-Type Oxidation of Hydrocarbons Mediated by Iron Picolinate H2O2-Dependent Systems: Evidence for the Generation of Carbon- and Oxygen-Centered Radicals","Journal of the American Chemical Society","2000","122","","7503","7517","10.1021/ja000063h","","","0.71073","MoKα","","0.0656","0.034","","","0.0508","0.0528","","","","","","1.177","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116111","9.589","0.003","14.297","0.005","12.09","0.003","90","","93.04","0.02","90","","1655.1","0.9","213","2","213","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H30 Fe2 N6 O10 -","- C30 H30 Fe2 N6 O10 -","- C60 H60 Fe4 N12 O20 -","2","0.5","","Salma Kiani; Amy Tapper; Richard J. Staples; Pericles Stavropoulos","Functional Aspects of Gif-Type Oxidation of Hydrocarbons Mediated by Iron Picolinate H2O2-Dependent Systems: Evidence for the Generation of Carbon- and Oxygen-Centered Radicals","Journal of the American Chemical Society","2000","122","","7503","7517","10.1021/ja000063h","","","0.71073","MoKα","","0.0835","0.0523","","","0.1379","0.1645","","","","","","1.058","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116112","9.048","0.002","6.237","0.0007","14.285","0.004","90","","107.89","0.02","90","","767.2","0.3","213","2","213","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H16 Fe N2 O6 -","- C14 H16 Fe N2 O6 -","- C28 H32 Fe2 N4 O12 -","2","0.5","","Salma Kiani; Amy Tapper; Richard J. Staples; Pericles Stavropoulos","Functional Aspects of Gif-Type Oxidation of Hydrocarbons Mediated by Iron Picolinate H2O2-Dependent Systems: Evidence for the Generation of Carbon- and Oxygen-Centered Radicals","Journal of the American Chemical Society","2000","122","","7503","7517","10.1021/ja000063h","","","0.71073","MoKα","","0.0407","0.0267","","","0.0623","0.0643","","","","","","1.08","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116113","5.121","0.003","7.587","0.004","9.193","0.005","75.347","0.009","84.627","0.009","71.767","0.009","328.2","0.3","213","2","213","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H12 Fe N2 O6 -","- C12 H12 Fe N2 O6 -","- C12 H12 Fe N2 O6 -","1","0.5","","Salma Kiani; Amy Tapper; Richard J. Staples; Pericles Stavropoulos","Functional Aspects of Gif-Type Oxidation of Hydrocarbons Mediated by Iron Picolinate H2O2-Dependent Systems: Evidence for the Generation of Carbon- and Oxygen-Centered Radicals","Journal of the American Chemical Society","2000","122","","7503","7517","10.1021/ja000063h","","","0.71073","MoKα","","0.0352","0.033","","","0.089","0.0911","","","","","","1.183","","","","has coordinates,has disorder","178932","2020-10-21","18:00:00",""
"4116114","19.67","0.009","8.913","0.003","9.469","0.004","90","","96.66","0.01","90","","1648.9","1.2","213","2","213","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C30 H30 Fe2 N6 O11 -","- C30 H30 Fe2 N6 O11 -","- C60 H60 Fe4 N12 O22 -","2","0.5","","Salma Kiani; Amy Tapper; Richard J. Staples; Pericles Stavropoulos","Functional Aspects of Gif-Type Oxidation of Hydrocarbons Mediated by Iron Picolinate H2O2-Dependent Systems: Evidence for the Generation of Carbon- and Oxygen-Centered Radicals","Journal of the American Chemical Society","2000","122","","7503","7517","10.1021/ja000063h","","","0.71073","MoKα","","0.023","0.022","","0.0584","0.0577","","","","1.04","1.041","1.041","","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116115","13.7241","0.0003","13.7241","0.0003","18.2281","0.0003","90","","90","","120","","2973.31","0.1","213","2","213","2","","","","","","","","5","P 64","P 64","172","","","","- C20.5 H14.5 Fe N3.5 O6 -","- C20.5 H14.5 Fe N3.5 O6 -","- C123 H87 Fe6 N21 O36 -","6","1","","Salma Kiani; Amy Tapper; Richard J. Staples; Pericles Stavropoulos","Functional Aspects of Gif-Type Oxidation of Hydrocarbons Mediated by Iron Picolinate H2O2-Dependent Systems: Evidence for the Generation of Carbon- and Oxygen-Centered Radicals","Journal of the American Chemical Society","2000","122","","7503","7517","10.1021/ja000063h","","","0.71073","MoKα","","0.053","0.0405","","","0.1046","0.1155","","","","","","1.077","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116116","17.904","0.0006","24.04","0.001","24.955","0.001","90","","90","","90","","10740.9","0.7","213","2","213","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C26 H22 Fe2 N4 O10 -","- C26 H22 Fe2 N4 O10 -","- C416 H352 Fe32 N64 O160 -","16","0.5","","Salma Kiani; Amy Tapper; Richard J. Staples; Pericles Stavropoulos","Functional Aspects of Gif-Type Oxidation of Hydrocarbons Mediated by Iron Picolinate H2O2-Dependent Systems: Evidence for the Generation of Carbon- and Oxygen-Centered Radicals","Journal of the American Chemical Society","2000","122","","7503","7517","10.1021/ja000063h","","","0.71073","MoKα","","0.0993","0.0352","","","0.0483","0.0522","","","","","","1.006","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116117","10.464","0.001","12.395","0.001","6.433","0.0006","99.332","0.008","101.209","0.009","95.744","0.008","800.12","0.13","293.2","","293.2","","","","","","","","","3","P -1","-P 1","2","","","","- C44 H30 N4 -","- C44 H30 N4 -","- C44 H30 N4 -","1","0.5","","Koji Kano; Kazuya Fukuda; Hideo Wakami; Ryuhei Nishiyabu; Robert F. Pasternack","Factors Influencing Self-Aggregation Tendencies of Cationic Porphyrins in Aqueous Solution","Journal of the American Chemical Society","2000","122","","7494","7502","10.1021/ja000738g","","","0.7107","MoK\Ja","","0.0437","0.044","","0.044","","0.044","","","1.144","","","1.14","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116118","37.314","0.004","5.008","0.005","25.474","0.005","90","","127.184","0.007","90","","3793","4","293.2","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C40 H50 Cl4 N4 -","- C40 H50 Cl4 N4 -","- C160 H200 Cl16 N16 -","4","0.5","","Koji Kano; Kazuya Fukuda; Hideo Wakami; Ryuhei Nishiyabu; Robert F. Pasternack","Factors Influencing Self-Aggregation Tendencies of Cationic Porphyrins in Aqueous Solution","Journal of the American Chemical Society","2000","122","","7494","7502","10.1021/ja000738g","","","0.7107","MoKα","","","0","","","","0.051","","","","","","1.092","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116119","10.6911","0.0005","24.4434","0.0011","29.7425","0.0013","90","","90","","90","","7772.5","0.6","91","2","91","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","[Rh2(TBSP)4(DMF)2].0.5toluene.0.5n-pentane","tetrakis[1-[(4-tert-butylphenyl)sulfonyl] -(2S)-pyrrolidinecarboxylate]dirhodium(II)","","- C72 H104 N6 O18 Rh2 S4 -","- C72 H104 N6 O18 Rh2 S4 -","- C288 H416 N24 O72 Rh8 S16 -","4","1","","Dolores C. Wynne; Marilyn M. Olmstead; Philip G. Jessop","Supercritical and Liquid Solvent Effects on the Enantioselectivity of Asymmetric Cyclopropanation with Tetrakis[1-[(4-tert-butylphenyl)- sulfonyl]-(2S)-pyrrolidinecarboxylate]dirhodium(II)","Journal of the American Chemical Society","2000","122","","7638","7647","10.1021/ja000894n","","","0.71073","MoKα","","0.131","0.059","","","0.1096","0.1306","","","","","","0.902","","","","has coordinates,has disorder","178932","2020-10-21","18:00:00",""
"4116120","8.0696","0.0006","9.8315","0.0007","10.8759","0.0008","73.119","0.001","72.563","0.001","66.184","0.001","738.79","0.09","173","2","173","2","","","","","","","","4","P -1","-P 1","2","2(1a).2(2a)","","","- C18 H16 N2 O2 -","- C18 H16 N2 O2 -","- C36 H32 N4 O4 -","2","1","","Leonard R. MacGillivray; Jennifer L. Reid; John A. Ripmeester","Supramolecular Control of Reactivity in the Solid State Using Linear Molecular Templates","Journal of the American Chemical Society","2000","122","","7817","7818","10.1021/ja001239i","","","0.7107","MoKα","","0.0952","0.0542","","0.1463","0.125","","","","1.034","1.111","1.111","","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4116121","11.366","0.0014","9.7488","0.0013","14.273","0.002","90","","111.668","0.003","90","","1469.8","0.3","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","2(1a).3a","","","- C36 H32 N4 O4 -","- C36 H32 N4 O4 -","- C72 H64 N8 O8 -","2","0.5","","Leonard R. MacGillivray; Jennifer L. Reid; John A. Ripmeester","Supramolecular Control of Reactivity in the Solid State Using Linear Molecular Templates","Journal of the American Chemical Society","2000","122","","7817","7818","10.1021/ja001239i","","","0.7107","MoKα","","0.1274","0.0635","","0.1585","0.1288","","","","1.022","1.151","1.151","","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116122","9.5735","0.0006","11.3886","0.0007","15.0387","0.0009","90","","94.317","0.001","90","","1635","0.17","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2(1b).2(2a)","","","- C19 H18 N2 O3 -","- C19 H18 N2 O3 -","- C76 H72 N8 O12 -","4","1","","Leonard R. MacGillivray; Jennifer L. Reid; John A. Ripmeester","Supramolecular Control of Reactivity in the Solid State Using Linear Molecular Templates","Journal of the American Chemical Society","2000","122","","7817","7818","10.1021/ja001239i","","","0.7107","MoKα","","0.038","0.0325","","0.0858","0.0824","","","","1.084","1.125","1.125","","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4116123","7.4833","0.0007","10.0186","0.001","10.5994","0.001","79.811","0.002","73.146","0.002","77.686","0.002","737.38","0.12","173","2","173","2","","","","","","","","4","P -1","-P 1","2","2(1a).2(2b)","","","- C18 H16 N2 O2 -","- C18 H16 N2 O2 -","- C36 H32 N4 O4 -","2","1","","Leonard R. MacGillivray; Jennifer L. Reid; John A. Ripmeester","Supramolecular Control of Reactivity in the Solid State Using Linear Molecular Templates","Journal of the American Chemical Society","2000","122","","7817","7818","10.1021/ja001239i","","","0.7107","MoKα","","0.0794","0.0659","","0.2004","0.1819","","","","0.906","0.959","0.959","","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4116124","9.4598","0.001","9.4703","0.001","13.7442","0.0014","83.164","0.002","72.181","0.002","67.893","0.002","1086","0.2","173","2","173","2","","","","","","","","4","P -1","-P 1","2","2(1b).2(2c)","","","- C27 H24 N2 O3 -","- C27 H24 N2 O3 -","- C54 H48 N4 O6 -","2","1","","Leonard R. MacGillivray; Jennifer L. Reid; John A. Ripmeester","Supramolecular Control of Reactivity in the Solid State Using Linear Molecular Templates","Journal of the American Chemical Society","2000","122","","7817","7818","10.1021/ja001239i","","","0.7107","MoKα","","0.1101","0.0594","","0.1824","0.1514","","","","0.84","0.976","0.976","","","","","has coordinates,has disorder","178932","2020-10-21","18:00:00",""
"4116125","15.639","0.003","15.996","0.003","16.538","0.003","82.77","0.03","61.95","0.03","60.97","0.03","3164.3","1.8","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","Anilinium Tetrakis[benzilato(2-)-O1,O2]-my-oxo-disilicate-Diacetonitrile","","- C72 H62 N4 O13 Si2 -","- C72 H62 N4 O13 Si2 -","- C144 H124 N8 O26 Si4 -","2","1","","Reinhold Tacke; Christian Burschka; Ingo Richter; Brigitte Wagner; Reiner Willeke","Pentacoordinate Silicon Compounds with SiO5Skeletons Containing SiOH or SiOSi Groups: Derivatives of the Pentahydroxosilicate(1-) Anion [Si(OH)5]-and Its Anhydride [(HO)4Si-O-Si(OH)4]2-","Journal of the American Chemical Society","2000","122","","8480","8485","10.1021/ja000637i","","","0.71073","MoKα","","0.0581","0.0346","","","0.0759","0.0822","","","","","","0.886","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116126","10.863","0.002","11.12","0.002","14.495","0.003","82.02","0.03","86.46","0.03","64.36","0.03","1563.2","0.7","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","Triethylammonium Bis[benzilato(2-)-O1,O2]hydroxosilicate","","- C34 H37 N O7 Si -","- C34 H37 N O7 Si -","- C68 H74 N2 O14 Si2 -","2","1","","Reinhold Tacke; Christian Burschka; Ingo Richter; Brigitte Wagner; Reiner Willeke","Pentacoordinate Silicon Compounds with SiO5Skeletons Containing SiOH or SiOSi Groups: Derivatives of the Pentahydroxosilicate(1-) Anion [Si(OH)5]-and Its Anhydride [(HO)4Si-O-Si(OH)4]2-","Journal of the American Chemical Society","2000","122","","8480","8485","10.1021/ja000637i","","","0.71073","MoKα","","0.0656","0.0479","","","0.12","0.1284","","","","","","0.955","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116127","11.3633","0.0014","12.5129","0.0013","11.8372","0.0014","90","","91.155","0.015","90","","1682.8","0.3","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Anilinium Bis[benzilato(2-)-O1,O2]hydroxosilicate-Tetrahydrofuran","","- C38 H37 N O8 Si -","- C38 H37 N O8 Si -","- C76 H74 N2 O16 Si2 -","2","1","","Reinhold Tacke; Christian Burschka; Ingo Richter; Brigitte Wagner; Reiner Willeke","Pentacoordinate Silicon Compounds with SiO5Skeletons Containing SiOH or SiOSi Groups: Derivatives of the Pentahydroxosilicate(1-) Anion [Si(OH)5]-and Its Anhydride [(HO)4Si-O-Si(OH)4]2-","Journal of the American Chemical Society","2000","122","","8480","8485","10.1021/ja000637i","","","0.71073","MoKα","","0.0519","0.0413","","","0.0991","0.1034","","","","","","0.998","","","","has coordinates,has disorder","178932","2020-10-21","18:00:00",""
"4116128","23.7736","0.0005","33.099","0.0004","28.179","0.0006","90","","108.096","0.001","90","","21076.8","0.7","173","","173","","","","","","","","","9","C 1 2/c 1","-C 2yc","15","","","","- C102 H94 Cl F6 N4 O15 P4 Pt2 S2 -","- C102 H83 Cl F6 N4 O14 P4 Pt2 S2 -","- C816 H664 Cl8 F48 N32 O112 P32 Pt16 S16 -","8","1","","Nathan C. Gianneschi; Edward R. T. Tiekink; Louis M. Rendina","Dinuclear Platinum Complexes with Hydrogen-Bonding Functionality: Noncovalent Assembly of Nanoscale Cyclic Arrays","Journal of the American Chemical Society","2000","122","","8474","8479","10.1021/ja994483m","","","0.7107","MoKα","","","0.084","","","","0.11","","","","","","2.52","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116129","35.2023","0.0019","6.0715","0.0004","10.471","0.0009","90","","101.414","0.006","90","","2193.7","0.3","571","2","571","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C21 H31 N O4 -","- C21 H31 N O4 -","- C84 H124 N4 O16 -","4","1","","James D. White; Jungchul Kim; Nicholas E. Drapela","Enantiospecific Synthesis of (+)-Byssochlamic Acid, a Nonadride from the Ascomycete Byssochlamysfulva","Journal of the American Chemical Society","2000","122","","8665","8671","10.1021/ja001898v","","","1.54178","CuKα","","0.0502","0.044","","","0.1145","0.1238","","","","","","1.059","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116130","5.999","0.002","11.212","0.002","13.274","0.003","98.53","0.01","91.64","0.02","96.5","0.02","876.3","0.4","566","2","566","2","","","","","","","","4","P -1","-P 1","2","","","","- C16 H27 N O4 -","- C16 H27 N O4 -","- C32 H54 N2 O8 -","2","1","","James D. White; Jungchul Kim; Nicholas E. Drapela","Enantiospecific Synthesis of (+)-Byssochlamic Acid, a Nonadride from the Ascomycete Byssochlamysfulva","Journal of the American Chemical Society","2000","122","","8665","8671","10.1021/ja001898v","","","1.54178","CuKα","","0.0948","0.0803","","","0.2339","0.2555","","","","","","1.78","","","","has coordinates,has disorder","178932","2020-10-21","18:00:00",""
"4116131","9.552","0.002","14.509","0.003","17.781","0.002","90","0.014","90","0.014","90","0.02","2464.3","0.8","293","2","293","2","","","","","","","synthesis","4","P 21 21 21","P 2ac 2ab","19","","3',4'-Bis(n-hexyl)-2,2':5',2''-terthiophene 1',1'-dioxide","","- C24 H32 O2 S3 -","- C24 H32 O2 S3 -","- C96 H128 O8 S12 -","4","1","","Luciano Antolini; Emilio Tedesco; Giovanna Barbarella; Laura Favaretto; Giovanna Sotgiu; Massimo Zambianchi; Daniele Casarini; Giuseppe Gigli; Roberto Cingolani","Molecular Packing and Photoluminescence Efficiency in Odd-Membered Oligothiophene S,S-Dioxides","Journal of the American Chemical Society","2000","122","","9006","9013","10.1021/ja000834h","","","0.71069","MoKα","","0.1354","0.0664","","0.1856","0.1591","","","","0.991","1.184","1.184","","","","","has coordinates,has disorder","178932","2020-10-21","18:00:00",""
"4116132","15.287","0.002","8.518","0.003","23.425","0.003","90","0.02","90.625","0.01","90","0.02","3050.1","1.2","200","1","200","1","","","","","","","synthesis","4","P 1 21/n 1","-P 2yn","14","","3'',4''-Bis(n-hexyl)-2,2':5',2'':5'',2''':5''',2''''-quinquethiophene 1'',1''-dioxide","","- C32 H36 O2 S5 -","- C32 H36 O2 S5 -","- C128 H144 O8 S20 -","4","1","","Luciano Antolini; Emilio Tedesco; Giovanna Barbarella; Laura Favaretto; Giovanna Sotgiu; Massimo Zambianchi; Daniele Casarini; Giuseppe Gigli; Roberto Cingolani","Molecular Packing and Photoluminescence Efficiency in Odd-Membered Oligothiophene S,S-Dioxides","Journal of the American Chemical Society","2000","122","","9006","9013","10.1021/ja000834h","","","0.71069","MoKα","","0.1382","0.0797","","0.2346","0.2057","","","","1.044","1.205","1.205","","","","","has coordinates,has disorder","178932","2020-10-21","18:00:00",""
"4116133","10.614","0.002","13.133","0.002","15.427","0.002","96.67","0.02","109.2","0.02","107.43","0.02","1881.8","0.7","200","1","200","1","","","","","","","synthesis","4","P -1","-P 1","2","","3''',4'''-Bis(n-hexyl)-2,2':5',2'':5'',2''':5''',2'''':5'''',2''''': 5''''',2''''''-heptathiophene 1''',1'''-dioxide","","- C40 H40 O2 S7 -","- C40 H40 O2 S7 -","- C80 H80 O4 S14 -","2","1","","Luciano Antolini; Emilio Tedesco; Giovanna Barbarella; Laura Favaretto; Giovanna Sotgiu; Massimo Zambianchi; Daniele Casarini; Giuseppe Gigli; Roberto Cingolani","Molecular Packing and Photoluminescence Efficiency in Odd-Membered Oligothiophene S,S-Dioxides","Journal of the American Chemical Society","2000","122","","9006","9013","10.1021/ja000834h","","","0.71069","MoKα","","0.097","0.0792","","0.2293","0.2125","","","","1.118","1.189","1.189","","","","","has coordinates,has disorder","178932","2020-10-21","18:00:00",""
"4116134","23.807","0.005","13.334","0.004","11.354","0.006","90","","90","","90","","3604","2","296.2","","296.2","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C21 H24 O2 -","- C21 H24 O2 -","- C168 H192 O16 -","8","1","","Eiji Shirakawa; Yoshiaki Nakao; Hiroto Yoshida; Tamejiro Hiyama","Nickel-Catalyzed Acylstannylation of 1,3-Dienes: Synthesis and Reaction of ε-Oxoallylstannanes","Journal of the American Chemical Society","2000","122","","9030","9031","10.1021/ja0020409","","","0.7107","MoKα","","","0.043","","","","0.026","","","","","","1.78","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116135","18.7297","0.0006","37.2711","0.0001","7.3366","0.0003","90","","90","","90","","5121.5","0.3","213","2","213","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","(2R,4aS,12aR)-8-Allyloxy-2-(dimethyl-phenyl-silanyl)-4a-methyl-2,3,5,6,12,12a- hexahydro-1H,4aH-chrysene-4,11-dione","","- C30 H34 O3 Si -","- C30 H34 O3 Si -","- C240 H272 O24 Si8 -","8","1","","Brian M. Stoltz; Taichi Kano; E. J. Corey","Enantioselective Total Synthesis of Nicandrenones","Journal of the American Chemical Society","2000","122","","9044","9045","10.1021/ja0024892","","","0.71073","MoKα","","0.1119","0.0609","","","0.1465","0.1779","","","","","","1.044","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116136","10.429","0.002","21.129","0.004","12.695","0.004","90","","106.129","0.014","90","","2687.3","1.1","188","2","188","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C40 H46 Cl3 N12 Ni2 O11 -","- C42.034 H49.966 Cl3 N11.966 Ni2 O17.466 -","- C84.068 H99.932 Cl6 N23.932 Ni4 O34.932 -","2","0.5","","Amy M. Barrios; Stephen J. Lippard","Interaction of Urea with a Hydroxide-Bridged Dinuclear Nickel Center: An Alternative Model for the Mechanism of Urease","Journal of the American Chemical Society","2000","122","","9172","9177","10.1021/ja000202v","","","0.71073","MoKα","","0.1219","0.0659","","","0.1658","0.1902","","","","","","1.122","","","","has coordinates,has disorder","178932","2020-10-21","18:00:00",""
"4116137","13.52","0.014","12.434","0.009","31.21","0.03","90","","100.938","0.011","90","","5151","8","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C49 H51 N7 Ni2 O11 S2 -","- C51 H52 N7 Ni2 O12 S2 -","- C204 H208 N28 Ni8 O48 S8 -","4","1","","Amy M. Barrios; Stephen J. Lippard","Interaction of Urea with a Hydroxide-Bridged Dinuclear Nickel Center: An Alternative Model for the Mechanism of Urease","Journal of the American Chemical Society","2000","122","","9172","9177","10.1021/ja000202v","","","0.71073","MoKα","","0.1321","0.0598","","","0.1429","0.1586","","","","","","0.874","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116138","14.91","0.003","24.128","0.002","10.014","0.002","90","","90","","90","","3602.5","1.1","294.2","","294.2","","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C30 H48 B Mo N6 O3 P -","- C30 H48 B Mo N6 O3 P -","- C120 H192 B4 Mo4 N24 O12 P4 -","4","1","","Paul D. Smith; Andrew J. Millar; Charles G. Young; Amit Ghosh; Partha Basu","Detection, Isolation, and Characterization of Intermediates in Oxygen Atom Transfer Reactions in Molybdoenzyme Model Systems","Journal of the American Chemical Society","2000","122","","9298","9299","10.1021/ja0008362","","","0.7107","MoKα","","","0.0388","","","","0.0469","","","","","","1.657","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116139","6.4928","0.0001","6.06","0.0002","7.803","0.0003","90","","90","","90","","307.02","0.016","130","2","130","2","","","","","","","Fluka","3","P b c a","-P 2ac 2ab","61","Oxalic acid","Ethane-1,2-dioic acid","","- C2 H2 O4 -","- C2 H2 O4 -","- C8 H8 O16 -","4","0.5","","Venkat R. Thalladi; Markus Nüsse; Roland Boese","The Melting Point Alternation in α,ω-Alkanedicarboxylic Acids","Journal of the American Chemical Society","2000","122","","9227","9236","10.1021/ja0011459","","","0.71073","MoKα","","0.0455","0.0415","","0.1066","0.1046","","","","1.193","1.248","1.248","","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116140","5.1604","0.0006","5.3319","0.0005","8.1838","0.0009","108.083","0.002","101.28","0.002","95.23","0.002","207.11","0.04","130","2","130","2","","","","","","","Fluka","3","P -1","-P 1","2","Malonic acid","Propane-1,3-dioic acid","","- C3 H4 O4 -","- C3 H4 O4 -","- C6 H8 O8 -","2","1","","Venkat R. Thalladi; Markus Nüsse; Roland Boese","The Melting Point Alternation in α,ω-Alkanedicarboxylic Acids","Journal of the American Chemical Society","2000","122","","9227","9236","10.1021/ja0011459","","","0.71073","MoKα","","0.0891","0.0755","","0.1963","0.1864","","","","1.005","1.131","1.131","","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4116141","5.4769","0.0004","8.7817","0.0007","5.028","0.0003","90","","92.928","0.002","90","","241.51","0.03","130","2","130","2","","","","","","","Fluka","3","P 1 21/c 1","-P 2ybc","14","Succinic acid","Butane-1,4-dioic acid","","- C4 H6 O4 -","- C2 H3 O2 -","- C8 H12 O8 -","4","1","","Venkat R. Thalladi; Markus Nüsse; Roland Boese","The Melting Point Alternation in α,ω-Alkanedicarboxylic Acids","Journal of the American Chemical Society","2000","122","","9227","9236","10.1021/ja0011459","","","0.71073","MoKα","","0.0519","0.0487","","0.1323","0.1295","","","","1.139","1.182","1.182","","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116142","12.9769","0.0006","4.7484","0.0002","9.6955","0.0004","90","","98.304","0.002","90","","591.17","0.04","130","2","130","2","","","","","","","Fluka","3","C 1 2/c 1","-C 2yc","15","Glutaric acid","Pentane-1,5-dioic acid","","- C5 H8 O4 -","- C2.5 H4 O2 -","- C20 H32 O16 -","8","1","","Venkat R. Thalladi; Markus Nüsse; Roland Boese","The Melting Point Alternation in α,ω-Alkanedicarboxylic Acids","Journal of the American Chemical Society","2000","122","","9227","9236","10.1021/ja0011459","","","0.71073","MoKα","","0.0589","0.0464","","0.1253","0.1162","","","","0.99","1.062","1.062","","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116143","7.187","0.0014","5.1626","0.0011","10.015","0.002","90","","110.856","0.006","90","","347.25","0.12","130","2","130","2","","","","","","","fluka","3","P 1 21/c 1","-P 2ybc","14","Adipic acid","Hexane-1,6-dioic acid","","- C6 H10 O4 -","- C6 H10 O4 -","- C12 H20 O8 -","2","0.5","","Venkat R. Thalladi; Markus Nüsse; Roland Boese","The Melting Point Alternation in α,ω-Alkanedicarboxylic Acids","Journal of the American Chemical Society","2000","122","","9227","9236","10.1021/ja0011459","","","0.71073","MoKα","","0.0951","0.0683","","0.2354","0.1932","","","","1.133","1.107","1.107","","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116144","17.7028","0.0009","4.727","0.0002","9.6713","0.0004","90","","106.58","0.001","90","","775.66","0.06","130","2","130","2","","","","","","","Fluka","3","C 1 2/c 1","-C 2yc","15","Pimelic acid","Heptane-1,7-dioic acid","","- C7 H14 O4 -","- C3.5 H6 O2 -","- C28 H48 O16 -","8","1","","Venkat R. Thalladi; Markus Nüsse; Roland Boese","The Melting Point Alternation in α,ω-Alkanedicarboxylic Acids","Journal of the American Chemical Society","2000","122","","9227","9236","10.1021/ja0011459","","","0.71073","MoKα","","0.0621","0.0507","","0.127","0.1207","","","","0.979","1.094","1.094","","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116145","8.7912","0.0007","5.0681","0.0004","9.8995","0.0008","90","","96.083","0.002","90","","438.59","0.06","130","2","130","2","","","","","","","Fluka","3","P 1 21/c 1","-P 2ybc","14","Suberic acid","Octane-1,8-dioic acid","","- C8 H14 O4 -","- C4 H7 O2 -","- C16 H28 O8 -","4","1","","Venkat R. Thalladi; Markus Nüsse; Roland Boese","The Melting Point Alternation in α,ω-Alkanedicarboxylic Acids","Journal of the American Chemical Society","2000","122","","9227","9236","10.1021/ja0011459","","","0.71073","MoKα","","0.0679","0.0525","","0.1315","0.1231","","","","1.068","1.163","1.163","","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116146","22.6366","0.0001","4.7143","0.0001","9.6162","0.0003","90","","110.809","0.002","90","","959.26","0.04","130","2","130","2","","","","","","","Fluka","3","C 1 2/c 1","-C 2yc","15","Azelaic acid","Nonane-1,9-dioic acid","","- C9 H16 O4 -","- C4.5 H8 O2 -","- C36 H64 O16 -","8","1","","Venkat R. Thalladi; Markus Nüsse; Roland Boese","The Melting Point Alternation in α,ω-Alkanedicarboxylic Acids","Journal of the American Chemical Society","2000","122","","9227","9236","10.1021/ja0011459","","","0.71073","MoKα","","0.0701","0.0454","","0.1187","0.108","","","","0.997","1.096","1.096","","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116147","10.9106","0.0004","5.0109","0.0002","9.7936","0.0001","90","","93.451","0.001","90","","534.46","0.03","130","2","130","2","","","","","","","Fluka","3","P 1 21/c 1","-P 2ybc","14","Sebacic acid","Decane-1,10-dioic acid","","- C10 H18 O4 -","- C5 H9 O2 -","- C20 H36 O8 -","4","1","","Venkat R. Thalladi; Markus Nüsse; Roland Boese","The Melting Point Alternation in α,ω-Alkanedicarboxylic Acids","Journal of the American Chemical Society","2000","122","","9227","9236","10.1021/ja0011459","","","0.71073","MoKα","","0.0775","0.0552","","0.1431","0.1322","","","","0.968","1.097","1.097","","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116148","6.5594","0.0005","6.094","0.0005","7.8524","0.0006","90","","90","","90","","313.88","0.04","298","2","298","2","","","","","","","Fluka","3","P b c a","-P 2ac 2ab","61","Oxalic acid","Ethane-1,2-dioic acid","","- C2 H2 O4 -","- C H O2 -","- C8 H8 O16 -","8","1","","Venkat R. Thalladi; Markus Nüsse; Roland Boese","The Melting Point Alternation in α,ω-Alkanedicarboxylic Acids","Journal of the American Chemical Society","2000","122","","9227","9236","10.1021/ja0011459","","","0.71073","MoKα","","0.036","0.0343","","0.0932","0.0925","","","","1.111","1.162","1.162","","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116149","5.1626","0.0006","5.3452","0.0006","8.4162","0.0012","108.516","0.002","100.603","0.002","94.954","0.001","213.84","0.05","298","2","298","2","","","","","","","Fluka","3","P -1","-P 1","2","Malonic acid","Propane-1,3-dioic acid","","- C3 H4 O4 -","- C3 H4 O4 -","- C6 H8 O8 -","2","1","","Venkat R. Thalladi; Markus Nüsse; Roland Boese","The Melting Point Alternation in α,ω-Alkanedicarboxylic Acids","Journal of the American Chemical Society","2000","122","","9227","9236","10.1021/ja0011459","","","0.71073","MoKα","","0.046","0.0416","","0.1214","0.1142","","","","1.046","1.08","1.08","","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4116150","5.5261","0.0004","8.8807","0.0006","5.1051","0.0004","90","","91.49","0.002","90","","250.45","0.03","298","2","298","2","","","","","","","Fluka","3","P 1 21/c 1","-P 2ybc","14","Succinic acid","Butane-1,4-dioic acid","","- C4 H6 O4 -","- C2 H3 O2 -","- C8 H12 O8 -","4","1","","Venkat R. Thalladi; Markus Nüsse; Roland Boese","The Melting Point Alternation in α,ω-Alkanedicarboxylic Acids","Journal of the American Chemical Society","2000","122","","9227","9236","10.1021/ja0011459","","","0.71073","MoKα","","0.0457","0.0423","","0.1143","0.1123","","","","1.105","1.171","1.171","","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116151","12.968","0.003","4.8296","0.0012","9.982","0.002","90","","96.872","0.006","90","","620.7","0.2","298","2","298","2","","","","","","","Fluka","3","C 1 2/c 1","-C 2yc","15","Glutaric acid","Pentane-1,5-dioic acid","","- C5 H8 O4 -","- C2.5 H4 O2 -","- C20 H32 O16 -","8","1","","Venkat R. Thalladi; Markus Nüsse; Roland Boese","The Melting Point Alternation in α,ω-Alkanedicarboxylic Acids","Journal of the American Chemical Society","2000","122","","9227","9236","10.1021/ja0011459","","","0.71073","MoKα","","0.0471","0.0415","","0.1267","0.1196","","","","1.046","1.109","1.109","","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116152","7.3712","0.0002","5.154","0.0002","10.1449","0.0004","90","","112.36","0.002","90","","356.44","0.02","298","2","298","2","","","","","","","fluka","3","P 1 21/c 1","-P 2ybc","14","Adipic acid","Hexane-1,6-dioic acid","","- C6 H10 O4 -","- C3 H5 O2 -","- C12 H20 O8 -","4","1","","Venkat R. Thalladi; Markus Nüsse; Roland Boese","The Melting Point Alternation in α,ω-Alkanedicarboxylic Acids","Journal of the American Chemical Society","2000","122","","9227","9236","10.1021/ja0011459","","","0.71073","MoKα","","0.0751","0.0526","","0.1466","0.1299","","","","0.972","1.08","1.08","","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116153","5.6482","0.0004","9.6538","0.0006","16.0217","0.0011","90","","108.018","0.001","90","","830.77","0.1","298","2","298","2","","","","","","","Fluka","3","P 1 21/c 1","-P 2ybc","14","Pimelic acid","Heptane-1,7-dioic acid","","- C7 H14 O4 -","- C7 H12 O4 -","- C28 H48 O16 -","4","1","","Venkat R. Thalladi; Markus Nüsse; Roland Boese","The Melting Point Alternation in α,ω-Alkanedicarboxylic Acids","Journal of the American Chemical Society","2000","122","","9227","9236","10.1021/ja0011459","","","0.71073","MoKα","","0.1023","0.0645","","0.1831","0.1534","","","","0.9","1.076","1.076","","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4116154","17.6631","0.0011","4.789","0.0003","9.8882","0.0007","90","","105.612","0.002","90","","805.57","0.09","298","2","298","2","","","","","","","Fluka","3","C 1 2/c 1","-C 2yc","15","Pimelic acid","Heptane-1,7-dioic acid","","- C7 H14 O4 -","- C3.5 H6 O2 -","- C28 H48 O16 -","8","1","","Venkat R. Thalladi; Markus Nüsse; Roland Boese","The Melting Point Alternation in α,ω-Alkanedicarboxylic Acids","Journal of the American Chemical Society","2000","122","","9227","9236","10.1021/ja0011459","","","0.71073","MoKα","","0.0599","0.0502","","0.1438","0.129","","","","1.03","1.116","1.116","","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116155","8.98","0.004","5.063","0.0014","10.106","0.003","90","","98.18","0.04","90","","454.8","0.3","298","2","298","2","","","","","","","Fluka","3","P 1 21/c 1","-P 2ybc","14","Suberic acid","Octane-1,8-dioic acid","","- C8 H14 O4 -","- C4 H7 O2 -","- C16 H28 O8 -","4","1","","Venkat R. Thalladi; Markus Nüsse; Roland Boese","The Melting Point Alternation in α,ω-Alkanedicarboxylic Acids","Journal of the American Chemical Society","2000","122","","9227","9236","10.1021/ja0011459","","","0.71073","MoKα","","0.0725","0.0582","","0.1475","0.1396","","","","0.911","1.053","1.053","","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116156","22.593","0.002","4.7804","0.0005","9.8445","0.001","90","","109.934","0.002","90","","999.54","0.17","298","2","298","2","","","","","","","Fluka","3","C 1 2/c 1","-C 2yc","15","Azelaic acid","Nonane-1,9-dioic acid","","- C9 H16 O4 -","- C4.5 H8 O2 -","- C36 H64 O16 -","8","1","","Venkat R. Thalladi; Markus Nüsse; Roland Boese","The Melting Point Alternation in α,ω-Alkanedicarboxylic Acids","Journal of the American Chemical Society","2000","122","","9227","9236","10.1021/ja0011459","","","0.71073","MoKα","","0.094","0.0498","","0.1454","0.1179","","","","0.888","1.083","1.083","","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116157","10.6208","0.0006","18.2546","0.0011","24.4927","0.0014","90","","100.601","0.0011","90","","4667.6","0.5","193","2","193","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C46 H65 Al2 N3 O P2 Si2 -","- C46 H65 Al2 N3 O P2 Si2 -","- C184 H260 Al8 N12 O4 P8 Si8 -","4","1","","Kasani Aparna; Robert McDonald; Ronald G. Cavell","Carbon-Carbon Double Bond Formation Reactions of the Unique Spirocyclic Aluminum Bis(iminophosphorano) Methandiide Complex: Insertion of Heteroallenes into Aluminum-Carbon Bonds","Journal of the American Chemical Society","2000","122","","9314","9315","10.1021/ja001445q","","","0.71073","MoKα","","0.0595","0.0412","","","0.1102","0.1178","","","","","","1.038","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116158","12.4477","0.0009","13.2048","0.0009","18.2357","0.0013","91.0447","0.0013","101.967","0.0013","109.623","0.0012","2749.4","0.3","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C55 H80 Al2 N4 P2 Si2 -","- C55 H80 Al2 N4 P2 Si2 -","- C110 H160 Al4 N8 P4 Si4 -","2","1","","Kasani Aparna; Robert McDonald; Ronald G. Cavell","Carbon-Carbon Double Bond Formation Reactions of the Unique Spirocyclic Aluminum Bis(iminophosphorano) Methandiide Complex: Insertion of Heteroallenes into Aluminum-Carbon Bonds","Journal of the American Chemical Society","2000","122","","9314","9315","10.1021/ja001445q","","","0.71073","MoKα","","0.0625","0.0466","","","0.1322","0.1428","","","","","","1.045","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116159","22.448","0.005","10.029","0.002","9.4089","0.0014","90","","90","","90","","2118.2","0.7","295","2","295","2","","","","","","","","4","C m c 21","C 2c -2","36","","","","- C20 H26 Al2 N2 -","- C20 H26 Al2 N2 -","- C80 H104 Al8 N8 -","4","0.5","","Zhengkun Yu; Joanne M. Wittbrodt; Mary Jane Heeg; H. Bernhard Schlegel; Charles H. Winter","Unusually Stable Pyrazolate-Bridged Dialuminum Complexes Containing Bridging Methyl Groups","Journal of the American Chemical Society","2000","122","","9338","9339","10.1021/ja001822z","","","0.71073","MoKα","","0.2015","0.0745","","0.1498","0.1163","","","","1.045","1.31","1.31","","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116160","19.4947","0.0001","5.8781","0.0002","17.7056","0.0006","90","","111.701","0.002","90","","1885.12","0.09","293","2","293","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C18 H24 O5 S -","- C18 H24 O5 S -","- C72 H96 O20 S4 -","4","1","","David A. Evans; Tomislav Rovis; Marisa C. Kozlowski; C. Wade Downey; Jason S. Tedrow","Enantioselective Lewis Acid Catalyzed Michael Reactions of Alkylidene Malonates. Catalysis by C2-Symmetric Bis(oxazoline) Copper(II) Complexes in the Synthesis of Chiral, Differentiated Glutarate Esters","Journal of the American Chemical Society","2000","122","","9134","9142","10.1021/ja002246+","","","0.71073","MoKα","","0.0724","0.0615","","","0.1416","0.1447","","","","","","0.975","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116161","13.8276","0.0007","10.7023","0.0005","14.6248","0.0007","90","","112.289","0.001","90","","2002.57","0.17","213","2","213","2","","","","","","","","8","P 1 21 1","P 2yb","4","","","","- C25 H40 Cl2 Cu F12 N2 O6 Sb2 -","- C25 H42 Cl2 Cu F12 N2 O6 Sb2 -","- C50 H84 Cl4 Cu2 F24 N4 O12 Sb4 -","2","1","","David A. Evans; Tomislav Rovis; Marisa C. Kozlowski; C. Wade Downey; Jason S. Tedrow","Enantioselective Lewis Acid Catalyzed Michael Reactions of Alkylidene Malonates. Catalysis by C2-Symmetric Bis(oxazoline) Copper(II) Complexes in the Synthesis of Chiral, Differentiated Glutarate Esters","Journal of the American Chemical Society","2000","122","","9134","9142","10.1021/ja002246+","","","0.71073","MoKα","","0.1357","0.0665","","","0.1681","0.2422","","","","","","0.976","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116162","10.3851","0.0006","14.4993","0.0009","27.0817","0.0017","90","","90","","90","","4077.9","0.4","213","2","213","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C33 H34 Cu F12 N2 O6 Sb -","- C33 H34 Cu F12 N2 O6 Sb2 -","- C132 H136 Cu4 F48 N8 O24 Sb8 -","4","1","","David A. Evans; Tomislav Rovis; Marisa C. Kozlowski; C. Wade Downey; Jason S. Tedrow","Enantioselective Lewis Acid Catalyzed Michael Reactions of Alkylidene Malonates. Catalysis by C2-Symmetric Bis(oxazoline) Copper(II) Complexes in the Synthesis of Chiral, Differentiated Glutarate Esters","Journal of the American Chemical Society","2000","122","","9134","9142","10.1021/ja002246+","","","0.71073","MoKα","","0.1274","0.071","","","0.1403","0.1633","","","","","","1.093","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116163","26.6894","0.0004","16.0571","0.0003","9.9528","0.0001","90","","90","","90","","4265.32","0.11","150","1","150","1","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C39 H67 B P5 Re -","- C39 H67 B P5 Re -","- C156 H268 B4 P20 Re4 -","4","0.5","","Kamaluddin Abdur-Rashid; Tina P. Fong; Bronwyn Greaves; Dmitry G. Gusev; Justin G. Hinman; Shaun E. Landau; Alan J. Lough; Robert H. Morris","An Acidity Scale for Phosphorus-Containing Compounds Including Metal Hydrides and Dihydrogen Complexes in THF: Toward the Unification of Acidity Scales","Journal of the American Chemical Society","2000","122","","9155","9171","10.1021/ja994428d","","","0.71073","MoKα","","0.0423","0.0316","","","0.081","0.0863","","","","","","1.032","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116164","9.5274","0.0002","15.7802","0.0004","20.4054","0.0004","90","","76.51","0.001","90","","2983.2","0.11","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H21 Cr Mn N3 O12 -","- C26 H21.4 Cr Mn N3 O12 -","- C104 H85.6 Cr4 Mn4 N12 O48 -","4","1","","S. Bénard; P. Yu; J. P. Audière; E. Rivière; R. Clément; J. Guilhem; L. Tchertanov; K. Nakatani","Structure and NLO Properties of Layered Bimetallic Oxalato-Bridged Ferromagnetic Networks Containing Stilbazolium-Shaped Chromophores","Journal of the American Chemical Society","2000","122","","9444","9454","10.1021/ja0002619","","","0.71073","MoKα","","0.0673","0.0498","","0.1243","","0.1108","","","1.122","","","1.169","","","","has coordinates,has disorder","178932","2020-10-21","18:00:00",""
"4116165","9.535","0.001","15.89","0.002","18.229","0.002","90","","83.81","0.009","90","","2745.8","0.5","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25 H24 Cr Mn N O13 -","- C25 H24 Cr Mn N O13 -","- C100 H96 Cr4 Mn4 N4 O52 -","4","1","","S. Bénard; P. Yu; J. P. Audière; E. Rivière; R. Clément; J. Guilhem; L. Tchertanov; K. Nakatani","Structure and NLO Properties of Layered Bimetallic Oxalato-Bridged Ferromagnetic Networks Containing Stilbazolium-Shaped Chromophores","Journal of the American Chemical Society","2000","122","","9444","9454","10.1021/ja0002619","","","0.71073","MoKα","","0.067","0.0507","","0.1249","","0.1037","","","1.161","","","1.216","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116166","9.8502","0.0009","9.8632","0.0008","10.0719","0.0009","73.423","0.001","69.357","0.001","61.209","0.001","794.51","0.12","223","2","223","2","","","","","","","","4","P -1","-P 1","2","","","","- C24 H54 In2 O6 -","- C24 H54 In2 O6 -","- C24 H54 In2 O6 -","1","0.5","","Seigi Suh; David M. Hoffman","General Synthesis of Homoleptic Indium Alkoxide Complexes and the Chemical Vapor Deposition of Indium Oxide Films","Journal of the American Chemical Society","2000","122","","9396","9404","10.1021/ja000845a","","","0.71073","MoKα","","0.0399","0.0383","","","0.0993","0.1017","","","","","","1.129","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4116167","12.1119","0.0006","13.5007","0.0007","45.6039","0.0024","90","","96.723","0.001","90","","7405.8","0.7","223","2","223","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C60 H132 In4 O12 -","- C60 H120 In4 O12 -","- C240 H480 In16 O48 -","4","1","","Seigi Suh; David M. Hoffman","General Synthesis of Homoleptic Indium Alkoxide Complexes and the Chemical Vapor Deposition of Indium Oxide Films","Journal of the American Chemical Society","2000","122","","9396","9404","10.1021/ja000845a","","","0.71073","MoKα","","0.0546","0.0426","","","0.1012","0.1113","","","","","","1.215","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4116168","9.8335","0.0006","11.4492","0.0007","15.4315","0.0009","111.581","0.001","90.335","0.001","93.682","0.001","1611.43","0.17","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H52 In N4 O3.5 -","- C28 H52 In N4 O3.5 -","- C56 H104 In2 N8 O7 -","2","1","","Seigi Suh; David M. Hoffman","General Synthesis of Homoleptic Indium Alkoxide Complexes and the Chemical Vapor Deposition of Indium Oxide Films","Journal of the American Chemical Society","2000","122","","9396","9404","10.1021/ja000845a","","","0.71073","MoKα","","0.0364","0.0344","","","0.0895","0.0918","","","","","","1.046","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116169","24.1308","0.0013","12.6401","0.0007","32.2968","0.0018","90","","102.835","0.001","90","","9604.9","0.9","223","2","223","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C47.5 H77 In N2 O3 -","- C47.5 H77 In N2 O3 -","- C380 H616 In8 N16 O24 -","8","1","","Seigi Suh; David M. Hoffman","General Synthesis of Homoleptic Indium Alkoxide Complexes and the Chemical Vapor Deposition of Indium Oxide Films","Journal of the American Chemical Society","2000","122","","9396","9404","10.1021/ja000845a","","","0.71073","MoKα","","0.0289","0.0212","","","0.0511","0.0567","","","","","","1.147","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116170","14.4944","0.0008","16.2071","0.0009","12.6679","0.0007","90","","107.677","0.001","90","","2835.3","0.3","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H49 In N2 O3 -","- C25 H49 In N2 O3 -","- C100 H196 In4 N8 O12 -","4","1","","Seigi Suh; David M. Hoffman","General Synthesis of Homoleptic Indium Alkoxide Complexes and the Chemical Vapor Deposition of Indium Oxide Films","Journal of the American Chemical Society","2000","122","","9396","9404","10.1021/ja000845a","","","0.71073","MoKα","","0.025","0.0193","","","0.0505","0.0552","","","","","","1.108","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116171","19.6229","0.0011","11.9153","0.0007","19.3","0.0011","90","","98.961","0.001","90","","4457.5","0.4","223","2","223","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C38 H74 In2 O8 -","- C38.08 H74.18 In2.08 O8 -","- C152.32 H296.72 In8.32 O32 -","4","0.5","","Seigi Suh; David M. Hoffman","General Synthesis of Homoleptic Indium Alkoxide Complexes and the Chemical Vapor Deposition of Indium Oxide Films","Journal of the American Chemical Society","2000","122","","9396","9404","10.1021/ja000845a","","","0.71073","MoKα","","0.0417","0.0318","","","0.0809","0.0902","","","","","","1.109","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4116172","12.018","0.0014","8.6571","0.0006","13.973","0.002","90","","90","","90","","1453.8","0.3","295","","295","","","","","","","","","6","P b c m","-P 2c 2b","57","","","","- C13 H15 F3 Mo O3 S -","- C12.5 H14.5 F2.5 Mo0.5 O2.5 S0.5 -","- C50 H58 F10 Mo2 O10 S2 -","4","0.5","","Christoph Balzarek; Timothy J. R. Weakley; David R. Tyler","C-H Bond Activation in Aqueous Solution: Kinetics and Mechanism of H/D Exchange in Alcohols Catalyzed by Molybdocenes","Journal of the American Chemical Society","2000","122","","9427","9434","10.1021/ja001535v","","","0.71073","MoKα","","0.044","0.029","","0.034","","0.033","","","1.51","","","1.59","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116173","12.2333","0.0016","12.779","0.003","14.8254","0.002","89.398","0.016","73.53","0.015","68.792","0.018","2061","0.7","295.2","","295","","","","","","","","","5","P -1","-P 1","2","","","","- C21 H26 Mo O5 S -","- C21 H25 Mo O5 S -","- C84 H100 Mo4 O20 S4 -","4","2","","Christoph Balzarek; Timothy J. R. Weakley; David R. Tyler","C-H Bond Activation in Aqueous Solution: Kinetics and Mechanism of H/D Exchange in Alcohols Catalyzed by Molybdocenes","Journal of the American Chemical Society","2000","122","","9427","9434","10.1021/ja001535v","","","0.71073","MoKα","","0.067","0.042","","0.087","","0.043","","","1.36","","","1.46","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116174","13.4968","0.0008","17.822","0.001","21.321","0.001","78.194","0.001","79.992","0.001","87.845","0.001","4943.7","0.5","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C49 H27 B2 F30 N3 O -","- C49 H27 B2 F30 N3 O -","- C196 H108 B8 F120 N12 O4 -","4","2","","Robert E. LaPointe; Gordon R. Roof; Khalil A. Abboud; Jerzy Klosin","New Family of Weakly Coordinating Anions","Journal of the American Chemical Society","2000","122","","9560","9561","10.1021/ja002664e","","","0.71073","MoKα","","0.0954","0.043","","","0.0889","0.1021","","","","","","0.912","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116175","10.264","0.0005","22.276","0.001","12.4462","0.0006","90","","112.857","0.001","90","","2622.3","0.2","173","2","173","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C49 H27 Al2 F30 N3 O -","- C49.002 H27.01 Al2 F30 N3 O -","- C98.004 H54.02 Al4 F60 N6 O2 -","2","0.5","","Robert E. LaPointe; Gordon R. Roof; Khalil A. Abboud; Jerzy Klosin","New Family of Weakly Coordinating Anions","Journal of the American Chemical Society","2000","122","","9560","9561","10.1021/ja002664e","","","0.71073","MoKα","","0.0694","0.0444","","","0.1188","0.1292","","","","","","1.028","","","","has coordinates,has disorder","178932","2020-10-21","18:00:00",""
"4116176","10.199","0.002","10.631","0.002","14.062","0.002","82.49","0.01","69.358","0.01","83.35","0.01","1410.6","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H32 N11 O11 Pr -","- C18 H32 N11 O11 Pr -","- C36 H64 N22 O22 Pr2 -","2","1","","Myrtil L. Kahn; Jean-Pascal Sutter; Stephane Golhen; Philippe Guionneau; Lahcene Ouahab; Olivier Kahn; Daniel Chasseau","Systematic Investigations of the Nature of the Coupling between a Ln(III) Ion (Ln = Ce(III) to Dy(III)) and Its Aminoxyl Radical Ligands. Structural and Magnetic Characteristics of a Series of {Ln(organic radical)2} Compounds and the Related {Ln(Nitrone)2} Derivatives [J. Am. Chem. Soc.2000,122, 3413-3421].","Journal of the American Chemical Society","2000","122","","9566","9566","","","","0.71073","MoKα","","0.1004","0.0343","","","0.0699","0.0799","","","","","","1.041","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116177","9.3904","0.0016","11.8641","0.0019","25.019","0.004","90","","90","","90","","2787.3","0.8","123","2","123","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(S)-1-(2-methyl-5-phenyl-3-thienyl)-2-[2-(3-methyl-1-penten-1-yl) -5-phenyl-3-thienyl]-3,3,4,4,5,5-hexafluorocyclopentene","","- C32 H26 F6 S2 -","- C32 H26 F6 S2 -","- C128 H104 F24 S8 -","4","1","","Tetsuhiro Kodani; Kenji Matsuda; Taro Yamada; Seiya Kobatake; Masahiro Irie","Reversible Diastereoselective Photocyclization of a Diarylethene in a Single-Crystalline Phase","Journal of the American Chemical Society","2000","122","","9631","9637","10.1021/ja001350o","","","0.71073","MoKα","","0.055","0.0464","","","0.1151","0.1205","","","","","","1.048","","","","has coordinates,has disorder","178932","2020-10-21","18:00:00",""
"4116178","9.368","0.001","11.8571","0.0012","24.971","0.003","90","","90","","90","","2773.7","0.5","123","2","123","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(R)-1-(2-methyl-5-phenyl-3-thienyl)-2-[2-(3-methyl-1-penten-1-yl) -5-phenyl-3-thienyl]-3,3,4,4,5,5-hexafluorocyclopentene","","- C32 H26 F6 S2 -","- C32 H26 F6 S2 -","- C128 H104 F24 S8 -","4","1","","Tetsuhiro Kodani; Kenji Matsuda; Taro Yamada; Seiya Kobatake; Masahiro Irie","Reversible Diastereoselective Photocyclization of a Diarylethene in a Single-Crystalline Phase","Journal of the American Chemical Society","2000","122","","9631","9637","10.1021/ja001350o","","","0.71073","MoKα","","0.0574","0.0462","","","0.109","0.1149","","","","","","1.041","","","","has coordinates,has disorder","178932","2020-10-21","18:00:00",""
"4116179","9.399","0.002","11.866","0.003","24.972","0.006","90","","90","","90","","2785.1","1.1","123","2","123","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(S)-1-(2-methyl-5-phenyl-3-thienyl)-2-[2-(3-methyl-1-penten-1-yl) -5-phenyl-3-thienyl]-3,3,4,4,5,5-hexafluorocyclopentene","","- C32 H26 F6 S2 -","- C32 H26 F6 S2 -","- C128 H104 F24 S8 -","4","1","","Tetsuhiro Kodani; Kenji Matsuda; Taro Yamada; Seiya Kobatake; Masahiro Irie","Reversible Diastereoselective Photocyclization of a Diarylethene in a Single-Crystalline Phase","Journal of the American Chemical Society","2000","122","","9631","9637","10.1021/ja001350o","","","0.71073","MoKα","","0.1184","0.066","","","0.1529","0.1781","","","","","","0.891","","","","has coordinates,has disorder","178932","2020-10-21","18:00:00",""
"4116180","13.5363","0.0002","15.322","0.0002","17.8722","0.0003","90","","90","","90","","3706.75","0.1","183","2","183","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C37 H46 F6 Fe P3 Rh -","- C37 H46 F6 Fe P3 Rh -","- C148 H184 F24 Fe4 P12 Rh4 -","4","1","","Ken Tanaka; Shuang Qiao; Mamoru Tobisu; Michael M.-C. Lo; Gregory C. Fu","Enantioselective Isomerization of Allylic Alcohols Catalyzed by a Rhodium/Phosphaferrocene Complex","Journal of the American Chemical Society","2000","122","","9870","9871","10.1021/ja002471r","","","0.71073","MoKα","","0.0596","0.0463","","0.1357","0.0911","","","","1.127","1.094","1.094","","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116181","10.42","0.002","17.208","0.004","7.519","0.002","90","","90","","90","","1348.2","0.5","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H15 N O2 -","- C16 H15 N O2 -","- C64 H60 N4 O8 -","4","1","","Masami Sakamoto; Norio Sekine; Hiroko Miyoshi; Takashi Mino; Tsutomu Fujita","Absolute Asymmetric Phthalide Synthesis via the Solid-State Photoreaction of N,N-Disubstituted 2-Benzoylbenzamides Involving a Radical Pair Intermediate","Journal of the American Chemical Society","2000","122","","10210","10211","10.1021/ja001064c","","","1.5418","CuKα","","","0.032","","","0.035","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116182","11.453","0.003","18.572","0.005","8.107","0.002","90","","90","","90","","1724.4","0.8","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C21 H17 N O2 -","- C21 H17 N O2 -","- C84 H68 N4 O8 -","4","1","","Masami Sakamoto; Norio Sekine; Hiroko Miyoshi; Takashi Mino; Tsutomu Fujita","Absolute Asymmetric Phthalide Synthesis via the Solid-State Photoreaction of N,N-Disubstituted 2-Benzoylbenzamides Involving a Radical Pair Intermediate","Journal of the American Chemical Society","2000","122","","10210","10211","10.1021/ja001064c","","","1.5418","CuKα","","","0.044","","","0.044","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116183","19.106","0.005","8.019","0.002","11.986","0.003","90","","90.37","0.02","90","","1836.3","0.8","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C22 H19 N O2 -","- C11 H9.5 N0.5 O -","- C44 H38 N2 O4 -","4","2","","Masami Sakamoto; Norio Sekine; Hiroko Miyoshi; Takashi Mino; Tsutomu Fujita","Absolute Asymmetric Phthalide Synthesis via the Solid-State Photoreaction of N,N-Disubstituted 2-Benzoylbenzamides Involving a Radical Pair Intermediate","Journal of the American Chemical Society","2000","122","","10210","10211","10.1021/ja001064c","","","1.5418","CuKα","","","0.044","","","0.045","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116184","11.021","0.001","7.43","0.002","13.721","0.002","90","0.02","99.04","0.01","90","0.02","1109.6","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[Ag(Py2O)]NO3","","","- C10 H8 Ag N3 O4 -","- C10 H8 Ag N3 O4 -","- C40 H32 Ag4 N12 O16 -","4","1","","Ok-Sang Jung; Yun Ju Kim; Young-A Lee; Jong Ku Park; Hee K. Chae","Smart Molecular Helical Springs as Tunable Receptors","Journal of the American Chemical Society","2000","122","","9921","9925","10.1021/ja001618b","","","0.71073","MoKα","","0.0306","0.0306","","","0.0829","0.0829","","","","","","1.041","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116185","10.483","0.004","8.933","0.001","13.707","0.002","90","0.01","104.72","0.02","90","0.02","1241.5","0.5","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","[Ag(Py2O)]BF4","","","- C10 H8 Ag B F4 N2 O -","- C10 H8 Ag B F4 N2 O -","- C40 H32 Ag4 B4 F16 N8 O4 -","4","1","","Ok-Sang Jung; Yun Ju Kim; Young-A Lee; Jong Ku Park; Hee K. Chae","Smart Molecular Helical Springs as Tunable Receptors","Journal of the American Chemical Society","2000","122","","9921","9925","10.1021/ja001618b","","","0.71073","MoKα","","0.055","0.0547","","","0.147","0.1478","","","","","","1.119","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116186","10.553","0.001","9.034","0.002","13.708","0.002","90","0.02","106.7","0.01","90","0.01","1251.7","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[Ag(Py2O)]ClO4","","","- C10 H8 Ag Cl N2 O5 -","- C10 H8 Ag Cl N2 O5 -","- C40 H32 Ag4 Cl4 N8 O20 -","4","1","","Ok-Sang Jung; Yun Ju Kim; Young-A Lee; Jong Ku Park; Hee K. Chae","Smart Molecular Helical Springs as Tunable Receptors","Journal of the American Chemical Society","2000","122","","9921","9925","10.1021/ja001618b","","","0.71073","MoKα","","0.0381","0.0372","","","0.0968","0.0976","","","","","","1.085","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116187","10.575","0.003","9.621","0.002","14.175","0.003","90","0.02","109.8","0.01","90","0.02","1356.9","0.6","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","[Ag(Py2O)]PF6","","","- C10 H8 Ag F6 N2 O P -","- C10 H8 Ag F6 N2 O P -","- C40 H32 Ag4 F24 N8 O4 P4 -","4","1","","Ok-Sang Jung; Yun Ju Kim; Young-A Lee; Jong Ku Park; Hee K. Chae","Smart Molecular Helical Springs as Tunable Receptors","Journal of the American Chemical Society","2000","122","","9921","9925","10.1021/ja001618b","","","0.71073","MoKα","","0.0356","0.0352","","","0.0907","0.0911","","","","","","1.217","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116188","19.3462","0.0002","19.3462","0.0002","51.7863","0.0008","90","","90","","120","","16785.6","0.4","138","2","138","2","","","","","","","","8","R -3 c :H","-R 3 2""c","167","4","","","- C126 H78 Cl0 N7 O7 P6 Pd2 Tl -","- C125.76 H78 N7 O6.96 P6 Pd2 Tl -","- C754.56 H468 N42 O41.76 P36 Pd12 Tl6 -","6","0.166667","","Vincent J. Catalano; Byron L. Bennett; Renante L. Yson; Bruce C. Noll","Synthesis and Characterization of Pd(0) and Pt(0) Metallocryptands Encapsulating Tl+ Ion","Journal of the American Chemical Society","2000","122","","10056","10062","10.1021/ja001672s","","","0.71073","MoKα","","0.1167","0.0816","","","0.2356","0.2498","","","","","","1.579","","","","has coordinates,has disorder","178932","2020-10-21","18:00:00",""
"4116189","33.6379","0.0005","14.813","0.0001","41.9035","0.0006","90","","107.743","0.001","90","","19886.4","0.4","293","2","138","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","1","","","- C109.25 H63 Cl0.75 N7 O5 P6 Pt2 Tl -","- C109.25 H63 Cl0.75 N7 O5 P6 Pt2 Tl -","- C874 H504 Cl6 N56 O40 P48 Pt16 Tl8 -","8","1","","Vincent J. Catalano; Byron L. Bennett; Renante L. Yson; Bruce C. Noll","Synthesis and Characterization of Pd(0) and Pt(0) Metallocryptands Encapsulating Tl+ Ion","Journal of the American Chemical Society","2000","122","","10056","10062","10.1021/ja001672s","","","0.71073","MoKα","","0.145","0.0642","","","0.1339","0.1606","","","","","","0.966","","","","has coordinates,has disorder","178932","2020-10-21","18:00:00",""
"4116190","19.3694","0.0001","19.3694","0.0001","51.9258","0.0002","90","","90","","120","","16871.2","0.14","138","2","293","2","","","","","","","","8","R -3 c :H","-R 3 2""c","167","2","","","- C126 H78 Cl0 N7 O7 P6 Pt2 Tl -","- C125.76 H78 N7 O6.96 P6 Pt2 Tl -","- C754.56 H468 N42 O41.76 P36 Pt12 Tl6 -","6","0.166667","","Vincent J. Catalano; Byron L. Bennett; Renante L. Yson; Bruce C. Noll","Synthesis and Characterization of Pd(0) and Pt(0) Metallocryptands Encapsulating Tl+ Ion","Journal of the American Chemical Society","2000","122","","10056","10062","10.1021/ja001672s","","","0.71073","MoKα","","0.0752","0.0436","","","0.1312","0.1445","","","","","","1.102","","","","has coordinates,has disorder","178932","2020-10-21","18:00:00",""
"4116191","21.1124","0.0008","20.3657","0.0008","26.3042","0.001","90","","102.57","","90","","11038.9","0.7","293","2","138","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","3","","","- C132 H78 F0 N7 O3 P6 Pd2 Tl -","- C132 H78 N7 O3 P6 Pd2 Tl -","- C528 H312 N28 O12 P24 Pd8 Tl4 -","4","0.5","","Vincent J. Catalano; Byron L. Bennett; Renante L. Yson; Bruce C. Noll","Synthesis and Characterization of Pd(0) and Pt(0) Metallocryptands Encapsulating Tl+ Ion","Journal of the American Chemical Society","2000","122","","10056","10062","10.1021/ja001672s","","","0.71073","MoKα","","0.0988","0.0669","","","0.182","0.1984","","","","","","1.045","","","","has coordinates,has disorder","178932","2020-10-21","18:00:00",""
"4116192","8.355","0.002","17.337","0.004","11.351","0.003","90","","96.55","0.02","90","","1633.5","0.7","298","2","298","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C32 H37 Co2 O6 P S -","- C32 H37 Co2 O6 P S -","- C64 H74 Co4 O12 P2 S2 -","2","1","","Xavier Verdaguer; Albert Moyano; Miquel A. Pericàs; Antoni Riera; Miguel Angel Maestro; José Mahía","A New Chiral Bidentate (P,S) Ligand for the Asymmetric Intermolecular Pauson-Khand Reaction","Journal of the American Chemical Society","2000","122","","10242","10243","10.1021/ja001839h","","","0.71073","MoKα","","0.0555","0.0396","","","0.0813","0.0895","","","","","","1.067","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116193","12.793","0.002","13.881","0.002","18.919","0.002","90","","99.501","0.008","90","","3313.5","0.8","296.2","","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C30 H31 Cl F6 N4 O2 P2 Ru -","- C30 H31 Cl F6 N4 O2 P2 Ru -","- C120 H124 Cl4 F24 N16 O8 P8 Ru4 -","4","1","","Dusan Hesek; Guy A. Hembury; Michael G. B. Drew; Seiji Taniguchi; Yoshihisa Inoue","Atropisomer and Diastereomer Generation and Control in Ruthenium Bis(bipyridine) Phosphonite Complexes","Journal of the American Chemical Society","2000","122","","10236","10237","10.1021/ja002117t","","","0.71073","MoKα","","0.0887","0.0432","","","0.1193","0.1402","","","","","","1.016","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116194","12.509","0.014","14.445","0.017","18.52","0.02","90","","100.23","0.01","90","","3293","6","296.2","","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C29 H31 Cl F6 N4 O3 P2 Ru -","- C29 H31 Cl F6 N4 O3 P2 Ru -","- C116 H124 Cl4 F24 N16 O12 P8 Ru4 -","4","1","","Dusan Hesek; Guy A. Hembury; Michael G. B. Drew; Seiji Taniguchi; Yoshihisa Inoue","Atropisomer and Diastereomer Generation and Control in Ruthenium Bis(bipyridine) Phosphonite Complexes","Journal of the American Chemical Society","2000","122","","10236","10237","10.1021/ja002117t","","","0.71073","MoKα","","0.0724","0.035","","","0.0934","0.1139","","","","","","1.036","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116195","14.612","0.004","14.25","0.006","16.426","0.003","90","","111.269","0.014","90","","3187.3","1.7","296.2","","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C28 H27 Cl F6 N4 O2 P2 Ru -","- C28 H27 Cl F6 N4 O2 P2 Ru -","- C112 H108 Cl4 F24 N16 O8 P8 Ru4 -","4","1","","Dusan Hesek; Guy A. Hembury; Michael G. B. Drew; Seiji Taniguchi; Yoshihisa Inoue","Atropisomer and Diastereomer Generation and Control in Ruthenium Bis(bipyridine) Phosphonite Complexes","Journal of the American Chemical Society","2000","122","","10236","10237","10.1021/ja002117t","","","0.71069","MoKα","","0.1954","0.0511","","","0.1248","0.1677","","","","","","0.948","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116196","14.55","0.002","15.126","0.004","15.9844","0.0016","90","","111.435","0.008","90","","3274.6","1","296.2","","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C28 H27 Cl F6 N4 O2 P2 Ru -","- C28 H27 Cl F6 N4 O2 P2 Ru -","- C112 H108 Cl4 F24 N16 O8 P8 Ru4 -","4","1","","Dusan Hesek; Guy A. Hembury; Michael G. B. Drew; Seiji Taniguchi; Yoshihisa Inoue","Atropisomer and Diastereomer Generation and Control in Ruthenium Bis(bipyridine) Phosphonite Complexes","Journal of the American Chemical Society","2000","122","","10236","10237","10.1021/ja002117t","","","0.71073","MoKα","","0.13","0.0677","","","0.1967","0.2182","","","","","","1.286","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116197","26.711","0.003","26.711","0.003","9.884","0.004","90","","90","","120","","6107","3","128.2","","128.2","","","","","","","","","4","P 61","P 61","169","","","","- C32 H57 N5 O9 -","- C34 H65 N6 O11.5 -","- C204 H390 N36 O69 -","6","1","","Hiroshi Kogen; Toshihiro Kiho; Mizuka Nakayama; Youji Furukawa; Takeshi Kinoshita; Masatoshi Inukai","Crystal Structure and Total Synthesis of Globomycin: Establishment of Relative and Absolute Configurations","Journal of the American Chemical Society","2000","122","","10214","10215","10.1021/ja002547j","","","1.5418","CuKα","","","0.0531","","","0.0703","","","","","1.158","1.158","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116198","10.078","0.001","10.3207","0.0006","10.145","0.001","90","","105.21","0.01","90","","1018.24","0.16","293","2","293","2","","","","","","","","2","C 1 2/c 1","-C 2yc","15","cesium_bismuthide","Cs3Bi2","","- Bi2 Cs3 -","- Bi2 Cs3 -","- Bi8 Cs12 -","4","0.5","","Franck Gascoin; Slavi C. Sevov","Synthesis and Characterization of A3Bi2 (A = K, Rb, Cs) with Isolated Diatomic Dianion of Bismuth, [Bi2]2-, and an Extra Delocalized Electron","Journal of the American Chemical Society","2000","122","","10251","10252","10.1021/ja002606t","","","0.71073","MoKα","","0.0693","0.0414","","","0.0824","0.0909","","","","","","1.011","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116199","11.881","0.001","7.921","0.001","12.893","0.007","90","0","91.1","0.03","90","0","1213.1","0.7","295","","295","","","","","","","","......","4","P 1 21/c 1","-P 2ybc","14","","3-[1-(Phenylamino) ethylidene]-6-methyl-3H-pyran-2,4-dione","","- C14 H13 N O3 -","- C14 H13 N O3 -","- C56 H52 N4 O12 -","4","1","","Paola Gilli; Valerio Bertolasi; Valeria Ferretti; Gastone Gilli","Evidence for Intramolecular N-H...O Resonance-Assisted Hydrogen Bonding in β-Enaminones and Related Heterodienes. A Combined Crystal-Structural, IR and NMR Spectroscopic, and Quantum-Mechanical Investigation","Journal of the American Chemical Society","2000","122","","10405","10417","10.1021/ja000921+","","","0.71069","MoKα","","","0.044","","","","0.06","","","","","","2.02","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4116200","11.82","0.001","7.713","0.001","12.974","0.001","90","","91.12","0.01","90","","1182.6","0.2","150","","150","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-[1-(Phenylamino) ethylidene]-6-methyl-3H-pyran-2,4-dione","","- C14 H13 N O3 -","- C14 H13 N O3 -","- C56 H52 N4 O12 -","4","1","","Paola Gilli; Valerio Bertolasi; Valeria Ferretti; Gastone Gilli","Evidence for Intramolecular N-H...O Resonance-Assisted Hydrogen Bonding in β-Enaminones and Related Heterodienes. A Combined Crystal-Structural, IR and NMR Spectroscopic, and Quantum-Mechanical Investigation","Journal of the American Chemical Society","2000","122","","10405","10417","10.1021/ja000921+","","","1.5418","CuKα","","0.0404","0.04","","0.1025","0.1022","","","","1.163","1.173","1.173","","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116201","12.982","0.002","7.68","0.002","14.015","0.001","90","0","107.53","0.05","90","0","1332.4","0.6","295","","295","","","","","","","","......","4","P 1 21/a 1","-P 2yab","14","","3-[1-(4-Methoxyphenylamino) ethylidene]-6-methyl-3H-pyran-2,4-dione","","- C15 H15 N O4 -","- C15 H15 N O4 -","- C60 H60 N4 O16 -","4","1","","Paola Gilli; Valerio Bertolasi; Valeria Ferretti; Gastone Gilli","Evidence for Intramolecular N-H...O Resonance-Assisted Hydrogen Bonding in β-Enaminones and Related Heterodienes. A Combined Crystal-Structural, IR and NMR Spectroscopic, and Quantum-Mechanical Investigation","Journal of the American Chemical Society","2000","122","","10405","10417","10.1021/ja000921+","","","0.71069","MoKα","","","0.046","","","","0.057","","","","","","1.79","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4116202","12.999","0.002","7.547","0.001","13.974","0.002","90","","107.69","0.01","90","","1306.1","0.3","150","","150","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","3-[1-(4-Methoxyphenylamino) ethylidene]-6-methyl-3H-pyran-2,4-dione","","- C15 H15 N O4 -","- C15 H15 N O4 -","- C60 H60 N4 O16 -","4","1","","Paola Gilli; Valerio Bertolasi; Valeria Ferretti; Gastone Gilli","Evidence for Intramolecular N-H...O Resonance-Assisted Hydrogen Bonding in β-Enaminones and Related Heterodienes. A Combined Crystal-Structural, IR and NMR Spectroscopic, and Quantum-Mechanical Investigation","Journal of the American Chemical Society","2000","122","","10405","10417","10.1021/ja000921+","","","1.54178","CuKα","","0.0454","0.0436","","0.1246","0.1219","","","","1.11","1.119","1.119","","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116203","7.401","0.001","8.364","0.002","10.683","0.002","97.51","0.01","103.45","0.01","92.69","0.01","635.6","0.2","295","","295","","","","","","","","......","5","P -1","-P 1","2","","3-[1-(4-Chlorophenylamino) ethylidene]-6-methyl-3H-pyran-2,4-dione","","- C14 H12 Cl N O3 -","- C14 H12 Cl N O3 -","- C28 H24 Cl2 N2 O6 -","2","1","","Paola Gilli; Valerio Bertolasi; Valeria Ferretti; Gastone Gilli","Evidence for Intramolecular N-H...O Resonance-Assisted Hydrogen Bonding in β-Enaminones and Related Heterodienes. A Combined Crystal-Structural, IR and NMR Spectroscopic, and Quantum-Mechanical Investigation","Journal of the American Chemical Society","2000","122","","10405","10417","10.1021/ja000921+","","","0.71069","MoKα","","","0.043","","","","0.062","","","","","","2.14","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4116204","7.3373","0.0005","8.2919","0.0005","10.59","0.009","98.525","0.009","102.805","0.005","91.989","0.007","619.8","0.5","150","","150","","","","","","","","","5","P -1","-P 1","2","","3-[1-(4-Chlorophanylamino) ethylidene]-6-methyl-3H-pyran-2,4-dione","","- C14 H12 Cl N O3 -","- C14 H12 Cl N O3 -","- C28 H24 Cl2 N2 O6 -","2","1","","Paola Gilli; Valerio Bertolasi; Valeria Ferretti; Gastone Gilli","Evidence for Intramolecular N-H...O Resonance-Assisted Hydrogen Bonding in β-Enaminones and Related Heterodienes. A Combined Crystal-Structural, IR and NMR Spectroscopic, and Quantum-Mechanical Investigation","Journal of the American Chemical Society","2000","122","","10405","10417","10.1021/ja000921+","","","1.54178","CuKα","","0.036","0.0359","","0.1074","0.1074","","","","1.162","1.164","1.164","","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116205","13.21","0.004","14.666","0.002","10.13","0.003","90","0","92.46","0.02","90","0","1960.8","0.9","295","","295","","","","","","","","......","4","C 1 2/c 1","-C 2yc","15","","N,N'-3-Azapentane-1,5-bis[3-(1-aminoethylidene)-6-methyl-3H-pyran- 2,4-dione]","","- C20 H25 N3 O6 -","- C20 H25 N3 O6 -","- C80 H100 N12 O24 -","4","0.5","","Paola Gilli; Valerio Bertolasi; Valeria Ferretti; Gastone Gilli","Evidence for Intramolecular N-H...O Resonance-Assisted Hydrogen Bonding in β-Enaminones and Related Heterodienes. A Combined Crystal-Structural, IR and NMR Spectroscopic, and Quantum-Mechanical Investigation","Journal of the American Chemical Society","2000","122","","10405","10417","10.1021/ja000921+","","","0.71069","MoKα","","","0.046","","","","0.059","","","","","","1.96","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4116206","8.934","0.002","10.93","0.001","8.044","0.003","106.24","0.02","114.49","0.02","83.28","0.01","686.3","0.3","295","","295","","","","","","","","......","4","P -1","-P 1","2","","3-(3-methoxyphenylamino)-5,5-dimethyl-2-nitroso-2-cyclohexen-1-one","","- C15 H18 N2 O3 -","- C15 H18 N2 O3 -","- C30 H36 N4 O6 -","2","1","","Paola Gilli; Valerio Bertolasi; Valeria Ferretti; Gastone Gilli","Evidence for Intramolecular N-H...O Resonance-Assisted Hydrogen Bonding in β-Enaminones and Related Heterodienes. A Combined Crystal-Structural, IR and NMR Spectroscopic, and Quantum-Mechanical Investigation","Journal of the American Chemical Society","2000","122","","10405","10417","10.1021/ja000921+","","","0.71069","MoKα","","","0.042","","","","0.054","","","","","","1.76","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4116207","7.502","0.001","12.181","0.003","10.846","0.001","90","0","100.44","0.01","90","0","974.7","0.3","295","","295","","","","","","","","......","4","P 1 21/c 1","-P 2ybc","14","","o-Acetoacetotoluidide","","- C11 H13 N O2 -","- C11 H13 N O2 -","- C44 H52 N4 O8 -","4","1","","Paola Gilli; Valerio Bertolasi; Valeria Ferretti; Gastone Gilli","Evidence for Intramolecular N-H...O Resonance-Assisted Hydrogen Bonding in β-Enaminones and Related Heterodienes. A Combined Crystal-Structural, IR and NMR Spectroscopic, and Quantum-Mechanical Investigation","Journal of the American Chemical Society","2000","122","","10405","10417","10.1021/ja000921+","","","0.71069","MoKα","","","0.044","","","","0.053","","","","","","1.7","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4116208","6.727","0.002","21.286","0.003","7.99","0.001","90","0","113.7","0.02","90","0","1047.6","0.4","295","","295","","","","","","","","......","4","P 1 21/a 1","-P 2yab","14","","o-Acetoacetanisidide","","- C11 H13 N O3 -","- C11 H13 N O3 -","- C44 H52 N4 O12 -","4","1","","Paola Gilli; Valerio Bertolasi; Valeria Ferretti; Gastone Gilli","Evidence for Intramolecular N-H...O Resonance-Assisted Hydrogen Bonding in β-Enaminones and Related Heterodienes. A Combined Crystal-Structural, IR and NMR Spectroscopic, and Quantum-Mechanical Investigation","Journal of the American Chemical Society","2000","122","","10405","10417","10.1021/ja000921+","","","0.71069","MoKα","","","0.042","","","","0.057","","","","","","1.92","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4116209","11.392","0.005","11.392","0.005","3.938","0.003","90","","90","","120","","442.6","0.4","293","2","293","2","","","","","","","","3","P -6 2 m","P -6 -2","189","","Ba2NiSi3","","- Ba2 Ni Si3 -","- Ba2 Ni Si3 -","- Ba6 Ni3 Si9 -","3","0.25","","Joanna Goodey; Jianggao Mao; Arnold M. Guloy","Ba2NiSi3: A One-Dimensional Solid-State Metallocene Analog","Journal of the American Chemical Society","2000","122","","10478","10479","10.1021/ja0016102","","","0.71073","MoKα","","0.0522","0.0502","","0.1217","0.1201","","","","1.126","1.133","1.133","","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116210","15.064","0.002","13.013","0.003","12.47","0.002","90","","112.732","0.012","90","","2254.6","0.7","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H44 Mo8 N2 O26 S8 -","- C10 Mo8 N2 O26 S8 -","- C20 Mo16 N4 O52 S16 -","2","0.5","","Bernadette Salignac; Sandra Riedel; Anne Dolbecq; Francis Sécheresse; Emmanuel Cadot","""Wheeling Templates"" in Molecular Oxothiomolybdate Rings: Syntheses, Structures, and Dynamics","Journal of the American Chemical Society","2000","122","","10381","10389","10.1021/ja001878t","","","0.71073","MoKα","","0.0398","0.0309","","0.0904","0.0848","","","","1.057","1.077","1.077","","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116211","13.5426","0.0002","18.5523","0.0003","22.5839","0.0003","90","","103.703","0.001","90","","5512.62","0.14","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C5 H38 Cs2 Mo10 O35 S10 -","- C5 Cs2 Mo10 O35 S10 -","- C20 Cs8 Mo40 O140 S40 -","4","1","","Bernadette Salignac; Sandra Riedel; Anne Dolbecq; Francis Sécheresse; Emmanuel Cadot","""Wheeling Templates"" in Molecular Oxothiomolybdate Rings: Syntheses, Structures, and Dynamics","Journal of the American Chemical Society","2000","122","","10381","10389","10.1021/ja001878t","","","0.71073","MoKα","","0.0675","0.0492","","0.1365","0.1299","","","","0.995","1.131","1.131","","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116212","24.296","0.004","10.165","0.003","21.828","0.006","90","","90","","90","","5391","2","296","2","296","2","","","","","","","","6","C m c 21","C 2c -2","36","","","","- C10 H32 Mo10 O33 Rb4 S10 -","- C10 Mo10 O33 Rb4 S10 -","- C40 Mo40 O132 Rb16 S40 -","4","0.5","","Bernadette Salignac; Sandra Riedel; Anne Dolbecq; Francis Sécheresse; Emmanuel Cadot","""Wheeling Templates"" in Molecular Oxothiomolybdate Rings: Syntheses, Structures, and Dynamics","Journal of the American Chemical Society","2000","122","","10381","10389","10.1021/ja001878t","","","0.71073","MoKα","","0.1167","0.06","","0.1593","0.1294","","","","1.114","1.125","1.125","","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116213","22.285","0.0001","11.0041","0.0002","18.7617","0.0003","90","","123.007","0.001","90","","3858.3","0.1","293","2","293","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C7 H35 Cs2 Mo12 O50 S12 -","- C7 Cs1.98 Mo12 O50 S12 -","- C14 Cs3.96 Mo24 O100 S24 -","2","0.25","","Bernadette Salignac; Sandra Riedel; Anne Dolbecq; Francis Sécheresse; Emmanuel Cadot","""Wheeling Templates"" in Molecular Oxothiomolybdate Rings: Syntheses, Structures, and Dynamics","Journal of the American Chemical Society","2000","122","","10381","10389","10.1021/ja001878t","","","0.71073","MoKα","","0.0566","0.0528","","0.1603","0.1566","","","","0.904","0.926","0.926","","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116214","16.0489","0.0005","9.4521","0.0003","15.9728","0.0006","90","","116.707","0.002","90","","2164.51","0.13","173.2","","173.2","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C48 H32 Cl2 P2 Pd2 S6 -","- C48 H32 Cl2 P2 Pd2 S6 -","- C96 H64 Cl4 P4 Pd4 S12 -","2","0.5","","Olivier Clot; Michael O. Wolf; Brian O. Patrick","Electropolymerization of a Cyclometalated Terthiophene: A Hybrid Material with a Palladium-Carbon Bond to the Backbone","Journal of the American Chemical Society","2000","122","","10456","10457","10.1021/ja002258v","","","0.7107","MoKα","","0.0452","0.0452","","0.0764","","0.0764","","","1.082","","","1.082","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116215","15.2507","0.0007","16.5894","0.0008","25.8511","0.0012","90","","102.923","0.001","90","","6374.7","0.5","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3a*1.5THF","","- C76 H76 N4 O5.5 -","- C72.5 H64 N4 O4 -","- C290 H256 N16 O16 -","4","1","","Michael Harmjanz; Hubert S. Gill; Michael J. Scott","Porphodimethene-Porphyrin Interconversion: A Tetrapyrrolic Redox-Switchable Macrocycle","Journal of the American Chemical Society","2000","122","","10476","10477","10.1021/ja003004c","","","0.71073","MoKα","","0.1044","0.0804","","","0.2182","0.2349","","","","","","1.051","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4116216","29.448","0.003","12.588","0.0012","21.842","0.002","90","","107.913","0.002","90","","7704.2","1.3","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","8*5.25 MeOH","","- C85.25 H84 Co2 N4 O10.25 Zn -","- C85.25 H78 Co2 N4 O10.25 Zn -","- C341 H312 Co8 N16 O41 Zn4 -","4","1","","Michael Harmjanz; Hubert S. Gill; Michael J. Scott","Porphodimethene-Porphyrin Interconversion: A Tetrapyrrolic Redox-Switchable Macrocycle","Journal of the American Chemical Society","2000","122","","10476","10477","10.1021/ja003004c","","","0.71073","MoKα","","0.1352","0.0867","","","0.1955","0.226","","","","","","1.06","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116217","8.1252","0.0012","13.613","0.002","16.659","0.003","82.429","0.005","78.351","0.005","73.558","0.005","1725.4","0.5","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C38 H49 O8 -","- C38 H40 O8 -","- C76 H80 O16 -","2","1","","Chaomin Li; Emil Lobkovsky; John A. Porco","Total Synthesis of (\±)-Torreyanic Acid","Journal of the American Chemical Society","2000","122","","10484","10485","10.1021/ja005552w","","","0.71073","MoKα","","0.0951","0.0551","","","0.1353","0.1586","","","","","","0.984","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116218","31.008","0.0005","11.92","0.0003","29.791","0.0007","90","","107.994","0.0013","90","","10472.6","0.4","115","","115","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C117 H160 N4 O4 Zr2 -","- C117 H160 N4 O4 Zr2 -","- C468 H640 N16 O16 Zr8 -","4","1","","Edit Y. Tshuva; Israel Goldberg; Moshe Kol","Isospecific Living Polymerization of 1-Hexene by a Readily Available Nonmetallocene C2-Symmetrical Zirconium Catalyst","Journal of the American Chemical Society","2000","122","","10706","10707","10.1021/ja001219g","","","0.7107","MoKα","","0.0852","0.0493","","","0.1157","0.1323","","","","","","1.06","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116219","27.863","0.003","43.569","0.003","29.333","0.002","90","","90","","90","","35609","5","213","2","213","2","","","","","","","","5","C c c a :2","-C 2a 2ac","68","","","","- C209.5 H182 Cl2 N10 Pd2.5 -","- C209.5 H182 Cl2 N10 Pd2.5 -","- C1676 H1456 Cl16 N80 Pd20 -","8","0.5","","Dayong Sun; Fook S. Tham; Christopher A. Reed; Leila Chaker; Michael Burgess; Peter D. W. Boyd","Porphyrin-Fullerene Host-Guest Chemistry","Journal of the American Chemical Society","2000","122","","10704","10705","10.1021/ja002214m","","","0.71073","MoKα","","0.1281","0.0753","","","0.1945","0.2745","","","","","","1.067","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4116220","18.1981","0.0006","17.3589","0.0006","17.8391","0.0006","90","","91.957","0.001","90","","5632.1","0.3","90","2","90","2","","","","","","","","3","C 1 2/m 1","-C 2y","12","Sr~21~Mn~4~Sb~18~","","","- Mn4 Sb18 Sr21 -","- Mn4 Sb18 Sr21 -","- Mn16 Sb72 Sr84 -","4","0.5","","Hyungrak Kim; Cathie L. Condron; Aaron P. Holm; Susan M. Kauzlarich","Synthesis, Structure, and Magnetic Properties of a New Ternary Zintl Phase: Sr21Mn4Sb18","Journal of the American Chemical Society","2000","122","","10720","10721","10.1021/ja002709b","","","0.71073","MoKα","","0.0571","0.033","","","0.0638","0.0703","","","","","","1.026","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116221","9.9851","0.0012","37.016","0.004","8.274","0.002","90","","90","","90","","3058.1","0.9","188","2","188","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C31 H32 F3 N O10 -","- C31 H31 F3 N O10 -","- C124 H124 F12 N4 O40 -","4","1","","Ingrid M. Fellows; David E. Kaelin; Stephen F. Martin","Application of Ring-Closing Metathesis to the Formal Total Synthesis of (+)-FR900482","Journal of the American Chemical Society","2000","122","","10781","10787","10.1021/ja0013879","","","0.71073","MoKα","","0.2322","0.0787","","0.1869","0.1299","","","","1.034","1.261","1.261","","","","","has coordinates,has disorder","178933","2020-10-21","18:00:00",""
"4116222","12.546","0.001","12.662","0.001","12.995","0.001","106.54","0.01","113.17","0.01","96.981","0.008","1754.3","0.3","188","2","188","2","","","","","","","","4","P -1","-P 1","2","","","","- C40 H45 N O7 -","- C40 H45 N O7 -","- C80 H90 N2 O14 -","2","1","","Ingrid M. Fellows; David E. Kaelin; Stephen F. Martin","Application of Ring-Closing Metathesis to the Formal Total Synthesis of (+)-FR900482","Journal of the American Chemical Society","2000","122","","10781","10787","10.1021/ja0013879","","","0.71073","MoKα","","0.0927","0.0512","","0.1133","0.0967","","","","1.09","1.182","1.182","","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116223","10.855","0.0003","11.869","0.0002","17.657","0.0004","95.484","0.0016","90.68","0.0013","93.456","0.0013","2260.01","0.09","123","2","123","2","","","","","","","","7","P -1","-P 1","2","","","","- C46 H44 Cl3 I N2 O10 S -","- C46 H44 Cl3 I N2 O10 S -","- C92 H88 Cl6 I2 N4 O20 S2 -","2","1","","Ingrid M. Fellows; David E. Kaelin; Stephen F. Martin","Application of Ring-Closing Metathesis to the Formal Total Synthesis of (+)-FR900482","Journal of the American Chemical Society","2000","122","","10781","10787","10.1021/ja0013879","","","0.71073","MoKα","","0.0709","0.0448","","","0.1032","0.1139","","","","","","1.056","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116224","13.1029","0.0002","14.0516","0.0002","14.8296","0.0003","79.154","0.001","72.972","0.001","72.128","0.001","2470.16","0.07","123","2","123","2","","","","","","","","7","P -1","-P 1","2","","","","- C47 H45 Cl6 I N2 O10 S -","- C47 H45 Cl6 I N2 O10 S -","- C94 H90 Cl12 I2 N4 O20 S2 -","2","1","","Ingrid M. Fellows; David E. Kaelin; Stephen F. Martin","Application of Ring-Closing Metathesis to the Formal Total Synthesis of (+)-FR900482","Journal of the American Chemical Society","2000","122","","10781","10787","10.1021/ja0013879","","","0.71073","MoKα","","0.0459","0.0336","","","0.0701","0.0738","","","","","","1.035","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116225","11.018","0.004","14.145","0.004","17.79","0.006","110.15","0.02","97.598","0.019","89.51","0.02","2578","1.5","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C47.5 H47.5 Cl4.5 N2 O11 S -","- C47 H47 Cl3 N2 O11 S -","- C94 H94 Cl6 N4 O22 S2 -","2","1","","Ingrid M. Fellows; David E. Kaelin; Stephen F. Martin","Application of Ring-Closing Metathesis to the Formal Total Synthesis of (+)-FR900482","Journal of the American Chemical Society","2000","122","","10781","10787","10.1021/ja0013879","","","0.71073","MoKα","","0.3014","0.1886","","","0.2637","0.2924","","","","","","1.786","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116226","9.534","0.003","10.626","0.002","15.079","0.003","90","","91.75","0.02","90","","1526.9","0.6","296.2","","296.2","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C23 H34 Cd N2 S7 -","- C23 H34 Cd N2 S7 -","- C46 H68 Cd2 N4 S14 -","2","1","","Jie Dai; Guo-Qing Bian; Xin Wang; Qing-Feng Xu; Min-Yan Zhou; Megumu Munakata; Masahiko Maekawa; Ming-Hong Tong; Zhen-Rong Sun; He-Ping Zeng","A New Method to Synthesize Unsymmetrical Dithiolene Metal Complexes of 1,3-Dithiole-2-thione-4,5-dithiolate for Third-Order Nonlinear Optical Applications","Journal of the American Chemical Society","2000","122","","11007","11008","10.1021/ja001976e","","","0.7107","MoKα","","0.0384","0.0292","","","0.0827","0.0879","","","","","","0.968","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116227","10","0.0006","10.5047","0.0006","11.5559","0.0006","68.821","0.001","86.902","0.001","65.525","0.001","1023.65","0.1","213","2","213","2","","","","","","","","4","P -1","-P 1","2","","","","- C23 H28 N2 O2 -","- C23 H28 N2 O2 -","- C46 H56 N4 O4 -","2","1","","P. Andrew Evans; Thara Manangan; Arnold L. Rheingold","Stereoselective Construction of trans-Disubstituted Azabicycles Using Oxauracil as a Novel Free Radical Acceptor","Journal of the American Chemical Society","2000","122","","11009","11010","10.1021/ja0020308","","","0.71073","MoKα","","0.0851","0.0657","","0.2071","0.1897","","","","1.057","1.133","1.133","","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116228","15.2634","0.0006","6.7949","0.0002","9.3479","0.0003","90","","104.269","0.002","90","","939.59","0.06","228","2","228","2","","","","","","","","4","P 1 c 1","P -2yc","7","","","","- C21 H24 N2 O2 -","- C21 H24 N2 O2 -","- C42 H48 N4 O4 -","2","1","","P. Andrew Evans; Thara Manangan; Arnold L. Rheingold","Stereoselective Construction of trans-Disubstituted Azabicycles Using Oxauracil as a Novel Free Radical Acceptor","Journal of the American Chemical Society","2000","122","","11009","11010","10.1021/ja0020308","","","0.71073","MoKα","","0.0611","0.0465","","0.136","0.1107","","","","1.023","1.036","1.036","","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116229","10.5766","0.0001","9.7748","0.0002","19.1768","0.0004","90","","98.416","0.001","90","","1961.23","0.06","213","2","213","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 H26 N2 O2 -","- C22 H26 N2 O2 -","- C88 H104 N8 O8 -","4","1","","P. Andrew Evans; Thara Manangan; Arnold L. Rheingold","Stereoselective Construction of trans-Disubstituted Azabicycles Using Oxauracil as a Novel Free Radical Acceptor","Journal of the American Chemical Society","2000","122","","11009","11010","10.1021/ja0020308","","","0.71073","MoKα","","0.0637","0.0505","","0.1627","0.1526","","","","1.071","1.143","1.143","","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116230","9.532","0.006","24.712","0.008","38.47","0.01","90","","90","","90","","9062","7","296.2","","296.2","","","","","","","","","8","C 2 2 21","C 2c 2","20","","","","- C43 H62 B Cl F4 O2 Ru2 S2 -","- C43 B0.5 Cl F2 O1.5 Ru2 S2 -","- C344 B4 Cl8 F16 O12 Ru16 S16 -","8","1","","Yoshiaki Nishibayashi; Issei Wakiji; Masanobu Hidai","Novel Propargylic Substitution Reactions Catalyzed by Thiolate-Bridged Diruthenium Complexes via Allenylidene Intermediates","Journal of the American Chemical Society","2000","122","","11019","11020","10.1021/ja0021161","","","0.7107","MoKα","","0.0694","0.0694","","","0.0865","0.0865","","","","","","2.428","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116231","11.5194","0.0006","17.1506","0.001","13.0058","0.0007","90","","110.166","0.002","90","","2412","0.2","160","2","160","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C32 H72 K4 Li4 O8 -","- C32 H72 K4 Li4 O8 -","- C64 H144 K8 Li8 O16 -","2","0.5","","David R. Armstrong; William Clegg; Allison M. Drummond; Stephen T. Liddle; Robert E. Mulvey","A Remarkable Isostructural Homologous Series of Mixed Lithium-Heavier Alkali Metaltert-Butoxides [(t-BuO)8Li4M4] (M = Na, K, Rb or Cs)","Journal of the American Chemical Society","2000","122","","11117","11124","10.1021/ja002217z","","","0.71073","MoKα","","0.0441","0.0324","","","0.0853","0.088","","","","","","1.035","","","","has coordinates,has disorder","178933","2020-10-21","18:00:00",""
"4116232","18.998","0.003","12.01","0.003","20.402","0.003","90","","102.899","0.009","90","","4537.6","1.5","160","2","160","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C32 H72 Li4 Na4 O8 -","- C32 H72 Li4 Na4 O8 -","- C128 H288 Li16 Na16 O32 -","4","2","","David R. Armstrong; William Clegg; Allison M. Drummond; Stephen T. Liddle; Robert E. Mulvey","A Remarkable Isostructural Homologous Series of Mixed Lithium-Heavier Alkali Metaltert-Butoxides [(t-BuO)8Li4M4] (M = Na, K, Rb or Cs)","Journal of the American Chemical Society","2000","122","","11117","11124","10.1021/ja002217z","","","0.71073","MoKα","","0.0585","0.0376","","","0.0799","0.0871","","","","","","0.976","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116233","11.705","0.003","17.07","0.005","12.957","0.005","90","0.002","110.347","0.019","90","0.002","2427.3","1.4","160","2","160","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C32 H72 Li4 O8 Rb4 -","- C32 H72 Li4 O8 Rb4 -","- C64 H144 Li8 O16 Rb8 -","2","0.5","","David R. Armstrong; William Clegg; Allison M. Drummond; Stephen T. Liddle; Robert E. Mulvey","A Remarkable Isostructural Homologous Series of Mixed Lithium-Heavier Alkali Metaltert-Butoxides [(t-BuO)8Li4M4] (M = Na, K, Rb or Cs)","Journal of the American Chemical Society","2000","122","","11117","11124","10.1021/ja002217z","","","0.71073","MoKα","","0.0991","0.0437","","","0.0976","0.1088","","","","","","0.904","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116234","12.106","0.003","17.08","0.004","12.913","0.0017","90","","109.541","0.013","90","","2516.2","0.9","160","2","160","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C32 H72 Cs4 Li4 O8 -","- C32 H72 Cs4 Li4 O8 -","- C64 H144 Cs8 Li8 O16 -","2","0.5","","David R. Armstrong; William Clegg; Allison M. Drummond; Stephen T. Liddle; Robert E. Mulvey","A Remarkable Isostructural Homologous Series of Mixed Lithium-Heavier Alkali Metaltert-Butoxides [(t-BuO)8Li4M4] (M = Na, K, Rb or Cs)","Journal of the American Chemical Society","2000","122","","11117","11124","10.1021/ja002217z","","","0.71073","MoKα","","0.0323","0.023","","","0.0595","0.0625","","","","","","1.072","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116235","17.372","0.002","6.8151","0.0007","15.17","0.003","90","","90","","90","","1796","0.5","293","2","293","2","","","","","","","","7","P n n m","-P 2 2n","58","","","","- C11 H12 B N4 O3 Re S2 -","- C14 H12 B N4 O3 Re S2 -","- C56 H48 B4 N16 O12 Re4 S8 -","4","0.5","","Raquel Garcia; António Paulo; Ângela Domingos; Isabel Santos; Kirstin Ortner; Roger Alberto","Re and Tc Complexes Containing B-H...M Agostic Interactions as Building Blocks for the Design of Radiopharmaceuticals","Journal of the American Chemical Society","2000","122","","11240","11241","10.1021/ja002652t","","","0.71073","MoKα","","0.0694","0.0415","","0.101","0.0806","","","","1.15","1.074","1.074","","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116236","7.1363","0.0005","11.5834","0.0009","22.942","0.002","83.739","0.009","82.477","0.009","87.616","0.009","1868.2","0.3","183","2","183","2","","","","","","","","8","P -1","-P 1","2","","","","- C11.5 H12.5 B Cl1.5 N4 O3 S2 Tc -","- C11.4915 H12.4915 B Cl1.4745 N4 O3 S2 Tc -","- C45.966 H49.966 B4 Cl5.898 N16 O12 S8 Tc4 -","4","2","","Raquel Garcia; António Paulo; Ângela Domingos; Isabel Santos; Kirstin Ortner; Roger Alberto","Re and Tc Complexes Containing B-H...M Agostic Interactions as Building Blocks for the Design of Radiopharmaceuticals","Journal of the American Chemical Society","2000","122","","11240","11241","10.1021/ja002652t","","","0.71073","MoKα","","0.0435","0.0375","","0.1043","0.1025","","","","1.08","1.16","1.16","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116237","10.244","0.003","11.045","0.003","11.77","0.002","89.648","0.013","89.426","0.012","65.78","0.02","1214.4","0.6","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C18 H24 B N6 O4 Re S2 -","- C18 H24 B N6 O4 Re S2 -","- C36 H48 B2 N12 O8 Re2 S4 -","2","1","","Raquel Garcia; António Paulo; Ângela Domingos; Isabel Santos; Kirstin Ortner; Roger Alberto","Re and Tc Complexes Containing B-H...M Agostic Interactions as Building Blocks for the Design of Radiopharmaceuticals","Journal of the American Chemical Society","2000","122","","11240","11241","10.1021/ja002652t","","","0.71073","MoKα","","0.1149","0.0677","","0.1769","0.1243","","","","1.074","1.097","1.097","","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116238","13.016","0.003","13.016","0.003","7.356","0.004","90","","90","","90","","1246.2","0.8","293","2","293","2","","","","","","","","6","I -4 2 m","I -4 2","121","","","","- C12 H20 Ga4 N2 O21 P4 -","- C12 H12 Ga4 O21 P4 -","- C24 H24 Ga8 O42 P8 -","2","0.125","","David S. Wragg; Russell E. Morris","Anionic Gallium Phosphate Double Four-Ring Units Containing Occluded Oxygen","Journal of the American Chemical Society","2000","122","","11246","11247","10.1021/ja0055209","","","1.54178","CuKα","","0.079","0.0704","","0.1953","0.1838","","","","1.089","1.111","1.111","","","","","has coordinates","270822","2021-11-23","08:36:10",""
"4116239","11.9318","0.0018","14.041","0.002","17.25","0.003","109.831","0.011","96.22","0.012","102.619","0.011","2600","0.8","130","2","130","2","","","","","","","","5","P -1","-P 1","2","tetracation porphyrin trimer","","","- C122 H94 F12 N12 O10 -","- C122 H86 F12 N12 O10 -","- C122 H86 F12 N12 O10 -","1","0.5","","Roberto Paolesse; Laurent Jaquinod; Fabio Della Sala; Daniel J. Nurco; Luca Prodi; Marco Montalti; Corrado Di Natale; Arnaldo D'Amico; Aldo Di Carlo; Paolo Lugli; Kevin M. Smith","β-Fused Oligoporphyrins: A Novel Approach to a New Type of Extended Aromatic System","Journal of the American Chemical Society","2000","122","","11295","11302","10.1021/ja001316+","","","1.54178","CuKα","","0.1212","0.0814","","","0.2021","0.2361","","","","","","1.026","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116240","9.018","0.002","16.244","0.004","20.737","0.002","90","","90.84","0.01","90","","3037.4","1","286.2","","286.2","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C31 H34 N2 O2 Si W -","- C31 H33 N2 O2 Si W -","- C124 H132 N8 O8 Si4 W4 -","4","1","","Hiroyuki Sakaba; Masanori Tsukamoto; Takeshi Hirata; Chizuko Kabuto; Hiroshi Horino","Synthesis, Structure, and Silylene Exchange Reaction of Base-Stabilized Hydrido(silylene)tungsten Complexes and Rearrangement of Hydrosilyl(pyridine)tungsten Complexes to the Base-Stabilized Hydrido(silylene) Complexes via 1,2-Hydrogen Migration","Journal of the American Chemical Society","2000","122","","11511","11512","10.1021/ja993279w","","","0.7107","MoKα","","0.0422","0.0422","","","0.066","0.066","","","","","","1.553","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116241","34.226","0.009","20.44","0.01","15.638","0.007","90","","90","","90","","10940","8","286.2","","286.2","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C29 H31 N O2 Si W -","- C29 H31 N O2 Si W -","- C464 H496 N16 O32 Si16 W16 -","16","2","","Hiroyuki Sakaba; Masanori Tsukamoto; Takeshi Hirata; Chizuko Kabuto; Hiroshi Horino","Synthesis, Structure, and Silylene Exchange Reaction of Base-Stabilized Hydrido(silylene)tungsten Complexes and Rearrangement of Hydrosilyl(pyridine)tungsten Complexes to the Base-Stabilized Hydrido(silylene) Complexes via 1,2-Hydrogen Migration","Journal of the American Chemical Society","2000","122","","11511","11512","10.1021/ja993279w","","","0.7107","MoKα","","0.0511","0.0511","","","0.0541","0.0541","","","","","","2.492","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116242","11.574","0.003","19.732","0.004","11.853","0.003","90","","106.583","0.001","90","","2594.4","1.1","10","2","10","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C45 H69 Fe3 N3 O13 -","- C45 H69 Fe3 N3 O13 -","- C90 H138 Fe6 N6 O26 -","2","1","","Claire Wilson; Bo B. Iversen; Jacob Overgaard; Finn K. Larsen; Guang Wu; Sergiu P. Palii; Grigore A. Timco; Nicolae V. Gerbeleu","Multi-Temperature Crystallographic Studies of Mixed-Valence Polynuclear Complexes; Valence Trapping Process in the Trinuclear Oxo-Bridged Iron Compound, [Fe3O(O2CC(CH3)3)6(C5H5N)3]","Journal of the American Chemical Society","2000","122","","11370","11379","10.1021/ja994162a","","","0.5608","AgKα","","0.0679","0.0608","","","0.1465","0.1488","","","","","","1.362","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116243","11.573","0.002","19.725","0.004","11.847","0.002","90","","106.469","0.009","90","","2593.4","0.8","35","2","35","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C45 H69 Fe3 N3 O13 -","- C45 H69 Fe3 N3 O13 -","- C90 H138 Fe6 N6 O26 -","2","1","","Claire Wilson; Bo B. Iversen; Jacob Overgaard; Finn K. Larsen; Guang Wu; Sergiu P. Palii; Grigore A. Timco; Nicolae V. Gerbeleu","Multi-Temperature Crystallographic Studies of Mixed-Valence Polynuclear Complexes; Valence Trapping Process in the Trinuclear Oxo-Bridged Iron Compound, [Fe3O(O2CC(CH3)3)6(C5H5N)3]","Journal of the American Chemical Society","2000","122","","11370","11379","10.1021/ja994162a","","","0.71073","MoKα","","0.0474","0.0348","","","0.0735","0.0797","","","","","","1.067","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116244","11.588","0.003","19.709","0.004","11.875","0.003","90","","106.96","0.001","90","","2594.2","1.1","60","2","60","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C45 H69 Fe3 N3 O13 -","- C45 H69 Fe3 N3 O13 -","- C90 H138 Fe6 N6 O26 -","2","1","","Claire Wilson; Bo B. Iversen; Jacob Overgaard; Finn K. Larsen; Guang Wu; Sergiu P. Palii; Grigore A. Timco; Nicolae V. Gerbeleu","Multi-Temperature Crystallographic Studies of Mixed-Valence Polynuclear Complexes; Valence Trapping Process in the Trinuclear Oxo-Bridged Iron Compound, [Fe3O(O2CC(CH3)3)6(C5H5N)3]","Journal of the American Chemical Society","2000","122","","11370","11379","10.1021/ja994162a","","","0.5608","AgKα","","0.0834","0.0685","","","0.1618","0.1695","","","","","","1.218","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116245","11.6025","0.001","19.748","0.002","11.914","0.001","90","","106.826","0.002","90","","2612.9","0.4","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C45 H69 Fe3 N3 O13 -","- C45 H69 Fe3 N3 O13 -","- C90 H138 Fe6 N6 O26 -","2","1","","Claire Wilson; Bo B. Iversen; Jacob Overgaard; Finn K. Larsen; Guang Wu; Sergiu P. Palii; Grigore A. Timco; Nicolae V. Gerbeleu","Multi-Temperature Crystallographic Studies of Mixed-Valence Polynuclear Complexes; Valence Trapping Process in the Trinuclear Oxo-Bridged Iron Compound, [Fe3O(O2CC(CH3)3)6(C5H5N)3]","Journal of the American Chemical Society","2000","122","","11370","11379","10.1021/ja994162a","","","0.71073","MoKα","","0.0459","0.0449","","","0.1063","0.1071","","","","","","1.432","","","","has coordinates,has disorder","178933","2020-10-21","18:00:00",""
"4116246","11.6077","0.001","19.764","0.002","11.9384","0.001","90","","106.69","0.002","90","","2623.5","0.4","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C45 H69 Fe3 N3 O13 -","- C45 H69 Fe3 N3 O13 -","- C90 H138 Fe6 N6 O26 -","2","1","","Claire Wilson; Bo B. Iversen; Jacob Overgaard; Finn K. Larsen; Guang Wu; Sergiu P. Palii; Grigore A. Timco; Nicolae V. Gerbeleu","Multi-Temperature Crystallographic Studies of Mixed-Valence Polynuclear Complexes; Valence Trapping Process in the Trinuclear Oxo-Bridged Iron Compound, [Fe3O(O2CC(CH3)3)6(C5H5N)3]","Journal of the American Chemical Society","2000","122","","11370","11379","10.1021/ja994162a","","","0.71073","MoKα","","0.0448","0.0433","","","0.1168","0.1186","","","","","","1.111","","","","has coordinates,has disorder","178933","2020-10-21","18:00:00",""
"4116247","11.6346","0.001","19.807","0.002","11.8067","0.001","90","","106.903","0.002","90","","2603.3","0.4","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C45 H69 Fe3 N3 O13 -","- C45 H69 Fe3 N3 O13 -","- C90 H138 Fe6 N6 O26 -","2","1","","Claire Wilson; Bo B. Iversen; Jacob Overgaard; Finn K. Larsen; Guang Wu; Sergiu P. Palii; Grigore A. Timco; Nicolae V. Gerbeleu","Multi-Temperature Crystallographic Studies of Mixed-Valence Polynuclear Complexes; Valence Trapping Process in the Trinuclear Oxo-Bridged Iron Compound, [Fe3O(O2CC(CH3)3)6(C5H5N)3]","Journal of the American Chemical Society","2000","122","","11370","11379","10.1021/ja994162a","","","0.71073","MoKα","","0.0703","0.0581","","","0.1316","0.1406","","","","","","1.251","","","","has coordinates,has disorder","178933","2020-10-21","18:00:00",""
"4116248","11.628","0.001","19.843","0.002","11.843","0.001","90","","106.886","0.002","90","","2614.8","0.4","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C45 H69 Fe3 N3 O13 -","- C45 H69 Fe3 N3 O13 -","- C90 H138 Fe6 N6 O26 -","2","1","","Claire Wilson; Bo B. Iversen; Jacob Overgaard; Finn K. Larsen; Guang Wu; Sergiu P. Palii; Grigore A. Timco; Nicolae V. Gerbeleu","Multi-Temperature Crystallographic Studies of Mixed-Valence Polynuclear Complexes; Valence Trapping Process in the Trinuclear Oxo-Bridged Iron Compound, [Fe3O(O2CC(CH3)3)6(C5H5N)3]","Journal of the American Chemical Society","2000","122","","11370","11379","10.1021/ja994162a","","","0.71073","MoKα","","0.0495","0.0475","","","0.1159","0.1179","","","","","","1.327","","","","has coordinates,has disorder","178933","2020-10-21","18:00:00",""
"4116249","11.667","0.001","19.918","0.002","11.981","0.001","90","","106.786","0.002","90","","2665.6","0.4","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C45 H69 Fe3 N3 O13 -","- C45 H69 Fe3 N3 O13 -","- C90 H138 Fe6 N6 O26 -","2","1","","Claire Wilson; Bo B. Iversen; Jacob Overgaard; Finn K. Larsen; Guang Wu; Sergiu P. Palii; Grigore A. Timco; Nicolae V. Gerbeleu","Multi-Temperature Crystallographic Studies of Mixed-Valence Polynuclear Complexes; Valence Trapping Process in the Trinuclear Oxo-Bridged Iron Compound, [Fe3O(O2CC(CH3)3)6(C5H5N)3]","Journal of the American Chemical Society","2000","122","","11370","11379","10.1021/ja994162a","","","0.71073","MoKα","","0.0893","0.0577","","","0.1127","0.123","","","","","","1.154","","","","has coordinates,has disorder","178933","2020-10-21","18:00:00",""
"4116250","11.697","0.001","20.018","0.002","11.978","0.001","90","","106.903","0.002","90","","2683.5","0.4","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C45 H69 Fe3 N3 O13 -","- C45 H69 Fe3 N3 O13 -","- C90 H138 Fe6 N6 O26 -","2","1","","Claire Wilson; Bo B. Iversen; Jacob Overgaard; Finn K. Larsen; Guang Wu; Sergiu P. Palii; Grigore A. Timco; Nicolae V. Gerbeleu","Multi-Temperature Crystallographic Studies of Mixed-Valence Polynuclear Complexes; Valence Trapping Process in the Trinuclear Oxo-Bridged Iron Compound, [Fe3O(O2CC(CH3)3)6(C5H5N)3]","Journal of the American Chemical Society","2000","122","","11370","11379","10.1021/ja994162a","","","0.71073","MoKα","","0.0576","0.052","","","0.1322","0.1391","","","","","","1.153","","","","has coordinates,has disorder","178933","2020-10-21","18:00:00",""
"4116251","11.765","0.001","20.159","0.002","12.014","0.001","90","","106.88","0.002","90","","2726.6","0.4","240","2","240","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C45 H69 Fe3 N3 O13 -","- C45 H69 Fe3 N3 O13 -","- C90 H138 Fe6 N6 O26 -","2","1","","Claire Wilson; Bo B. Iversen; Jacob Overgaard; Finn K. Larsen; Guang Wu; Sergiu P. Palii; Grigore A. Timco; Nicolae V. Gerbeleu","Multi-Temperature Crystallographic Studies of Mixed-Valence Polynuclear Complexes; Valence Trapping Process in the Trinuclear Oxo-Bridged Iron Compound, [Fe3O(O2CC(CH3)3)6(C5H5N)3]","Journal of the American Chemical Society","2000","122","","11370","11379","10.1021/ja994162a","","","0.71073","MoKα","","0.1294","0.0579","","","0.1061","0.1205","","","","","","1.166","","","","has coordinates,has disorder","178933","2020-10-21","18:00:00",""
"4116252","11.824","0.002","20.271","0.004","12.011","0.002","90","","106.983","0.004","90","","2753.3","0.9","295","2","295","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C45 H69 Fe3 N3 O13 -","- C45 H69 Fe3 N3 O13 -","- C90 H138 Fe6 N6 O26 -","2","1","","Claire Wilson; Bo B. Iversen; Jacob Overgaard; Finn K. Larsen; Guang Wu; Sergiu P. Palii; Grigore A. Timco; Nicolae V. Gerbeleu","Multi-Temperature Crystallographic Studies of Mixed-Valence Polynuclear Complexes; Valence Trapping Process in the Trinuclear Oxo-Bridged Iron Compound, [Fe3O(O2CC(CH3)3)6(C5H5N)3]","Journal of the American Chemical Society","2000","122","","11370","11379","10.1021/ja994162a","","","0.71073","MoKα","","0.063","0.0544","","","0.1065","0.1123","","","","","","1.34","","","","has coordinates,has disorder","178933","2020-10-21","18:00:00",""
"4116253","14.07","0.003","15.309","0.003","23.968","0.003","90","","95.21","0.02","90","","5141.3","1.6","219.2","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C53 H77 B Cu N6 S -","- C53 H77 B Cu N6 S -","- C212 H308 B4 Cu4 N24 S4 -","4","1","","David W. Randall; Serena DeBeer George; Britt Hedman; Keith O. Hodgson; Kiyoshi Fujisawa; Edward I. Solomon","Spectroscopic and Electronic Structural Studies of Blue Copper Model Complexes. 1. Perturbation of the Thiolate-Cu Bond","Journal of the American Chemical Society","2000","122","","11620","11631","10.1021/ja001591w","","","0.7107","MoKα","","","0.0483","","","","0.0556","","","","","","1.893","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116254","11.3523","0.0002","17.0133","0.0003","18.3511","0.0002","90","","103.49","0.001","90","","3446.55","0.09","173","2","173","2","","","","","","","Patrick Holland","5","P 1 21/c 1","-P 2ybc","14","99169","A(DIPP)CuSDMP","","- C37 H50 Cu N2 S -","- C37 H50 Cu N2 S -","- C148 H200 Cu4 N8 S4 -","4","1","","David W. Randall; Serena DeBeer George; Patrick L. Holland; Britt Hedman; Keith O. Hodgson; William B. Tolman; Edward I. Solomon","Spectroscopic and Electronic Structural Studies of Blue Copper Model Complexes. 2. Comparison of Three- and Four-Coordinate Cu(II)-Thiolate Complexes and Fungal Laccase","Journal of the American Chemical Society","2000","122","","11632","11648","10.1021/ja001592o","","","0.71073","MoKα","","0.044","0.0295","","0.0774","0.0727","","","","1.033","1.106","1.106","","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116255","13.4053","0.0011","16.3295","0.0013","17.8203","0.0014","72.146","0.002","80.562","0.002","82.677","0.002","3650.4","0.5","213","2","213","2","","","","","","","","9","P -1","-P 1","2","","","","- C80 H80 Cl2 F6 O3 P4 Rh Sb Zr -","- C80 H80 Cl2 F6 O3 P4 Rh Sb Zr -","- C160 H160 Cl4 F12 O6 P8 Rh2 Sb2 Zr2 -","2","1","","T. Keith Hollis; Li-Sheng Wang; Fook Tham","Dynamic Resolution of a Metallocene: Diastereoselective Assembly of an Early-Late Heterobimetallic Metal-Bridgedansa-Metallocene Opening a Route to Parallel Catalyst Synthesis","Journal of the American Chemical Society","2000","122","","11737","11738","10.1021/ja002411l","","","0.71073","MoKα","","0.0956","0.0543","","","0.1343","0.1584","","","","","","1.035","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116256","12.8866","0.0003","15.9008","0.0003","12.1765","0.0003","90","","121.535","0.001","90","","2126.59","0.09","150","2","150","2","","","","","","","","7","C 1 2 1","C 2y","5","","","","- C44 H48 B2 F8 N2 P2 Pt -","- C44 H48 B2 F8 N2 P2 Pt -","- C88 H96 B4 F16 N4 P4 Pt2 -","2","0.5","","Martin Albrecht; Paulo Dani; Martin Lutz; Anthony L. Spek; Gerard van Koten","Transcyclometalation Processes with Late Transition Metals: Caryl-H Bond Activation via Noncovalent C-H...Interactions","Journal of the American Chemical Society","2000","122","","11822","11833","10.1021/ja001808m","","","0.71073","MoKα","","0.0278","0.0278","","","0.0703","0.0703","","","","","","1.042","","","","has coordinates,has disorder","178933","2020-10-21","18:00:00",""
"4116257","11.5811","0.0003","12.4431","0.0003","17.6349","0.0005","70.7122","0.001","84.1765","0.0011","69.4615","0.0013","2245.87","0.1","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C49 H51.33 Cl N2 P2 Pt -","- C48.99 H51.31 Cl N2 P2 Pt -","- C97.98 H102.62 Cl2 N4 P4 Pt2 -","2","1","","Martin Albrecht; Paulo Dani; Martin Lutz; Anthony L. Spek; Gerard van Koten","Transcyclometalation Processes with Late Transition Metals: Caryl-H Bond Activation via Noncovalent C-H...Interactions","Journal of the American Chemical Society","2000","122","","11822","11833","10.1021/ja001808m","","","0.71073","MoKα","","0.0408","0.0351","","","0.1017","0.105","","","","","","1.07","","","","has coordinates,has disorder","178933","2020-10-21","18:00:00",""
"4116258","13.0416","0.0002","15.5605","0.0003","24.1866","0.0005","90","","92.638","0.001","90","","4903.08","0.16","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C112 H118 Cl2 N4 P4 Pt2 -","- C112 H118 Cl2 N4 P4 Pt2 -","- C224 H236 Cl4 N8 P8 Pt4 -","2","0.5","","Martin Albrecht; Paulo Dani; Martin Lutz; Anthony L. Spek; Gerard van Koten","Transcyclometalation Processes with Late Transition Metals: Caryl-H Bond Activation via Noncovalent C-H...Interactions","Journal of the American Chemical Society","2000","122","","11822","11833","10.1021/ja001808m","","","0.71073","MoKα","","0.0362","0.0261","","","0.0551","0.0585","","","","","","1.04","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116259","9.9903","0.0003","9.9903","0.0003","15.3902","0.0006","90","","90","","120","","1330.25","0.08","158","2","158","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C30 H45 Cl U -","- C30 H45 Cl U -","- C60 H90 Cl2 U2 -","2","0.166667","","William J. Evans; Gregory W. Nyce; Matthew A. Johnston; Joseph W. Ziller","How Much Steric Crowding Is Possible in Tris(η5-pentamethylcyclopentadienyl) Complexes? Synthesis and Structure of (C5Me5)3UCl and (C5Me5)3UF1","Journal of the American Chemical Society","2000","122","","12019","12020","10.1021/ja002486p","","","0.71073","MoKα","","0.056","0.05","","","0.1215","0.1247","","","","","","1.398","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116260","9.9804","0.0005","9.9804","0.0005","15.4529","0.0011","90","","90","","120","","1333.02","0.13","153","2","153","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C30 H45 F U -","- C30 H45 F2 U -","- C60 H90 F4 U2 -","2","0.166667","","William J. Evans; Gregory W. Nyce; Matthew A. Johnston; Joseph W. Ziller","How Much Steric Crowding Is Possible in Tris(η5-pentamethylcyclopentadienyl) Complexes? Synthesis and Structure of (C5Me5)3UCl and (C5Me5)3UF1","Journal of the American Chemical Society","2000","122","","12019","12020","10.1021/ja002486p","","","0.71073","MoKα","","0.0609","0.0434","","","0.108","0.127","","","","","","1.18","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116261","12.965","0.001","17.957","0.002","5.619","0.001","90","","90","","90","","1308.2","0.3","296.2","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C13 H20 O4 -","- C13 H20 O4 -","- C52 H80 O16 -","4","1","","Katsumi Ukai; Koichiro Oshima; Seijiro Matsubara","Preparation of Cyclopropanediol: Novel [2 + 1] Cycloaddition Reaction of Bis(iodozincio)methane with 1,2-Diketones","Journal of the American Chemical Society","2000","122","","12047","12048","10.1021/ja003360v","","","0.7107","MoKα","","","0.0544","","","","0.0827","","","","","","1.136","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116262","43.816","0.009","5.922","0.002","38.178","0.008","90","","100.53","0.01","90","","9740","4","293","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C19 H18 O4 -","- C19 H18 O4 -","- C456 H432 O96 -","24","3","","Katsumi Ukai; Koichiro Oshima; Seijiro Matsubara","Preparation of Cyclopropanediol: Novel [2 + 1] Cycloaddition Reaction of Bis(iodozincio)methane with 1,2-Diketones","Journal of the American Chemical Society","2000","122","","12047","12048","10.1021/ja003360v","","","0.7107","MoKα","","","0.1295","","","","0.1383","","","","","","3.278","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116263","13.5885","0.0005","27.5919","0.001","16.7882","0.0008","90","","109.35","0.002","90","","5938.9","0.4","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C71 H78 N8 O6 Zn2 -","- C71 H77 N8 O6 Zn2 -","- C284 H308 N32 O24 Zn8 -","4","1","","James T. Fletcher; Michael J. Therien","Transition-Metal-Mediated [2 + 2 + 2] Cycloaddition Reactions with Ethyne-Containing Porphyrin Templates: New Routes to Cofacial Porphyrin Structures and Facially-Functionalized (Porphinato)metal Species","Journal of the American Chemical Society","2000","122","","12393","12394","10.1021/ja0001557","","","0.71069","MoKα","","0.1364","0.1146","","0.2095","0.1988","","","","1.238","1.299","1.299","","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116264","29.804","0.004","12.3908","0.0018","13.489","0.002","90","","101.289","0.003","90","","4885","1.2","123","2","123","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1,2-diethyl-8,8,9,9,10,10-hexafluoro-4,14-diphenyl-3,15-dithiatetracyclo-[10.3.0.0^2,6^.0^7,11^] pentadeca-4,6(7),11(12),13-tetraene and 1,2-bis(2-ethyl-5-phenyl-3-thienyl)perfluorocyclopentene","","- C29 H22 F6 S2 -","- C29 H22 F6 S2 -","- C232 H176 F48 S16 -","8","1","","Seiya Kobatake; Katsunori Shibata; Kingo Uchida; Masahiro Irie","Photochromism of 1,2-Bis(2-ethyl-5-phenyl-3-thienyl)perfluorocyclopentene in a Single-Crystalline Phase. Conrotatory Thermal Cycloreversion of the Closed-Ring Isomer","Journal of the American Chemical Society","2000","122","","12135","12141","10.1021/ja001996g","","","0.71073","MoKα","","0.0767","0.0459","","","0.1106","0.1277","","","","","","1.017","","","","has coordinates,has disorder","211399","2020-10-21","18:00:00",""
"4116265","22.277","0.003","10.9507","0.0016","10.5694","0.0016","90","","90","","90","","2578.4","0.6","80","2","80","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","1,2-bis(2-ethyl-5-phenyl-3-thienyl)perfluorocyclopentene","","- C29 H22 F6 S2 -","- C29 H22 F6 S2 -","- C116 H88 F24 S8 -","4","0.5","","Seiya Kobatake; Katsunori Shibata; Kingo Uchida; Masahiro Irie","Photochromism of 1,2-Bis(2-ethyl-5-phenyl-3-thienyl)perfluorocyclopentene in a Single-Crystalline Phase. Conrotatory Thermal Cycloreversion of the Closed-Ring Isomer","Journal of the American Chemical Society","2000","122","","12135","12141","10.1021/ja001996g","","","0.71073","MoKα","","0.0658","0.0503","","","0.1204","0.1273","","","","","","1.092","","","","has coordinates,has disorder","178933","2020-10-21","18:00:00",""
"4116266","29.762","0.006","12.427","0.002","13.424","0.003","90","","100.719","0.003","90","","4878.3","1.7","123","2","123","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1,2-diethyl-8,8,9,9,10,10-hexafluoro-4,14-diphenyl-3,15-dithiatetracyclo-[10.3.0.0^2,6^.0^7,11^] pentadeca-4,6(7),11(12),13-tetraene","","- C29 H22 F6 S2 -","- C29 H22 F6 S2 -","- C232 H176 F48 S16 -","8","1","","Seiya Kobatake; Katsunori Shibata; Kingo Uchida; Masahiro Irie","Photochromism of 1,2-Bis(2-ethyl-5-phenyl-3-thienyl)perfluorocyclopentene in a Single-Crystalline Phase. Conrotatory Thermal Cycloreversion of the Closed-Ring Isomer","Journal of the American Chemical Society","2000","122","","12135","12141","10.1021/ja001996g","","","0.71073","MoKα","","0.0679","0.0411","","","0.0951","0.1061","","","","","","0.969","","","","has coordinates","211399","2020-10-21","18:00:00",""
"4116267","11.5316","0.0006","11.5497","0.0005","13.0148","0.0004","74.998","0.003","74.883","0.003","72.182","0.002","1562.62","0.12","150","0.1","150","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C30 H48 Li N2 O5 P2 -","- C30 H48 Li N2 O5 P2 -","- C60 H96 Li2 N4 O10 P4 -","2","1","","Sylvie Choua; Helena Sidorenkova; Théo Berclaz; Michel Geoffroy; Patrick Rosa; Nicolas Mézailles; Louis Ricard; François Mathey; Pascal Le Floch","One-Electron Reduction Product of a Biphosphinine Derivative and of Its Ni(0) Complex: Crystal Structure, EPR/ENDOR, and DFT Investigations on (tmbp).- and [Ni(tmbp)2].-","Journal of the American Chemical Society","2000","122","","12227","12234","10.1021/ja002125+","","","0.71069","MoKα","","0.0557","0.0401","","","0.1156","0.1356","","","","","","1.102","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116268","34.611","0.003","14.3764","0.0014","34.408","0.004","90","","94.085","0.002","90","","17077","3","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","2,3,7,8,11,12,16,17,20,21,25,26,29,30,34,35,38,39,43,44,47,48,52,53,56,57, 61,62,65,66,70,71-dotriacontaethyl-5,14,23,32,41,50,59,68- octaphenyl-[64]hexadecaphyrin-(1.0.1.0.1.0.1.0.1.0.1.0.1.0.1.0)","","- C184 H208 N16 -","- C184 H208 N16 -","- C736 H832 N64 -","4","0.5","","Jun-ichiro Setsune; Satoshi Maeda","Bis(azafulvene) as a Versatile Building Block for Giant Cyclopolypyrroles: X-ray Crystal Structure of [64]Hexadecaphyrin(1.0.1.0.1.0.1.0.1.0.1.0.1.0.1.0)","Journal of the American Chemical Society","2000","122","","12405","12406","10.1021/ja005588o","","","0.71073","MoKα","","0.2453","0.0968","","","0.2442","0.328","","","","","","0.929","","","","has coordinates,has disorder","178933","2020-10-21","18:00:00",""
"4116269","13.3625","0.0007","13.7572","0.0007","14.2004","0.0007","66.538","0.001","74.973","0.001","71.105","0.001","2239.9","0.2","203","","203","","","","","","","","","5","P -1","-P 1","2","","","","- C40 H52 Fe4 N4 O12 -","- C40 H36 Fe4 N4 O12 -","- C80 H72 Fe8 N8 O24 -","2","1","","Hiroki Oshio; Norihisa Hoshino; Tasuku Ito","Superparamagnetic Behavior in an Alkoxo-Bridged Iron(II) Cube","Journal of the American Chemical Society","2000","122","","12602","12603","10.1021/ja002889p","","","0.71073","MoKα","","0.0477","0.0338","","","0.0898","0.0959","","","","","","1.022","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116270","14.451","0.004","13.884","0.001","5.8","0.001","90","","90","","90","","1163.7","0.4","120","","","","","","","","","","","2","P 21 21 21","P 2ac 2ab","19","","benzo[c]phenanthrene","","- C18 H12 -","- C18 H12 -","- C72 H48 -","4","1","","Mahesh K. Lakshman; Panna L. Kole; Surendrakumar Chaturvedi; Joseph H. Saugier; Herman J. C. Yeh; Jenny P. Glusker; H. L. Carrell; Amy K. Katz; Carol E. Afshar; Won-Mohaiza Dashwood; Gary Kenniston; William M. Baird","Methyl Group-Induced Helicity in 1,4-Dimethylbenzo[c]phenanthrene and Its Metabolites: Synthesis, Physical, and Biological Properties","Journal of the American Chemical Society","2000","122","","12629","12636","10.1021/ja002072w","","","","","","0.067","0.048","","0.073","0.072","","0.072","","2.317","2.333","2.333","","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116271","8.812","0.003","8.266","0.002","9.497","0.008","90","","103.47","0.04","90","","672.7","0.6","120","","","","","","","","","","","2","P 1 21 1","P 2yb","4","","1,4-dimethylbenzo[c]phenanthrene","","- C20 H16 -","- C20 H16 -","- C40 H32 -","2","1","","Mahesh K. Lakshman; Panna L. Kole; Surendrakumar Chaturvedi; Joseph H. Saugier; Herman J. C. Yeh; Jenny P. Glusker; H. L. Carrell; Amy K. Katz; Carol E. Afshar; Won-Mohaiza Dashwood; Gary Kenniston; William M. Baird","Methyl Group-Induced Helicity in 1,4-Dimethylbenzo[c]phenanthrene and Its Metabolites: Synthesis, Physical, and Biological Properties","Journal of the American Chemical Society","2000","122","","12629","12636","10.1021/ja002072w","","","","","","0.066","0.06","","0.127","0.126","","0.094","","2.556","2.577","2.577","","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116272","10.9593","0.0002","21.115","0.0004","12.7534","0.0001","90","","99.296","0.001","90","","2912.45","0.08","188","2","188","2","","","","","","","","8","P 1 21 1","P 2yb","4","[Fe2(BPEAN)(OH)(OTf)](OTf)2 compound 1","","","- C44 H47 Cl6 F9 Fe2 N8 O10 S3 -","- C44 H40 Cl6 F9 Fe2 N8 O10 S3 -","- C88 H80 Cl12 F18 Fe4 N16 O20 S6 -","2","1","","Chuan He; Amy M. Barrios; Dongwhan Lee; Jane Kuzelka; Roman M. Davydov; Stephen J. Lippard","Diiron Complexes of 1,8-Naphthyridine-Based Dinucleating Ligands as Models for Hemerythrin","Journal of the American Chemical Society","2000","122","","12683","12690","10.1021/ja0026861","","","0.71073","MoKα","","0.0633","0.0468","","","0.1162","0.1243","","","","","","0.876","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116273","17.432","0.002","12.878","0.001","7.5758","0.0009","90","","109.715","0.008","90","","1601","0.3","173.2","","173.2","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C18 B F13 -","- C17 B0.5 F12.5 -","- C68 B2 F50 -","4","0.5","","Preston A. Chase; Warren E. Piers; Brian O. Patrick","New Fluorinated 9-Borafluorene Lewis Acids","Journal of the American Chemical Society","2000","122","","12911","12912","10.1021/ja005607u","","","0.7107","MoKα","","0.0724","0.042","","0.1208","","0.057","","","1.688","","","1.688","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116274","25.241","0.003","10.755","0.002","24.913","0.002","90","","112.302","0.003","90","","6257.2","1.5","173.2","","173.2","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C35.5 H31 B F8 Zr -","- C35.125 H30.875 B F8 Zr -","- C281 H247 B8 F64 Zr8 -","8","1","","Preston A. Chase; Warren E. Piers; Brian O. Patrick","New Fluorinated 9-Borafluorene Lewis Acids","Journal of the American Chemical Society","2000","122","","12911","12912","10.1021/ja005607u","","","0.7107","MoKα","","0.0685","0.039","","0.1109","","0.051","","","1.823","","","1.823","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4123919","6.8925","","7.8573","","10.1656","","90","","91.487","","90","","550.347","","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","K (Sb P2 Se6)","","- K P2 Sb Se6 -","- K P2 Sb Se6 -","- K2 P4 Sb2 Se12 -","2","1","","Breshears, J.D.; Kanatzidis, M.G.","beta-(K M P2 Se6) (M = Sb, Bi): kinetically accessible phases obtained from rapid crystallisation of amorphous precursors","Journal of the American Chemical Society","2000","122","","7839","7840","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4123920","6.9183","","7.663","","10.239","","90","","91.508","","90","","542.632","","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","K (Bi P2 Se6)","","- Bi K P2 Se6 -","- Bi K P2 Se6 -","- Bi2 K2 P4 Se12 -","2","1","","Breshears, J.D.; Kanatzidis, M.G.","beta-(K M P2 Se6) (M = Sb, Bi): kinetically accessible phases obtained from rapid crystallisation of amorphous precursors","Journal of the American Chemical Society","2000","122","","7839","7840","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4123921","14.88","","10.09","","10.93","","90","","96.16","","90","","1631.55","","","","","","","","","","","","","2","P 1 2 1","P 2y","3","","Sm3 C70","","- C70 Sm3 -","- C70 Sm3 -","- C140 Sm6 -","2","1","","Chen, X.H.; Chi, D.H.; Liu, Z.S.; Takenobu, T.; Sun, Z.; Iwasa, Y.","Synthesis, structure, and transport properties of novel fullerides A3 C70 (A = Ba and Sm)","Journal of the American Chemical Society","2000","122","","5729","5732","","","","","","","","","","","","","","","","","","","","","","has coordinates","140525","2020-10-21","18:00:00",""
"4123922","7.556","","7.556","","27.257","","90","","90","","90","","1556.19","","","","","","","","","","","","","4","I 4/m","-I 4","87","","(Mg (N H3)6) Hg22","","- H18 Hg22 Mg N6 -","- Hg22 Mg N6 -","- Hg44 Mg2 N12 -","2","0.125","","Hwang, I.-C.; Drews, T.; Seppelt, K.","Mg (N H3)6 Hg22, a mercury intercalation compound","Journal of the American Chemical Society","2000","122","","8486","8489","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4123923","10.1899","","10.1899","","10.1899","","90","","90","","90","","1058.06","","","","","","","","","","","","","4","F m -3 m","-F 4 2 3","225","","(Mg (N H3)6) Cl2","","- Cl2 H18 Mg N6 -","- Cl2 H18 Mg N6 -","- Cl8 H72 Mg4 N24 -","4","0.0208333","","Hwang, I.-C.; Drews, T.; Seppelt, K.","Mg (N H3)6 Hg22, a mercury intercalation compound","Journal of the American Chemical Society","2000","122","","8486","8489","","","","","","","","","","","","","","","","","","","","","","has coordinates","189075","2020-10-21","18:00:00",""
"4123929","11.208","","17.286","","23.536","","90","","90","","90","","4559.9","","","","","","","","","","","","","5","I 2 2 2","I 2 2","23","","Cs14 Li22.72 (Li18.4 Si72 O172) (D2 O)6.16","","- Cs14 D12.32 Li41.12 O178.16 Si72 -","- Cs13.996 Li41.12 O178.164 Si72 -","- Cs13.996 Li41.12 O178.164 Si72 -","1","0.125","","Park, S.-H.; Grey, C.P.; Parise, J.B.; Gies, H.; Liu, H.-M.; Toby, B.H.","A new porous lithosilicate with a high ionic conductivity and ion-exchange capacity","Journal of the American Chemical Society","2000","122","","11023","11024","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4123930","9.3357","","9.3357","","9.3357","","93.482","","93.482","","93.482","","808.958","","","","","","","","","","","","","4","R -3 m :R","-P 3* 2","166","","Li3.53 (Al3.53 Si8.47 O24)","","- Al3.53 Li3.53 O24 Si8.47 -","- Al3.528 Li3.536 O24 Si8.472 -","- Al3.528 Li3.536 O24 Si8.472 -","1","0.0833333","","Smith, L.J.; Eckert, H.; Cheetham, A.K.","Site preferences in the mixed cation zeolite, Li, Na-chabazite: a combined solid-state NMR and neutron diffraction study","Journal of the American Chemical Society","2000","122","","1700","1708","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4123931","9.3385","","9.3385","","9.3385","","93.482","","93.482","","93.482","","809.686","","","","","","","","","","","","","5","R -3 m :R","-P 3* 2","166","","(Li2.05 Na1.61) (Al3.53 Si8.47 O24)","","- Al3.53 Li2.05 Na1.61 O24 Si8.47 -","- Al3.528 Li2.054 Na1.608 O24 Si8.472 -","- Al3.528 Li2.054 Na1.608 O24 Si8.472 -","1","0.0833333","","Smith, L.J.; Eckert, H.; Cheetham, A.K.","Site preferences in the mixed cation zeolite, Li, Na-chabazite: a combined solid-state NMR and neutron diffraction study","Journal of the American Chemical Society","2000","122","","1700","1708","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4123932","28.24919","","15.7094","","24.424","","90","","102.337","","90","","10588.5","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","(Al O4 Al12 (O H)12 (H2 O)24) (Al (O H)6 Mo6 O18)2 (O H) (H2 O)29.7","","- Al15 H132.4 Mo12 O118.7 -","- Al15 Mo12 O118.704 -","- Al60 Mo48 O474.816 -","4","0.5","","Son, J.-H.; Kwon, Y.-U.; Choi, H.","Porous crystal formation from polyoxometalate building blocks: single-crystal structure of (Al O4 Al12 (O H)12 (H2 O)24) (Al (O H)6 No6 O18)2 (O H) . 29.5(H2 O)","Journal of the American Chemical Society","2000","122","","7432","7433","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124800","24.797","","8.594","","6.6891","","90","","90","","90","","1425.48","","","","","","","","","","","","","3","C m c m","-C 2c 2","63","","Zr4.3 Ti2.7 Sb7","","- Sb7 Ti2.7 Zr4.3 -","- Sb7 Ti2.68 Zr4.32 -","- Sb28 Ti10.72 Zr17.28 -","4","0.25","","Kleinke, H.","Zr1-x Tix Sb: A novel antimonide on the quasibinary section Zr Sb - Ti Sb with a complex crystal structure exhibiting linear Sb chains and fragments of the Ti Sb structure","Journal of the American Chemical Society","2000","122","","853","860","","","","","","","","","","","","","","","","","","","","","","has coordinates","173392","2020-10-21","18:00:00",""
"4300000","8.484","0.002","10.91","0.002","16.026","0.003","105.17","0.03","99.62","0.03","100.51","0.03","1371.1","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Bis[bis(bipyridine)ruthenium(II)]1,2,4,5-Tetramino 3,6-Diketocyclohexane","","- C46 H42 Cl4 N12 O21 Ru2 -","- C46 H36 Cl4 N12 O22 Ru2 -","- C46 H36 Cl4 N12 O22 Ru2 -","1","0.5","","Hitoshi Masui; Assunta L. Freda; Michael C. Zerner; A. B. P. Lever","Binuclear 1,2,4,5-Tetraimino-3,6-diketocyclohexane Bis[bis(Bipyridine)ruthenium(II)] Redox Series","Inorganic Chemistry","2000","39","","141","152","10.1021/ic980826q","","","0.71073","MoKα","","0.0656","0.0496","","0.1389","0.1264","","","","1.073","1.105","1.105","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300001","9.4405","0.0001","13.3617","0.0001","16.71","0.0002","90","","90","","90","","2107.82","0.04","180","2","180","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C21 H30 Cl N5 O -","- C21 H32 Cl N5 O -","- C84 H128 Cl4 N20 O4 -","4","1","","Simon Collinson; Nathaniel W. Alcock; Ahasuya Raghunathan; Pawan K. Kahol; Daryle H. Busch","Synthesis and Properties of Iron(II) and Manganese(II) Complexes Derived from a Topologically Constrained Pentadentate Ligand","Inorganic Chemistry","2000","39","","757","764","10.1021/ic981410f","","","0.71073","MoKα","","0.0479","0.0374","","0.0832","0.0778","","","","1.085","1.084","1.084","","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4300002","7.745","0.002","22.786","0.004","14.639","0.004","90","","105.074","0.01","90","","2494.6","1","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C21 H29 Cl F6 Mn N5 P -","- C21 H29 Cl F6 Mn N5 P -","- C84 H116 Cl4 F24 Mn4 N20 P4 -","4","1","","Simon Collinson; Nathaniel W. Alcock; Ahasuya Raghunathan; Pawan K. Kahol; Daryle H. Busch","Synthesis and Properties of Iron(II) and Manganese(II) Complexes Derived from a Topologically Constrained Pentadentate Ligand","Inorganic Chemistry","2000","39","","757","764","10.1021/ic981410f","","","0.71073","MoKα","","0.0844","0.0616","","0.1515","0.1337","","","","1.072","1.09","1.09","","","","","has coordinates","132026","2020-10-21","18:00:00",""
"4300003","7.959","0.007","12.3","0.01","21.72","0.02","90","","90","","90","","2126","3","173.2","","173.2","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C18 H25 Cl2 Mn N5 O4 -","- C18 H25 Cl2 Mn N5 O4 -","- C72 H100 Cl8 Mn4 N20 O16 -","4","1","","Suzanne J. Brudenell; Leone Spiccia; Alan M. Bond; Gary D. Fallon; David C. R. Hockless; George Lazarev; Peter J. Mahon; Edward R. T. Tiekink","Structural, Spectroscopic, and Electrochemical Studies of Binuclear Manganese(II) Complexes of Bis(pentadentate) Ligands Derived from Bis(1,4,7-triazacyclononane) Macrocycles","Inorganic Chemistry","2000","39","","881","892","10.1021/ic9814470","","","0.7107","MoKalpha","","","0.0354","","","0.0304","","","","","2.207","2.207","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300004","11.455","0.004","15.037","0.006","15.887","0.004","90","","96.48","0.02","90","","2719","1.6","293","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H33 Cl2 Mn N6 O5 -","- C22 H33 Cl2 Mn N6 O8 -","- C88 H132 Cl8 Mn4 N24 O32 -","4","1","","Suzanne J. Brudenell; Leone Spiccia; Alan M. Bond; Gary D. Fallon; David C. R. Hockless; George Lazarev; Peter J. Mahon; Edward R. T. Tiekink","Structural, Spectroscopic, and Electrochemical Studies of Binuclear Manganese(II) Complexes of Bis(pentadentate) Ligands Derived from Bis(1,4,7-triazacyclononane) Macrocycles","Inorganic Chemistry","2000","39","","881","892","10.1021/ic9814470","","","0.7107","MoKalpha","","","0.092","","","0.108","","","","","4.17","4.17","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300005","13.334","0.002","19.926","0.002","18.799","0.001","90","","104.328","0.008","90","","4839.4","0.9","183.2","","183.2","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C39 H60 Cl4 Mn2 N10 O11 -","- C39 H58 Cl4 Mn2 N10 O11 -","- C156 H232 Cl16 Mn8 N40 O44 -","4","1","","Suzanne J. Brudenell; Leone Spiccia; Alan M. Bond; Gary D. Fallon; David C. R. Hockless; George Lazarev; Peter J. Mahon; Edward R. T. Tiekink","Structural, Spectroscopic, and Electrochemical Studies of Binuclear Manganese(II) Complexes of Bis(pentadentate) Ligands Derived from Bis(1,4,7-triazacyclononane) Macrocycles","Inorganic Chemistry","2000","39","","881","892","10.1021/ic9814470","","","1.5418","CuKα","","0.1574","0.0531","","0.0712","0.0605","","","","1.615","2.057","2.057","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300006","13.361","0.003","16.807","0.005","14.339","0.004","90","","111.14","0.02","90","","3003.2","1.5","180","","180","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C23 H38 Cl2 Mn N6 O6.5 -","- C23 H35 Cl2 Mn N6 O7 -","- C92 H140 Cl8 Mn4 N24 O28 -","4","1","","Suzanne J. Brudenell; Leone Spiccia; Alan M. Bond; Gary D. Fallon; David C. R. Hockless; George Lazarev; Peter J. Mahon; Edward R. T. Tiekink","Structural, Spectroscopic, and Electrochemical Studies of Binuclear Manganese(II) Complexes of Bis(pentadentate) Ligands Derived from Bis(1,4,7-triazacyclononane) Macrocycles","Inorganic Chemistry","2000","39","","881","892","10.1021/ic9814470","","","0.7107","MoKalpha","","","0.0716","","","0.0698","","","","","2.7","2.7","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300007","9.239","0.002","16.786","0.003","15.739","0.003","90","","93.25","0.03","90","","2437","0.8","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","closo-1,7-P2B10Cl10.toluene","2,3,4,5,6,8,9,10,11,12-Decachloro-1,7-diphospha-closo-dodecaborane(10)-toluene","","- C7 H8 B10 Cl10 P2 -","- C7 H8 B10 Cl10 P2 -","- C28 H32 B40 Cl40 P8 -","4","1","","Willi Keller; Gisela Sawitzki; Wolfgang Haubold","Synthesis of Halogenated Polyhedral Phosphaboranes. Crystal Structure of closo-1,7-P2B10Cl10","Inorganic Chemistry","2000","39","","1282","1287","10.1021/ic990112v","","","0.71073","MoKα","","0.1276","0.0669","","0.1812","0.1441","","","","1.088","1.149","1.149","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300008","12.4004","0.0007","15.4068","0.0009","15.4512","0.0009","90","","90","","90","","2952","0.3","153","2","153","2","","","","","","","","6","P n m a","-P 2ac 2n","62","1,3-bis(diphenylphosphino)propane maleneonitrilediselenolate nickel(ii)","1,3-bis(diphenylphosphino)propane cis-1,2-dicyano,1,2-diselenato-ethene-Se-Se-nickel(ii)","","- C31 H26 N2 Ni P2 Se2 -","- C31 H26 N2 Ni P2 Se2 -","- C124 H104 N8 Ni4 P8 Se8 -","4","0.5","","Craig C. McLauchlan; James A. Ibers","Facile Syntheses and Structures of New Metal-Maleonitrilediselenolates [K([2.2.2]-cryptand)]3[Ag(Se2C2(CN)2)(Se6)], [K([2.2.2]-cryptand)]2[Ni(Se2C2(CN)2)2], and Ni(dppp)(Se2C2(CN)2)","Inorganic Chemistry","2000","39","","1046","1048","10.1021/ic9901719","","","0.71073","MoKα","","0.039","0.0263","","","0.0593","0.0614","","","","","","1.099","","","","has coordinates","171491","2020-10-21","18:00:00",""
"4300009","12.2196","0.0011","15.8602","0.0015","15.3055","0.0014","90","","107.644","0.002","90","","2826.7","0.5","153","2","153","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","bis(potassium-[2.2.2]-cryptand) bis(maleonitrilediselenolate)nickelate(ii)","bis(potassium-4,7,13,16,21,24-hexaoxa-1,10-diazobicyclo[8.8.8]hexacosane) bis(cis-1,2-dicyano,1,2-diselenato-ethene-Se-Se')nickelate(ii)","","- C44 H72 K2 N8 Ni O12 Se4 -","- C44 H72 K2 N8 Ni O12 Se4 -","- C88 H144 K4 N16 Ni2 O24 Se8 -","2","0.5","","Craig C. McLauchlan; James A. Ibers","Facile Syntheses and Structures of New Metal-Maleonitrilediselenolates [K([2.2.2]-cryptand)]3[Ag(Se2C2(CN)2)(Se6)], [K([2.2.2]-cryptand)]2[Ni(Se2C2(CN)2)2], and Ni(dppp)(Se2C2(CN)2)","Inorganic Chemistry","2000","39","","1046","1048","10.1021/ic9901719","","","0.71073","MoKα","","0.0791","0.0405","","","0.0814","0.0873","","","","","","0.97","","","","has coordinates","179038","2020-10-21","18:00:00",""
"4300010","15.537","0.008","36.151","0.016","19.407","0.005","90","","91.14","","90","","10898","8","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C76.5 H0 N8 O24 P4 Ru9 -","- C76.5 N8 O24 P4 Ru9 -","- C306 N32 O96 P16 Ru36 -","4","1","","Weibin Wang; Paul J. Low; Arthur J. Carty; Enrico Sappa; Giuliana Gervasio; Carlo Mealli; Andrea Ienco; Enrique Perez-Carreño","Synthesis and Structure of the Cluster Ion Pair {Ru3(CO)9[μ-P(NPri2)2]3}{Ru6(CO)15(μ6-C)[μ-P(NPri2)2]}. A Theoretical Overview of M3(μ-PR2)3 Frameworks","Inorganic Chemistry","2000","39","","998","1005","10.1021/ic990195f","","","0.71073","MoKα","","0.1175","0.0689","","0.2802","0.1923","","","","1.098","1.103","1.103","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300011","9.974","0.0002","15.2622","0.0003","17.9482","0.0004","90","","90.8125","0.0008","90","","2731.89","0.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H36 N Ni S7 -","- C20 H36 N Ni S7 -","- C80 H144 N4 Ni4 S28 -","4","1","","Jun-Feng Bai; Jing-Lin Zuo; Zhen Shen; Xiao-Zeng You; Hoong-Kun Fun; Kandasamy Chinnakali","A Convenient Route To Synthesize the Fully Conjugated Bimetallic Complex (Bu4N)2{tto[Ni(dmit)2]} (tto = Tetrathiooxalate, C2S42-, and dmit = 1,3-dithiole-2-thione-4,5-dithiolate, C3S52-) and the Crystal Structure of a New Crystal Form","Inorganic Chemistry","2000","39","","1322","1324","10.1021/ic9902875","","","0.71073","MoKα","","0.129","0.052","","","0.097","0.117","","","","","","0.885","","","","has coordinates","120081","2020-10-21","18:00:00",""
"4300012","24.413","0.003","24.413","0.003","24.413","0.003","90","","90","","90","","14550","3","296.2","","296.2","","","","","","","","","8","I 2 3","I 2 2 3","197","","","","- C63 H60 Br Cu3 F12 N9 O3 P2 -","- C62.94 H54 Br0.33 Cu3 F12.06 N9 O3 P2.01 -","- C503.52 H432 Br2.64 Cu24 F96.48 N72 O24 P16.08 -","8","0.333333","","Masahito Kodera; Yoshimitsu Tachi; Toshio Kita; Hiromu Kobushi; Yoshinori Sumi; Koji Kano; Motoo Shiro; Masayuki Koikawa; Tadashi Tokii; Masaaki Ohba; Hisashi Okawa","A Cu(II)-Mediated C-H Oxygenation of Sterically Hindered Tripyridine Ligands To Form Triangular Cu(II)3 Complexes","Inorganic Chemistry","2000","39","","226","234","10.1021/ic990331g","","","1.5418","CuKα","","","0.068","","","0.0982","","","","","1.275","1.275","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300013","24.433","0.003","24.4328","","24.4328","","90","","90","","90","","14585.6","1.8","293.2","","293.2","","","","","","","","","8","I 2 3","I 2 2 3","197","","","","- C63 H60 Cl Cu3 F12 N9 O3 P2 -","- C62.01 H54 Cl0.33 Cu3 F11.2 N9 O3 P0.92 -","- C496.08 H432 Cl2.64 Cu24 F89.6 N72 O24 P7.36 -","8","0.333333","","Masahito Kodera; Yoshimitsu Tachi; Toshio Kita; Hiromu Kobushi; Yoshinori Sumi; Koji Kano; Motoo Shiro; Masayuki Koikawa; Tadashi Tokii; Masaaki Ohba; Hisashi Okawa","A Cu(II)-Mediated C-H Oxygenation of Sterically Hindered Tripyridine Ligands To Form Triangular Cu(II)3 Complexes","Inorganic Chemistry","2000","39","","226","234","10.1021/ic990331g","","","0.7107","MoKα","","","0.076","","","0.0902","","","","","1.398","1.398","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300014","14.26","0.002","14.2602","","17.693","0.003","90","","90","","120","","3115.9","0.7","293.2","","293.2","","","","","","","","","8","P 63","P 6c","173","","","","- C54 H48 Br Cu3 F12 N9 O3 P2 -","- C54 H48 Br0.33 Cu3 F12 N9 O3 P0.66 -","- C108 H96 Br0.66 Cu6 F24 N18 O6 P1.32 -","2","0.333333","","Masahito Kodera; Yoshimitsu Tachi; Toshio Kita; Hiromu Kobushi; Yoshinori Sumi; Koji Kano; Motoo Shiro; Masayuki Koikawa; Tadashi Tokii; Masaaki Ohba; Hisashi Okawa","A Cu(II)-Mediated C-H Oxygenation of Sterically Hindered Tripyridine Ligands To Form Triangular Cu(II)3 Complexes","Inorganic Chemistry","2000","39","","226","234","10.1021/ic990331g","","","0.7107","MoKα","","","0.0693","","","0.0876","","","","","3.543","3.543","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300015","24.177","0.003","24.1765","","24.1765","","90","","90","","90","","14131.5","1.8","293.2","","293.2","","","","","","","","","8","I 2 3","I 2 2 3","197","","","","- C60 H54 Cl Cu3 F12 N9 O3 P2 -","- C59.01 H48 Cl0.33 Cu3 F10.65 N9 O3 P0.92 -","- C472.08 H384 Cl2.64 Cu24 F85.2 N72 O24 P7.36 -","8","0.333333","","Masahito Kodera; Yoshimitsu Tachi; Toshio Kita; Hiromu Kobushi; Yoshinori Sumi; Koji Kano; Motoo Shiro; Masayuki Koikawa; Tadashi Tokii; Masaaki Ohba; Hisashi Okawa","A Cu(II)-Mediated C-H Oxygenation of Sterically Hindered Tripyridine Ligands To Form Triangular Cu(II)3 Complexes","Inorganic Chemistry","2000","39","","226","234","10.1021/ic990331g","","","0.7107","MoKα","","","0.0716","","","0.085","","","","","2.12","2.12","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300016","8.515","0.003","14.598","0.005","8.252","0.003","94.83","0.03","107.65","0.03","96.89","0.03","962.5","0.6","293.2","","293.2","","","","","","","","","5","P -1","-P 1","2","","","","- C19 H19 Br2 Cu N3 -","- C19 H19 Br2 Cu N3 -","- C38 H38 Br4 Cu2 N6 -","2","1","","Masahito Kodera; Yoshimitsu Tachi; Toshio Kita; Hiromu Kobushi; Yoshinori Sumi; Koji Kano; Motoo Shiro; Masayuki Koikawa; Tadashi Tokii; Masaaki Ohba; Hisashi Okawa","A Cu(II)-Mediated C-H Oxygenation of Sterically Hindered Tripyridine Ligands To Form Triangular Cu(II)3 Complexes","Inorganic Chemistry","2000","39","","226","234","10.1021/ic990331g","","","0.7107","MoKα","","0","0","","","0","0.0488","","","","","","1.06","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300017","7.9903","0.0012","9.3545","0.0009","10.754","0.002","113.485","0.011","101.399","0.013","101.897","0.012","685.4","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H12 Cu N8 -","- C12 H12 Cu N8 -","- C24 H24 Cu2 N16 -","2","1","","Hao-Yu Shen; Wei-Ming Bu; En-Qing Gao; Dai-Zheng Liao; Zong-Hui Jiang; Shi-Ping Yan; Geng-Lin Wang","New Alternating Ferro- and Antiferromagnetic One-Dimensional Complexes. Synthesis, Characterization, Crystal Structure, and Magnetic Properties of [M(4,4'-dimethylbipyridine)(N3)2]n [M = Cu(II), Mn(II), Ni(II), Fe(II)]","Inorganic Chemistry","2000","39","","396","400","10.1021/ic990338y","","","0.71073","MoKα","","0.0568","0.0434","","0.1297","0.1129","","","","1.034","1.076","1.076","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300018","9.3","0.002","10.483","0.002","11.05","0.002","68.21","0.03","75.47","0.03","73.83","0.03","947.5","0.4","163","2","163","2","","","","","","","","5","P -1","-P 1","2","","","","- C10 H21 N8 O9.5 Pt -","- C10 H18 N8 O9.5 Pt -","- C20 H36 N16 O19 Pt2 -","2","1","","Jorge A. R. Navarro; Eva Freisinger; Bernhard Lippert","From Simple trans-[a2Pt(2-hydroxypyrimidine)2]2+ (a = NH3, CH3NH2) Complexes to Structures of Higher Complexity. Molecular Recognition of 2-Aminopyrimidine by Hydrogen Bond Formation and Reactivity toward Additional Metal Ions","Inorganic Chemistry","2000","39","","1059","1065","10.1021/ic9903634","","","0.71069","MoKα","","0.0308","0.0253","","0.0948","0.0623","","","","1.059","1.085","1.085","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300019","5.692","0.001","7.758","0.002","11.236","0.002","93.12","0.03","92.86","0.03","102.58","0.03","482.56","0.18","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C5 H9 Cl N3 O5 Pt0.5 -","- C5 H9 Cl N3 O5 Pt0.5 -","- C10 H18 Cl2 N6 O10 Pt -","2","1","","Jorge A. R. Navarro; Eva Freisinger; Bernhard Lippert","From Simple trans-[a2Pt(2-hydroxypyrimidine)2]2+ (a = NH3, CH3NH2) Complexes to Structures of Higher Complexity. Molecular Recognition of 2-Aminopyrimidine by Hydrogen Bond Formation and Reactivity toward Additional Metal Ions","Inorganic Chemistry","2000","39","","1059","1065","10.1021/ic9903634","","","0.71069","MoKα","","0.0495","0.048","","0.1228","0.1189","","","","1.094","1.094","1.094","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4300020","8.355","0.002","11.221","0.002","13.004","0.003","86.76","0.03","78.62","0.03","77.96","0.03","1168.7","0.5","163","2","163","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H23 Cl2 N9 O10 Pt -","- C14 H23 Cl2 N9 O10 Pt -","- C28 H46 Cl4 N18 O20 Pt2 -","2","1","","Jorge A. R. Navarro; Eva Freisinger; Bernhard Lippert","From Simple trans-[a2Pt(2-hydroxypyrimidine)2]2+ (a = NH3, CH3NH2) Complexes to Structures of Higher Complexity. Molecular Recognition of 2-Aminopyrimidine by Hydrogen Bond Formation and Reactivity toward Additional Metal Ions","Inorganic Chemistry","2000","39","","1059","1065","10.1021/ic9903634","","","0.71069","MoKα","","0.0395","0.0328","","0.0943","0.08","","","","1.013","1.065","1.065","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300021","5.345","0.001","23.998","0.005","12.474","0.002","90","","102.27","0.03","90","","1563.5","0.5","163","2","163","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C4 H7 Ag0.5 N3.5 O3 Pt0.5 -","- C4 H6 Ag0.5 N3.5 O3 Pt0.5 -","- C32 H48 Ag4 N28 O24 Pt4 -","8","1","","Jorge A. R. Navarro; Eva Freisinger; Bernhard Lippert","From Simple trans-[a2Pt(2-hydroxypyrimidine)2]2+ (a = NH3, CH3NH2) Complexes to Structures of Higher Complexity. Molecular Recognition of 2-Aminopyrimidine by Hydrogen Bond Formation and Reactivity toward Additional Metal Ions","Inorganic Chemistry","2000","39","","1059","1065","10.1021/ic9903634","","","0.71069","MoKα","","0.0549","0.041","","0.1219","0.093","","","","1.019","1.103","1.103","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300022","19.6385","0.0012","16.3298","0.001","19.3328","0.0012","90","","118.908","0.001","90","","5427.4","0.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H41 B N6 P Rh -","- C23 H41 B N6 P Rh -","- C184 H328 B8 N48 P8 Rh8 -","8","2","","M. Carmen Nicasio; Margarita Paneque; Pedro J. Pérez; Antonio Pizarro; Manuel L. Poveda; Luis Rey; Sabine Sirol; Soraya Taboada; Marianela Trujillo; Angeles Monge; Caridad Ruiz; Ernesto Carmona","Substitution and Hydrogenation Reactions on Rhodium(I)-Ethylene Complexes of the Hydrotris(pyrazolyl)borate Ligands Tp' (Tp' = Tp, TpMe2)","Inorganic Chemistry","2000","39","","180","188","10.1021/ic990419u","","","0.71073","MoKα","","0.1311","0.0586","","0.1366","0.1151","","","","0.898","1.071","1.071","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300023","17.532","0.002","11.1955","0.0011","13.7896","0.0013","90","","109.323","0.002","90","","2554.1","0.5","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C21 H36 B N6 O2 P Rh -","- C21 H37 B N6 O2 P Rh -","- C84 H148 B4 N24 O8 P4 Rh4 -","4","1","","M. Carmen Nicasio; Margarita Paneque; Pedro J. Pérez; Antonio Pizarro; Manuel L. Poveda; Luis Rey; Sabine Sirol; Soraya Taboada; Marianela Trujillo; Angeles Monge; Caridad Ruiz; Ernesto Carmona","Substitution and Hydrogenation Reactions on Rhodium(I)-Ethylene Complexes of the Hydrotris(pyrazolyl)borate Ligands Tp' (Tp' = Tp, TpMe2)","Inorganic Chemistry","2000","39","","180","188","10.1021/ic990419u","","","0.71073","MoKα","","0.0767","0.042","","0.1258","0.1039","","","","0.786","0.79","0.79","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300024","13.797","0.003","18.378","0.004","24.531","0.005","105.17","0.03","104.82","0.03","96.56","0.03","5693","3","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C91.3 H32 Bi6 F60 O16 -","- C91.3 H22.5 Bi6 F60 O16 -","- C182.6 H45 Bi12 F120 O32 -","2","1","","Kenton H. Whitmire; Silke Hoppe; Orson Sydora; Jennifer L. Jolas; Carolyn M. Jones","Oligomerization and Oxide Formation in Bismuth Aryl Alkoxides: Synthesis and Characterization of Bi4(μ4-O)(μ-OC6F5)6{μ3-OBi(μ-OC6F5)3}2(C6H5CH3), Bi8(μ4-O)2(μ3-O)2(μ-OC6F5)16, Bi6(μ3-O)4(μ3-OC6F5){μ3-OBi(OC6F5)4}3, NaBi4(μ3-O)2(OC6F5)9(THF)2, and Na2Bi4(μ3-O)2(OC6F5)10(THF)2","Inorganic Chemistry","2000","39","","85","97","10.1021/ic990431m","","","0.71073","MoKα","","0.0709","0.0516","","","0.1341","0.1449","","","","","","1.043","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300025","14.292","0.003","15.111","0.003","17.545","0.004","112.19","0.03","104.46","0.03","100.58","0.03","3230","1.8","193","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C99.37 H10.74 Bi8 Cl6.74 F80 O22 -","- C99.38 H10.76 Bi8 Cl6.76 F80 O22 -","- C99.38 H10.76 Bi8 Cl6.76 F80 O22 -","1","0.5","","Kenton H. Whitmire; Silke Hoppe; Orson Sydora; Jennifer L. Jolas; Carolyn M. Jones","Oligomerization and Oxide Formation in Bismuth Aryl Alkoxides: Synthesis and Characterization of Bi4(μ4-O)(μ-OC6F5)6{μ3-OBi(μ-OC6F5)3}2(C6H5CH3), Bi8(μ4-O)2(μ3-O)2(μ-OC6F5)16, Bi6(μ3-O)4(μ3-OC6F5){μ3-OBi(OC6F5)4}3, NaBi4(μ3-O)2(OC6F5)9(THF)2, and Na2Bi4(μ3-O)2(OC6F5)10(THF)2","Inorganic Chemistry","2000","39","","85","97","10.1021/ic990431m","","","0.71073","MoKα","","0.056","0.0397","","0.1015","0.0931","","","","1.048","1.089","1.089","","","","","has coordinates,has disorder","134621","2020-10-21","18:00:00",""
"4300026","14.123","0.003","14.578","0.003","29.487","0.006","86.04","0.03","81.79","0.03","61.98","0.03","5304","2","293","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C92 H16 Bi9 F65 O20 -","- C92 H16 Bi9 F65 O20 -","- C184 H32 Bi18 F130 O40 -","2","1","","Kenton H. Whitmire; Silke Hoppe; Orson Sydora; Jennifer L. Jolas; Carolyn M. Jones","Oligomerization and Oxide Formation in Bismuth Aryl Alkoxides: Synthesis and Characterization of Bi4(μ4-O)(μ-OC6F5)6{μ3-OBi(μ-OC6F5)3}2(C6H5CH3), Bi8(μ4-O)2(μ3-O)2(μ-OC6F5)16, Bi6(μ3-O)4(μ3-OC6F5){μ3-OBi(OC6F5)4}3, NaBi4(μ3-O)2(OC6F5)9(THF)2, and Na2Bi4(μ3-O)2(OC6F5)10(THF)2","Inorganic Chemistry","2000","39","","85","97","10.1021/ic990431m","","","0.71073","MoKα","","0.1382","0.0764","","","0.2161","0.2854","","","","","","1.058","","","","has coordinates","120081","2020-10-21","18:00:00",""
"4300027","25.954","0.005","14.755","0.003","19.916","0.004","90","","107.73","0.03","90","","7265","3","293","2","193","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C62 H16 Bi4 F45 Na O13 -","- C62 H16 Bi4 F45 Na O13 -","- C248 H64 Bi16 F180 Na4 O52 -","4","0.5","","Kenton H. Whitmire; Silke Hoppe; Orson Sydora; Jennifer L. Jolas; Carolyn M. Jones","Oligomerization and Oxide Formation in Bismuth Aryl Alkoxides: Synthesis and Characterization of Bi4(μ4-O)(μ-OC6F5)6{μ3-OBi(μ-OC6F5)3}2(C6H5CH3), Bi8(μ4-O)2(μ3-O)2(μ-OC6F5)16, Bi6(μ3-O)4(μ3-OC6F5){μ3-OBi(OC6F5)4}3, NaBi4(μ3-O)2(OC6F5)9(THF)2, and Na2Bi4(μ3-O)2(OC6F5)10(THF)2","Inorganic Chemistry","2000","39","","85","97","10.1021/ic990431m","","","0.71073","MoKα","","0.1641","0.068","","","0.1415","0.1743","","","","","","1.051","","","","has coordinates","134573","2020-10-21","18:00:00",""
"4300028","12.008","0.005","23.36","0.01","13.816","0.005","90","","92.71","0.03","90","","3871","3","193","","193","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C62 H16 Bi4 F45 Na O13 -","- C68 H16 Bi4 F50 Na2 O14 -","- C136 H32 Bi8 F100 Na4 O28 -","2","0.5","","Kenton H. Whitmire; Silke Hoppe; Orson Sydora; Jennifer L. Jolas; Carolyn M. Jones","Oligomerization and Oxide Formation in Bismuth Aryl Alkoxides: Synthesis and Characterization of Bi4(μ4-O)(μ-OC6F5)6{μ3-OBi(μ-OC6F5)3}2(C6H5CH3), Bi8(μ4-O)2(μ3-O)2(μ-OC6F5)16, Bi6(μ3-O)4(μ3-OC6F5){μ3-OBi(OC6F5)4}3, NaBi4(μ3-O)2(OC6F5)9(THF)2, and Na2Bi4(μ3-O)2(OC6F5)10(THF)2","Inorganic Chemistry","2000","39","","85","97","10.1021/ic990431m","","","0.71073","MoKα","","","0.067","","","0.069","","","","","1.94","1.94","","","","","has coordinates","179038","2020-10-21","18:00:00",""
"4300029","7.118","0.004","8.537","0.004","13.231","0.009","79.16","0.05","78.03","0.05","70.96","0.04","737.2","0.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C11 H8 Cl4 N3 O Re -","- C11 H8 Cl4 N3 O Re -","- C22 H16 Cl8 N6 O2 Re2 -","2","1","","Sangeeta Banerjee; Sibaprasad Bhattacharyya; Bimal Kumar Dirghangi; Mahua Menon; Animesh Chakravorty","Chemistry of the Rhenium-Azopyridine Family: An Oxo Parent and Derivatives Thereof Including a Novel Oxo-Imido Dimer","Inorganic Chemistry","2000","39","","6","13","10.1021/ic990465u","","","0.71073","MoKα","","0.038","0.0319","","0.0833","0.0783","","","","1.11","1.11","1.11","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4300030","11.264","0.007","15.221","0.009","17.628","0.009","90","","94.21","0.06","90","","3014","3","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C29 H23 Cl4 N3 O P Re -","- C29 H23 Cl4 N3 O P Re -","- C116 H92 Cl16 N12 O4 P4 Re4 -","4","1","","Sangeeta Banerjee; Sibaprasad Bhattacharyya; Bimal Kumar Dirghangi; Mahua Menon; Animesh Chakravorty","Chemistry of the Rhenium-Azopyridine Family: An Oxo Parent and Derivatives Thereof Including a Novel Oxo-Imido Dimer","Inorganic Chemistry","2000","39","","6","13","10.1021/ic990465u","","","0.71073","MoKα","","0.1083","0.0616","","0.1666","0.1355","","","","1.04","1.1","1.1","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4300031","9.683","0.003","10.898","0.003","11.522","0.003","63.67","0.02","71.24","0.02","86.79","0.02","1026.4","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H12 Cl5 N4 Re -","- C17 H12 Cl5 N4 Re -","- C34 H24 Cl10 N8 Re2 -","2","1","","Sangeeta Banerjee; Sibaprasad Bhattacharyya; Bimal Kumar Dirghangi; Mahua Menon; Animesh Chakravorty","Chemistry of the Rhenium-Azopyridine Family: An Oxo Parent and Derivatives Thereof Including a Novel Oxo-Imido Dimer","Inorganic Chemistry","2000","39","","6","13","10.1021/ic990465u","","","0.71073","MoKα","","0.0441","0.0339","","0.0812","0.0765","","","","1.043","1.059","1.059","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4300032","12.522","0.006","12.857","0.008","13.182","0.007","67.75","0.04","88.3","0.04","82.09","0.04","1944.9","1.9","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H25 Cl8 N7 O2 Re2 -","- C30 H25 Cl8 N7 O2 Re2 -","- C60 H50 Cl16 N14 O4 Re4 -","2","1","","Sangeeta Banerjee; Sibaprasad Bhattacharyya; Bimal Kumar Dirghangi; Mahua Menon; Animesh Chakravorty","Chemistry of the Rhenium-Azopyridine Family: An Oxo Parent and Derivatives Thereof Including a Novel Oxo-Imido Dimer","Inorganic Chemistry","2000","39","","6","13","10.1021/ic990465u","","","0.71073","MoKα","","0.0708","0.0469","","0.1287","0.1068","","","","1.053","1.103","1.103","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4300033","15.677","0.003","15.677","0.003","16.021","0.002","90","","90","","120","","3409.9","1","183","2","183","2","","","","","","","","5","P -3","-P 3","147","","(mu)-nitrido tris-thioadamantyl tris-(N-tert-butyl anilido) dimolybdenum(IV, V)","","- C60 H87 Mo2 N4 S3 -","- C60 H87 Mo2 N4 S3 -","- C120 H174 Mo4 N8 S6 -","2","0.333333","","Theodor Agapie; Aaron L. Odom; Christopher C. Cummins","In Pursuit of the Molybdenum(III) Tris(thiolate) Fragment: Unusual Structure of a Dimolybdenum μ-Nitrido Complex","Inorganic Chemistry","2000","39","","174","179","10.1021/ic9904891","","","0.71073","MoKα","","0.0702","0.0588","","0.211","0.1823","","","","1.11","1.1","1.1","","","","","has coordinates","270074","2021-10-24","17:53:43",""
"4300034","8.845","0.006","12.6609","0.0009","12.826","0.003","88.45","0.02","74.36","0.03","89.32","0.02","1382.6","1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H10 F8 N6 Pd -","- C22 H10 F8 N6 Pd -","- C44 H20 F16 N12 Pd2 -","2","1","","Felipe Gómez-de la Torre; Antonio de la Hoz; Félix A. Jalón; Blanca R. Manzano; Ana M. Rodríguez; José Elguero; Martín Martínez-Ripoll","Pd(II) Complexes with Polydentate Nitrogen Ligands. Molecular Recognition and Dynamic Behavior Involving Pd-N Bond Rupture. X-ray Molecular Structures of [{Pd(C~6~HF~4~)~2~}(bpzm)] and [{PdΜ^3^-(C~4~H~7~)}~2~(bpzm)]CF~3~SO~3~)~2~ [bpzpm = 4,6-Bis(pyrazol-1-yl)pyrimidine]","Inorganic Chemistry","2000","39","","1152","1162","10.1021/ic990495x","","","0.7107","MoKα","","0.1373","0.0798","","","0.2452","0.3077","","","","","","1.066","","","","has coordinates","120081","2020-10-21","18:00:00",""
"4300035","9.368","0.002","16.191","0.003","20.228","0.006","90","","101.26","0.03","90","","3009.1","1.3","293","2","293","2","","","","","","","","7","I 1 2/m 1","-I 2y","12","","","","- C20 H22 F6 N6 O6 Pd2 S2 -","- C20 H22 F6 N6 O6 Pd2 S2 -","- C80 H88 F24 N24 O24 Pd8 S8 -","4","0.5","","Felipe Gómez-de la Torre; Antonio de la Hoz; Félix A. Jalón; Blanca R. Manzano; Ana M. Rodríguez; José Elguero; Martín Martínez-Ripoll","Pd(II) Complexes with Polydentate Nitrogen Ligands. Molecular Recognition and Dynamic Behavior Involving Pd-N Bond Rupture. X-ray Molecular Structures of [{Pd(C~6~HF~4~)~2~}(bpzm)] and [{PdΜ^3^-(C~4~H~7~)}~2~(bpzm)]CF~3~SO~3~)~2~ [bpzpm = 4,6-Bis(pyrazol-1-yl)pyrimidine]","Inorganic Chemistry","2000","39","","1152","1162","10.1021/ic990495x","","","0.7107","MoKα","","0.0432","0.0361","","0.0945","0.0875","","","","1.199","1.185","1.185","","","","","has coordinates,has disorder","134621","2020-10-21","18:00:00",""
"4300036","9.318","0.001","9.677","0.001","8.475","0.001","95.011","0.008","116.249","0.006","75.709","0.008","663.97","0.13","102","","102","","","","","","","","","3","P -1","-P 1","2","","","","- C28 H46 Pb -","- C28 H46 Pb -","- C28 H46 Pb -","1","0.5","","David J. Burkey; Timothy P. Hanusa; John C. Huffman","Stereochemical Activity of the Metal-Centered Lone Electron Pair in Group 14 Metallocenes. Crystal Structure of the Linear Sandwich Complex [C5(iPr)3H2]2Pb","Inorganic Chemistry","2000","39","","153","155","10.1021/ic9905401","","","0.71073","MoKα","","","0.0224","","","","0.0206","","","","","","0.911","","","","has coordinates","179038","2020-10-21","18:00:00",""
"4300037","12.053","0.002","12.09","0.002","26.864","0.005","90","","98.5","0.03","90","","3871.6","1.2","100","0.4","100","0.4","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C41 H46 Cl2 Mg2 O8 -","- C41 H46 Cl2 Mg2 O8 -","- C164 H184 Cl8 Mg8 O32 -","4","1","","Piotr Sobota; Józef Utko; Katarzyna Sztajnowska; Jolanta Ejfler; Lucjan B. Jerzykiewicz","Polynuclear Magnesium and Magnesium-Titanium Species. Syntheses and Crystal Structures of [Mg4(μ3,η2-ddbfo)2(μ,η2-ddbfo)2(μ,η1-ddbfo)2(η1-ddbfo)2], [Mg4(μ3-OMe)2(μ,η2-ddbfo)2(μ,η1-ddbfo)2(η1-ddbfo)2(CH3OH)5], and [Mg4(μ3,η2-thffo)2(μ,η2-thffo)2(μ,η1-thffo)2{μ-OTi(DIPP)3}2] Aggregates","Inorganic Chemistry","2000","39","","235","239","10.1021/ic990542l","","","0.71073","MoKα","","0.0504","0.0482","","","0.111","0.1132","","","","","","1.079","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300038","13.323","0.003","20.768","0.004","27.584","0.006","90","","104.26","0.03","90","","7397","3","100","0.4","100","0.4","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C72 H104 Mg4 O21 -","- C72 H104 Mg4 O21 -","- C288 H416 Mg16 O84 -","4","1","","Piotr Sobota; Józef Utko; Katarzyna Sztajnowska; Jolanta Ejfler; Lucjan B. Jerzykiewicz","Polynuclear Magnesium and Magnesium-Titanium Species. Syntheses and Crystal Structures of [Mg4(μ3,η2-ddbfo)2(μ,η2-ddbfo)2(μ,η1-ddbfo)2(η1-ddbfo)2], [Mg4(μ3-OMe)2(μ,η2-ddbfo)2(μ,η1-ddbfo)2(η1-ddbfo)2(CH3OH)5], and [Mg4(μ3,η2-thffo)2(μ,η2-thffo)2(μ,η1-thffo)2{μ-OTi(DIPP)3}2] Aggregates","Inorganic Chemistry","2000","39","","235","239","10.1021/ic990542l","","","0.71073","MoKα","","0.063","0.0629","","","0.1571","0.1571","","","","","","1.089","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300039","17.069","0.003","18.421","0.004","17.815","0.004","90","","90.77","0.03","90","","5601","2","100","0.4","100","0.4","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C52 H80 Cl2 Mg2 O10 Ti -","- C52 H80 Cl2 Mg2 O10 Ti -","- C208 H320 Cl8 Mg8 O40 Ti4 -","4","1","","Piotr Sobota; Józef Utko; Katarzyna Sztajnowska; Jolanta Ejfler; Lucjan B. Jerzykiewicz","Polynuclear Magnesium and Magnesium-Titanium Species. Syntheses and Crystal Structures of [Mg4(μ3,η2-ddbfo)2(μ,η2-ddbfo)2(μ,η1-ddbfo)2(η1-ddbfo)2], [Mg4(μ3-OMe)2(μ,η2-ddbfo)2(μ,η1-ddbfo)2(η1-ddbfo)2(CH3OH)5], and [Mg4(μ3,η2-thffo)2(μ,η2-thffo)2(μ,η1-thffo)2{μ-OTi(DIPP)3}2] Aggregates","Inorganic Chemistry","2000","39","","235","239","10.1021/ic990542l","","","0.71073","MoKα","","0.0599","0.0565","","","0.1312","0.1344","","","","","","1.077","","","","has coordinates,has disorder","134621","2020-10-21","18:00:00",""
"4300040","9.886","0.003","17.539","0.004","11.867","0.003","90","","99.35","0.02","90","","2030.3","0.9","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H21 Au Cl Fe P -","- C23 H21 Au Cl Fe P -","- C92 H84 Au4 Cl4 Fe4 P4 -","4","1","","Eva M. Barranco; Olga Crespo; M. Concepción Gimeno; Antonio Laguna; Peter G. Jones; Birte Ahrens","Gold and Silver Complexes with the Ferrocenyl Phosphine FcCH2PPh2 [Fc = (η5-C5H5)Fe(η5-C5H4)]","Inorganic Chemistry","2000","39","","680","687","10.1021/ic9905446","","","0.71073","MoKα","","0.0519","0.0328","","","0.0684","0.0723","","","","","","0.898","","","","has coordinates","179038","2020-10-21","18:00:00",""
"4300041","10.9599","0.0018","11.049","0.002","12.5618","0.0018","115.374","0.014","109.135","0.012","94.918","0.014","1252.1","0.4","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C29 H21 Au F5 Fe P -","- C29 H21 Au F5 Fe P -","- C58 H42 Au2 F10 Fe2 P2 -","2","1","","Eva M. Barranco; Olga Crespo; M. Concepción Gimeno; Antonio Laguna; Peter G. Jones; Birte Ahrens","Gold and Silver Complexes with the Ferrocenyl Phosphine FcCH2PPh2 [Fc = (η5-C5H5)Fe(η5-C5H4)]","Inorganic Chemistry","2000","39","","680","687","10.1021/ic9905446","","","0.71073","MoKα","","0.0437","0.0298","","0.0522","0.0503","","","","0.888","0.963","0.963","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4300042","10.859","0.003","11.463","0.004","16.517","0.005","74.69","0.02","80.33","0.02","76.98","0.02","1919.1","1.1","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C42 H36 Au F3 Fe O3 P2 S -","- C42 H36 Au F3 Fe O3 P2 S -","- C84 H72 Au2 F6 Fe2 O6 P4 S2 -","2","1","","Eva M. Barranco; Olga Crespo; M. Concepción Gimeno; Antonio Laguna; Peter G. Jones; Birte Ahrens","Gold and Silver Complexes with the Ferrocenyl Phosphine FcCH2PPh2 [Fc = (η5-C5H5)Fe(η5-C5H4)]","Inorganic Chemistry","2000","39","","680","687","10.1021/ic9905446","","","0.71073","MoKα","","0.0332","0.029","","0.0721","0.0694","","","","0.996","1.04","1.04","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300043","9.0828","0.0018","9.5568","0.0016","13.501","0.002","86.587","0.012","89.573","0.014","77.154","0.014","1140.5","0.3","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C47 H44 Au Cl3 Fe2 O4 P2 -","- C47 H42 Au Cl3 Fe2 O4 P2 -","- C47 H42 Au Cl3 Fe2 O4 P2 -","1","0.5","","Eva M. Barranco; Olga Crespo; M. Concepción Gimeno; Antonio Laguna; Peter G. Jones; Birte Ahrens","Gold and Silver Complexes with the Ferrocenyl Phosphine FcCH2PPh2 [Fc = (η5-C5H5)Fe(η5-C5H4)]","Inorganic Chemistry","2000","39","","680","687","10.1021/ic9905446","","","0.71073","MoKα","","0.0637","0.0489","","","0.12","0.1254","","","","","","0.973","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"4300044","13.6515","0.0014","17.1007","0.0016","16.2736","0.0016","90","","91.566","0.007","90","","3797.7","0.6","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C41 H21 Au F15 Fe P -","- C41 H21 Au F15 Fe P -","- C164 H84 Au4 F60 Fe4 P4 -","4","1","","Eva M. Barranco; Olga Crespo; M. Concepción Gimeno; Antonio Laguna; Peter G. Jones; Birte Ahrens","Gold and Silver Complexes with the Ferrocenyl Phosphine FcCH2PPh2 [Fc = (η5-C5H5)Fe(η5-C5H4)]","Inorganic Chemistry","2000","39","","680","687","10.1021/ic9905446","","","0.71073","MoKα","","0.0424","0.0248","","0.0443","0.042","","","","0.886","0.98","0.98","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4300045","12.692","0.003","18.467","0.004","28.693","0.006","90","","93.08","0.02","90","","6715","3","173","2","173","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C71 H65 Ag Cl2 F3 Fe3 O3 P3 S -","- C71 H65 Ag Cl2 F3 Fe3 O3 P3 S -","- C284 H260 Ag4 Cl8 F12 Fe12 O12 P12 S4 -","4","1","","Eva M. Barranco; Olga Crespo; M. Concepción Gimeno; Antonio Laguna; Peter G. Jones; Birte Ahrens","Gold and Silver Complexes with the Ferrocenyl Phosphine FcCH2PPh2 [Fc = (η5-C5H5)Fe(η5-C5H4)]","Inorganic Chemistry","2000","39","","680","687","10.1021/ic9905446","","","0.71073","MoKα","","0.1912","0.095","","","0.2323","0.278","","","","","","0.878","","","","has coordinates","179038","2020-10-21","18:00:00",""
"4300046","6.901","0.001","8.303","0.002","14.177","0.003","101.02","0.03","99.35","0.03","96.68","0.03","777.6","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H36 Cl4 N8 O6 Pt -","- C18 H36 Cl4 N8 O6 Pt -","- C18 H36 Cl4 N8 O6 Pt -","1","0.5","","Vadim Yu. Kukushkin; Tatyana B. Pakhomova; Nadezhda A. Bokach; Gabriele Wagner; Maxim L. Kuznetsov; Markus Galanski; Armando J. L. Pombeiro","Iminoacylation. 3. Formation of Platinum(IV)-Based Metallaligands Due to Facile One-End Addition of vic-Dioximes to Coordinated Organonitriles1-3","Inorganic Chemistry","2000","39","","216","225","10.1021/ic990552m","","","0.71073","MoKα","","0.0263","0.0263","","","0.066","0.066","","","","","","1.083","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300047","10.29","","18.153","","13.059","","90","","94.46","","90","","2431.96","","293","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H44 Cl8 N12 O8 Pt2 -","- C16 H22 Cl4 N6 O4 Pt -","- C64 H88 Cl16 N24 O16 Pt4 -","4","1","","Vadim Yu. Kukushkin; Tatyana B. Pakhomova; Nadezhda A. Bokach; Gabriele Wagner; Maxim L. Kuznetsov; Markus Galanski; Armando J. L. Pombeiro","Iminoacylation. 3. Formation of Platinum(IV)-Based Metallaligands Due to Facile One-End Addition of vic-Dioximes to Coordinated Organonitriles1-3","Inorganic Chemistry","2000","39","","216","225","10.1021/ic990552m","","","0.71069","MoKα","","0.058","0.058","","0.078","0.078","","","","6.919","6.919","6.919","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300048","8.163","0.003","7.823","0.003","14.51","0.04","90","","100.04","0.03","90","","912","3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H22 Cl2 N4 O4 Pt -","- C14 H20 Cl2 N4 O4 Pt -","- C28 H40 Cl4 N8 O8 Pt2 -","2","0.5","","Vadim Yu. Kukushkin; Tatyana B. Pakhomova; Nadezhda A. Bokach; Gabriele Wagner; Maxim L. Kuznetsov; Markus Galanski; Armando J. L. Pombeiro","Iminoacylation. 3. Formation of Platinum(IV)-Based Metallaligands Due to Facile One-End Addition of vic-Dioximes to Coordinated Organonitriles1-3","Inorganic Chemistry","2000","39","","216","225","10.1021/ic990552m","","","0.71069","MoKα","","0.0559","0.0412","","","0.106","0.1117","","","","","","1.094","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300049","7.67","0.002","8.23","0.002","9.682","0.002","65.14","0.03","86.18","0.03","65.12","0.03","498.5","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C16 H26 Cl2 N4 O4 Pt -","- C16 H26 Cl2 N4 O4 Pt -","- C16 H26 Cl2 N4 O4 Pt -","1","0.5","","Vadim Yu. Kukushkin; Tatyana B. Pakhomova; Nadezhda A. Bokach; Gabriele Wagner; Maxim L. Kuznetsov; Markus Galanski; Armando J. L. Pombeiro","Iminoacylation. 3. Formation of Platinum(IV)-Based Metallaligands Due to Facile One-End Addition of vic-Dioximes to Coordinated Organonitriles1-3","Inorganic Chemistry","2000","39","","216","225","10.1021/ic990552m","","","0.71073","MoKα","","0.0264","0.0264","","","0.0747","0.0747","","","","","","1.143","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300050","14.645","0.001","14.645","0.001","25.53","0.004","90","","90","","120","","4742","0.9","293","2","293","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C30 H50 N8 O4 -","- C30 H48 N8 O3.99 -","- C180 H288 N48 O23.94 -","6","0.333333","","Françoise Arnaud-Neu; Saowarux Fuangswasdi; Beatrice Maubert; Jane Nelson; Vickie McKee","Binding Properties of Octaaminocryptands","Inorganic Chemistry","2000","39","","573","579","10.1021/ic9905704","","","0.71073","MoKα","","0.0471","0.0371","","0.0947","0.0884","","","","1.05","1.073","1.073","","","","","has coordinates","179038","2020-10-21","18:00:00",""
"4300051","9.517","0.001","15.584","0.002","23.617","0.004","90.73","0.01","90.94","0.01","90.746","0.007","3501.6","0.8","153","2","153","2","","","","","","","","3","P -1","-P 1","2","","","","- C36 H54 N8 -","- C36 H54 N8 -","- C144 H216 N32 -","4","2","","Françoise Arnaud-Neu; Saowarux Fuangswasdi; Beatrice Maubert; Jane Nelson; Vickie McKee","Binding Properties of Octaaminocryptands","Inorganic Chemistry","2000","39","","573","579","10.1021/ic9905704","","","0.71073","MoKα","","0.0965","0.0506","","","0.0997","0.1169","","","","","","1.013","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4300052","15.813","0.008","26.145","0.004","17.768","0.008","90","","96.98","0.02","90","","7291","5","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C75 H88 Au3 B F4 N O4 P3 -","- C75 H88 Au3 B F4 N O4 P3 -","- C300 H352 Au12 B4 F16 N4 O16 P12 -","4","1","","Bruce W. Flint; Yi Yang; Paul R. Sharp","Gold(I) Heteroatom-Substituted Imido Complexes. Amino Nitrene Loss from [(LAu)3(μ-NNR2)]+","Inorganic Chemistry","2000","39","","602","608","10.1021/ic990586u","","","0.7093","MolybdenumKα","","0.0781","0.0499","","","0.132","0.1438","","","","","","1.06","","","","has coordinates","120081","2020-10-21","18:00:00",""
"4300053","12.975","0.0008","14.5771","0.0009","22.0437","0.0014","71.75","0.001","89.42","0.001","68.236","0.001","3650.7","0.4","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C72 H80 Au3 F6 N2 O9 P3 S2 -","- C72 H80 Au3 F6 N2 O9 P3 S2 -","- C144 H160 Au6 F12 N4 O18 P6 S4 -","2","1","","Bruce W. Flint; Yi Yang; Paul R. Sharp","Gold(I) Heteroatom-Substituted Imido Complexes. Amino Nitrene Loss from [(LAu)3(μ-NNR2)]+","Inorganic Chemistry","2000","39","","602","608","10.1021/ic990586u","","","0.7107","MoKα","","0.1058","0.0513","","","0.1079","0.1276","","","","","","0.972","","","","has coordinates","120081","2020-10-21","18:00:00",""
"4300054","12.721","0.003","24.516","0.005","26.45","0.005","89.9","0.03","77.32","0.03","89.96","0.03","8048","3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- As4 Cu4 H98 Na16 O161 W30 -","- As4 Cu4 Na16 O161 W30 -","- As8 Cu8 Na32 O322 W60 -","2","1","","Li-Hua Bi; En-Bo Wang; Jun Peng; Ru-Dan Huang; Lin Xu; Chang-Wen Hu","Crystal Structure and Replacement Reaction of Coordinated Water Molecules of the Heteropoly Compounds of Sandwich-Type Tungstoarsenates","Inorganic Chemistry","2000","39","","671","679","10.1021/ic990596v","","","0.71073","MoKα","","0.174","0.0974","","0.3109","0.232","","","","0.889","1.167","1.167","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300055","8.4552","0.001","18.0676","0.0032","19.7286","0.0027","90","","99.658","0.007","90","","2971.1","0.8","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C28 H31 Cl2 F6 N2 P2 Rh -","- C28 H31 Cl2 F6 N2 P2 Rh -","- C112 H124 Cl8 F24 N8 P8 Rh4 -","4","1","","M. Aránzazu Alonso; Juan A. Casares; Pablo Espinet; Katerina Soulantica; Jonathan P. H. Charmant; A. Guy Orpen","Rhodium Complexes with the Chelating and Binucleating Ligands P(CH~2~CH~2~Py)~n~Ph~3-n~, (Py = 2-Pyridyl; n= 1, 2): Structures and Fluxional Behavior","Inorganic Chemistry","2000","39","","705","711","10.1021/ic990634a","","","0.71073","MoKα","","0.0382","0.0264","","0.066","0.0624","","","","0.998","1.061","1.061","","","","","has coordinates,has disorder","134621","2020-10-21","18:00:00",""
"4300056","13.012","0.001","13.0115","","24.707","0.002","90","","90","","90","","4183","0.5","296.2","","296.2","","","","","","","","","9","I -4 2 m","I -4 2","121","","","","- C18 H44 Ag3 Co2 F18 N8 O P3 S6 -","- C16 Ag1.25 Co F15 N7 O0.25 P1.25 S6 -","- C64 Ag5 Co4 F60 N28 O P5 S24 -","4","0.25","","Keiji Tokuda; Ken-ichi Okamoto; Takumi Konno","Synthesis, Characterization, and Chiral Properties of CoIII2AgI3 Pentanuclear, CoIII4ZnII4 Octanuclear, and CoIII Mononuclear Complexes with Aza-Capped Hexadentate-N3S3 Thiolate Ligands: Crystal Structures of [Ag3{Co(L)}2][PF6]3 and [Zn4O{Co(L)}4][PF6]6 (L = N(CH2NHCH2CH2S-)3)","Inorganic Chemistry","2000","39","","333","339","10.1021/ic9906407","","","0.7107","MoKα","","","0.0546","","","0.0574","","","","","1.027","1.027","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300057","14.33","0.07","25.76","0.1","24.83","0.06","90","","101.3","0.3","90","","8988","6","296.2","","296.2","","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C36 H100 Co4 F36 N16 O9 P6 S12 Zn4 -","- C36 Co4 F36 N16 O9 P6 S12 Zn4 -","- C144 Co16 F144 N64 O36 P24 S48 Zn16 -","4","1","","Keiji Tokuda; Ken-ichi Okamoto; Takumi Konno","Synthesis, Characterization, and Chiral Properties of CoIII2AgI3 Pentanuclear, CoIII4ZnII4 Octanuclear, and CoIII Mononuclear Complexes with Aza-Capped Hexadentate-N3S3 Thiolate Ligands: Crystal Structures of [Ag3{Co(L)}2][PF6]3 and [Zn4O{Co(L)}4][PF6]6 (L = N(CH2NHCH2CH2S-)3)","Inorganic Chemistry","2000","39","","333","339","10.1021/ic9906407","","","0.7107","MoKα","","","0.069","","","0.0774","","","","","1.265","1.265","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300058","8.987","0.001","8.987","0.001","9.24","0.001","90","","90","","90","","746.3","0.2","293","2","293","2","","","","","","","","3","I 4/m m m","-I 4 2","139","Cesium tetraiodopalladate diiodine","","","- Cs2 I6 Pd -","- Cs2 I6 Pd -","- Cs4 I12 Pd2 -","2","0.0625","","B. Schüpp; P. Heines; A. Savin; H.-L. Keller","Crystal Structures and Pressure-Induced Redox Reaction of Cs2PdI4.I2 to Cs2PdI6","Inorganic Chemistry","2000","39","","732","735","10.1021/ic990670+","","","","","","","0.0248","","","0.0614","","","","","","","","","","","has coordinates","277859","2022-09-15","00:05:25",""
"4300059","11.332","0.001","11.332","0.001","11.332","0.001","90","","90","","90","","1455.2","0.2","293","2","293","2","","","","","","","","3","F m -3 m","-F 4 2 3","225","Cesium hexaiodopalladate","","","- Cs2 I6 Pd -","- Cs2 I6 Pd -","- Cs8 I24 Pd4 -","4","0.0208333","","B. Schüpp; P. Heines; A. Savin; H.-L. Keller","Crystal Structures and Pressure-Induced Redox Reaction of Cs2PdI4.I2 to Cs2PdI6","Inorganic Chemistry","2000","39","","732","735","10.1021/ic990670+","","","","","","","0.0327","","","0.0832","","","","","","","","","","","has coordinates","277859","2022-09-15","00:05:25",""
"4300060","8.918","0.003","9.894","0.003","29.062","0.012","93.51","0.03","94.17","0.03","115.6","0.03","2294.2","1.5","298","","298","","","","","","","","chemical synthesis","5","P -1","-P 1","2","","bis[(N-tetradecyl)pyridinium]tetraiodopalladate(II)","","- C38 H68 I4 N2 Pd -","- C38 H68 I4 N2 Pd -","- C76 H136 I8 N4 Pd2 -","2","1","","Francesco Neve; Alessandra Crispini; Oriano Francescangeli","Structural Studies on Layered Alkylpyridinium Iodopalladate Networks","Inorganic Chemistry","2000","39","","1187","1194","10.1021/ic9906959","","","0.71073","MoKα","","0.0835","0.0575","","0.0819","0.0612","","","","","1.26","1.26","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300061","9.399","0.004","14.264","0.006","29.42","0.01","92.11","0.04","90.07","0.04","104.53","0.03","3815","3","298","","298","","","","","","","","chemical synthesis","5","P -1","-P 1","2","","bis[(N-tetradecyl)pyridinium]hexaiododipalladate(II)","","- C38 H68 I6 N2 Pd2 -","- C38 H68 I6 N2 Pd2 -","- C114 H204 I18 N6 Pd6 -","3","1.5","","Francesco Neve; Alessandra Crispini; Oriano Francescangeli","Structural Studies on Layered Alkylpyridinium Iodopalladate Networks","Inorganic Chemistry","2000","39","","1187","1194","10.1021/ic9906959","","","0.71073","MoKα","","0.1204","0.0617","","0.1074","0.066","","","","","0.91","0.91","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300062","9.417","0.002","14.215","0.003","31.552","0.006","87.96","0.03","87.63","0.03","75.67","0.03","4087.3","1.6","298","","298","","","","","","","","chemical synthesis","5","P -1","-P 1","2","","bis[(N-hexadecyl)pyridinium]hexaiododipalladate(II)","","- C42 H72 I6 N2 Pd2 -","- C42 H76 I6 N2 Pd2 -","- C126 H228 I18 N6 Pd6 -","3","1.5","","Francesco Neve; Alessandra Crispini; Oriano Francescangeli","Structural Studies on Layered Alkylpyridinium Iodopalladate Networks","Inorganic Chemistry","2000","39","","1187","1194","10.1021/ic9906959","","","0.71073","MoKα","","0.0873","0.0451","","0.1188","0.0984","","","","0.933","1.045","1.045","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300063","18.928","0.013","12.769","0.009","29.5","0.02","90","","90","","90","","7130","9","293","2","153","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C16 H40 Br6 Mo3 N2 S7 -","- C16 H40 Br6 Mo3 N2 S7 -","- C128 H320 Br48 Mo24 N16 S56 -","8","1","","Virginie Béreau; Christopher G. Pernin; James A. Ibers","Reactivity of the [Mo3(μ3-S)(μ2-S2)3Br6]2- Anion toward the Imidodiphosphinochalcogenido Ligands [N(QPPh2)2]- (Q = S, Se): Synthesis and Characterization of [Mo3(μ3-S)(μ2-S2)3{N(QPPh2)2}3]Br","Inorganic Chemistry","2000","39","","854","856","10.1021/ic9907056","","","0.71073","MoKα","","0.0706","0.0344","","","0.0689","0.0769","","","","","","0.819","","","","has coordinates","120081","2020-10-21","18:00:00",""
"4300064","13.309","0.004","24.971","0.008","26.206","0.008","90","","93.57","0.006","90","","8692","5","153","2","153","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C74 H64 Br Cl4 Mo3 N3 P6 S13 -","- C74 H64 Br Cl4 Mo3 N3 P6 S13 -","- C296 H256 Br4 Cl16 Mo12 N12 P24 S52 -","4","1","","Virginie Béreau; Christopher G. Pernin; James A. Ibers","Reactivity of the [Mo3(μ3-S)(μ2-S2)3Br6]2- Anion toward the Imidodiphosphinochalcogenido Ligands [N(QPPh2)2]- (Q = S, Se): Synthesis and Characterization of [Mo3(μ3-S)(μ2-S2)3{N(QPPh2)2}3]Br","Inorganic Chemistry","2000","39","","854","856","10.1021/ic9907056","","","0.71073","MoKα","","0.0939","0.055","","","0.123","0.1315","","","","","","1.503","","","","has coordinates","120081","2020-10-21","18:00:00",""
"4300065","21.076","0.003","21.076","0.003","75.848","0.015","90","","90","","120","","29178","8","153","2","153","2","","","","","","","","8","R -3 c :H","-R 3 2""c","167","","","","- C72 H60 Br Mo3 N3 P6 S7 Se6 -","- C72 H60 Br Mo3 N3 P6 S7 Se6 -","- C864 H720 Br12 Mo36 N36 P72 S84 Se72 -","12","0.333333","","Virginie Béreau; Christopher G. Pernin; James A. Ibers","Reactivity of the [Mo3(μ3-S)(μ2-S2)3Br6]2- Anion toward the Imidodiphosphinochalcogenido Ligands [N(QPPh2)2]- (Q = S, Se): Synthesis and Characterization of [Mo3(μ3-S)(μ2-S2)3{N(QPPh2)2}3]Br","Inorganic Chemistry","2000","39","","854","856","10.1021/ic9907056","","","0.71073","MoKα","","0.1547","0.0927","","","0.2145","0.2402","","","","","","1.327","","","","has coordinates","179038","2020-10-21","18:00:00",""
"4300066","6.534","0.001","10.801","0.001","9.631","0.002","90","","105.57","0.02","90","","654.75","0.19","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C12 H12 Al Cl2 N -","- C12 H12 Al Cl2 N -","- C24 H24 Al2 Cl4 N2 -","2","1","","Gregory S. Hair; Scott L. Battle; Andreas Decken; Alan H. Cowley; Richard A. Jones","Synthesis and Characterization of 8-(Dimethylamino)-1-naphthyl Derivatives of Aluminum, Gallium, and Indium","Inorganic Chemistry","2000","39","","27","31","10.1021/ic990707q","","","0.71073","MoKα","","0.0627","0.0453","","0.1142","0.1011","","","","1.069","1.096","1.096","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300067","6.552","0.002","10.833","0.002","9.601","0.002","90","","106.05","0.02","90","","654.9","0.3","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C12 H12 Cl2 Ga N -","- C12 H12 Cl2 Ga N -","- C24 H24 Cl4 Ga2 N2 -","2","1","","Gregory S. Hair; Scott L. Battle; Andreas Decken; Alan H. Cowley; Richard A. Jones","Synthesis and Characterization of 8-(Dimethylamino)-1-naphthyl Derivatives of Aluminum, Gallium, and Indium","Inorganic Chemistry","2000","39","","27","31","10.1021/ic990707q","","","0.71073","MoKα","","0.0724","0.0609","","0.1535","0.1362","","","","1.106","1.135","1.135","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300068","7.401","0.002","15.746","0.005","10.801","0.004","90","","92.37","0.03","90","","1257.6","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H12 Cl2 In N -","- C12 H12 Cl2 In N -","- C48 H48 Cl8 In4 N4 -","4","1","","Gregory S. Hair; Scott L. Battle; Andreas Decken; Alan H. Cowley; Richard A. Jones","Synthesis and Characterization of 8-(Dimethylamino)-1-naphthyl Derivatives of Aluminum, Gallium, and Indium","Inorganic Chemistry","2000","39","","27","31","10.1021/ic990707q","","","0.71073","MoKα","","0.1106","0.0712","","0.2713","0.1377","","","","1.064","1.103","1.103","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300069","13.343","0.003","11.228","0.002","7.505","0.0015","90","","100.64","0.03","90","","1105","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H14 Al N -","- C12 H14 Al N -","- C48 H56 Al4 N4 -","4","1","","Gregory S. Hair; Scott L. Battle; Andreas Decken; Alan H. Cowley; Richard A. Jones","Synthesis and Characterization of 8-(Dimethylamino)-1-naphthyl Derivatives of Aluminum, Gallium, and Indium","Inorganic Chemistry","2000","39","","27","31","10.1021/ic990707q","","","0.71073","MoKα","","0.113","0.056","","0.1226","0.1006","","","","1.034","1.137","1.137","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300070","12.4969","0.0003","12.8877","0.0003","13.407","0.0003","113.297","0.001","92.406","0.001","110.78","0.001","1811.96","0.08","198","2","198","2","","","","","","","","6","P -1","-P 1","2","","","","- C71 H46 Hg2 O22 P2 Re6 -","- C71 H46 Hg2 O22 P2 Re6 -","- C71 H46 Hg2 O22 P2 Re6 -","1","0.5","","Udo Brand; John R. Shapley","Carbidohexarhenate Cluster Cores Bicapped by Mercury with Acetate or Thiolate Ligands","Inorganic Chemistry","2000","39","","32","36","10.1021/ic990722v","","","0.71073","MoKα","","0.0459","0.0339","","0.085","0.0735","","","","1.021","1.011","1.011","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300071","34.9361","0.0007","7.1538","0.0002","29.6569","0.0007","90","","104.001","0.001","90","","7191.8","0.3","198","2","198","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C34.5 H30 Cl O10 P Re2 -","- C34.5 H30 Cl O10 P Re2 -","- C276 H240 Cl8 O80 P8 Re16 -","8","1","","Udo Brand; John R. Shapley","Carbidohexarhenate Cluster Cores Bicapped by Mercury with Acetate or Thiolate Ligands","Inorganic Chemistry","2000","39","","32","36","10.1021/ic990722v","","","0.71073","MoKα","","0.0299","0.0238","","0.0622","0.0523","","","","0.984","0.974","0.974","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300072","12.3703","0.0007","13.8241","0.0007","15.0331","0.0008","107.56","0.001","102.199","0.001","113.872","0.001","2071","0.2","198","2","198","2","","","","","","","","8","P -1","-P 1","2","","","","- C81 H56 Br2 Hg2 O20 P2 Re6 S2 -","- C81 H56 Br2 Hg2 O20 P2 Re6 S2 -","- C81 H56 Br2 Hg2 O20 P2 Re6 S2 -","1","0.5","","Udo Brand; John R. Shapley","Carbidohexarhenate Cluster Cores Bicapped by Mercury with Acetate or Thiolate Ligands","Inorganic Chemistry","2000","39","","32","36","10.1021/ic990722v","","","0.71073","MoKα","","0.0885","0.073","","0.2051","0.1857","","","","1.031","1.093","1.093","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300073","14.4679","0.0002","14.7984","0.0002","18.1199","0.0002","90","","90.16","0.001","90","","3879.49","0.09","198","2","198","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C77 H48 Hg2 N2 O18 P2 Re6 S2 -","- C77 H48 Hg2 N2 O18 P2 Re6 S2 -","- C154 H96 Hg4 N4 O36 P4 Re12 S4 -","2","0.5","","Udo Brand; John R. Shapley","Carbidohexarhenate Cluster Cores Bicapped by Mercury with Acetate or Thiolate Ligands","Inorganic Chemistry","2000","39","","32","36","10.1021/ic990722v","","","0.71073","MoKα","","0.0775","0.0466","","0.102","0.0857","","","","1.079","1.133","1.133","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300074","41.691","0.0004","41.691","0.0004","41.691","0.0004","90","","90","","90","","72464.8","1.2","173","2","173","2","","","","","","","","5","I 2 3","I 2 2 3","197","","","","- C138 Mo96 N12 O328 P11 -","- C138 Mo96 N12 O328 P11 -","- C552 Mo384 N48 O1312 P44 -","4","0.166667","","Ulrich Kortz","Polyoxometalate-Diphosphate Complexes. 5.1 Cigar-Shaped 30-Molybdobispyrophosphate: Structure of (N(C4H9)4)2H9[{(P2O7)Mo15O45}2][PMo12O40]","Inorganic Chemistry","2000","39","","623","624","10.1021/ic9907258","","","0.71073","MoKα","","0.0912","0.0848","","","0.2415","0.2485","","","","","","1.181","","","","has coordinates","268283","2021-08-30","06:31:22",""
"4300075","11.5844","0.0003","13.2459","0.0003","14.3433","0.0003","64.019","0.001","79.297","0.001","69.426","0.001","1850.98","0.08","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H36 Cu2 O2 P2 S2 -","- C40 H36 Cu2 O2 P2 S2 -","- C80 H72 Cu4 O4 P4 S4 -","2","1","","Theivanayagam C. Deivaraj; Ghee Xiong Lai; Jagadese J. Vittal","Chemistry of Thiocarboxylates: Synthesis and Structures of Neutral Copper(I) Thiocarboxylates with Triphenylphosphine","Inorganic Chemistry","2000","39","","1028","1034","10.1021/ic9907314","","","0.71073","MoKα","","0.0797","0.0493","","","0.0982","0.1112","","","","","","1.017","","","","has coordinates","130086","2020-10-21","18:00:00",""
"4300076","12.4413","0.0001","15.5443","0.0001","20.4637","0.0003","94.974","0.001","95.976","0.001","100.45","0.001","3848.09","0.07","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C82.5 H67 Cl Cu4 O5 P3 S4 -","- C82.5 H66 Cl Cu4 O5 P3 S4 -","- C165 H132 Cl2 Cu8 O10 P6 S8 -","2","1","","Theivanayagam C. Deivaraj; Ghee Xiong Lai; Jagadese J. Vittal","Chemistry of Thiocarboxylates: Synthesis and Structures of Neutral Copper(I) Thiocarboxylates with Triphenylphosphine","Inorganic Chemistry","2000","39","","1028","1034","10.1021/ic9907314","","","0.71073","MoKα","","0.11","0.058","","","0.1163","0.1365","","","","","","1.027","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4300077","15.2746","0.0002","23.2947","0.0002","19.0518","0.0003","90","","96.713","0.001","90","","6732.48","0.15","293","2","293","2","","","","","","","see text","6","P 1 21/n 1","-P 2yn","14","","","","- C76 H66 Cu2 O2 P4 S2 -","- C76 H66 Cu2 O2 P4 S2 -","- C304 H264 Cu8 O8 P16 S8 -","4","1","","Theivanayagam C. Deivaraj; Ghee Xiong Lai; Jagadese J. Vittal","Chemistry of Thiocarboxylates: Synthesis and Structures of Neutral Copper(I) Thiocarboxylates with Triphenylphosphine","Inorganic Chemistry","2000","39","","1028","1034","10.1021/ic9907314","","","0.71073","MoKα","","0.1144","0.0618","","0.116","0.0996","","","","1.024","1.129","1.129","","","","","has coordinates,has disorder","134621","2020-10-21","18:00:00",""
"4300078","10.2524","0.0003","12.9826","0.0004","14.534","0.0004","87.723","0.001","75.322","0.001","75.978","0.001","1815.14","0.09","293","2","293","2","","","","","","","see text","6","P -1","-P 1","2","","","","- C43 H35 Cu O P2 S -","- C43 H35 Cu O P2 S -","- C86 H70 Cu2 O2 P4 S2 -","2","1","","Theivanayagam C. Deivaraj; Ghee Xiong Lai; Jagadese J. Vittal","Chemistry of Thiocarboxylates: Synthesis and Structures of Neutral Copper(I) Thiocarboxylates with Triphenylphosphine","Inorganic Chemistry","2000","39","","1028","1034","10.1021/ic9907314","","","0.71073","MoKα","","0.0804","0.0499","","0.1094","0.0958","","","","1.02","1.075","1.075","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300079","9.2643","0.0014","12.661","0.008","12.839","0.005","106.09","0.03","77.89","0.02","97.73","0.03","1410.1","1.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H28 Cl O8 Ru2 -","- C24 H28 Cl O8 Ru2 -","- C48 H56 Cl2 O16 Ru4 -","2","1","","M. C. Barral; R. Jiménez-Aparicio; D. Pérez-Quintanilla; J. L. Priego; E. C. Royer; M. R. Torres; F. A. Urbanos","Magnetic Properties of Diruthenium(II,III) Carboxylate Compounds. Crystal Structures of Ru2Cl(μ-O2CCHCHCHCHMe)4 and Ru2Cl(μ-O2CCH2OMe)4","Inorganic Chemistry","2000","39","","65","70","10.1021/ic9907462","","","0.71073","MoKα","","0.0477","0.0239","","0.078","0.0676","","","","0.865","0.853","0.853","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300080","12.132","0.004","11.57","0.002","13.674","0.002","90","","91.18","0.02","90","","1919","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H20 Cl O12 Ru2 -","- C12 H20 Cl O12 Ru2 -","- C48 H80 Cl4 O48 Ru8 -","4","1","","M. C. Barral; R. Jiménez-Aparicio; D. Pérez-Quintanilla; J. L. Priego; E. C. Royer; M. R. Torres; F. A. Urbanos","Magnetic Properties of Diruthenium(II,III) Carboxylate Compounds. Crystal Structures of Ru2Cl(μ-O2CCHCHCHCHMe)4 and Ru2Cl(μ-O2CCH2OMe)4","Inorganic Chemistry","2000","39","","65","70","10.1021/ic9907462","","","0.71073","MoKα","","0.0734","0.0347","","0.1415","0.1021","","","","0.711","0.619","0.619","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300081","14.231","0.01","14.227","0.009","10.24","0.01","90.07","0.09","90.15","0.09","120.04","0.03","1795","2","298.2","","298.2","","","","","","","","","6","P 31","P 31","144","","","","- C9 H27 O9 P3 Ru S5 -","- C9 O9 P3 Ru S5 -","- C27 O27 P9 Ru3 S15 -","3","1","","Md. Munkir Hossain; Kazuko Matsumoto","Pentasulfide S52- as the First Tridentate Chelating Ligand in Ru(P(OE)3)3S5 (E = Me and Et)","Inorganic Chemistry","2000","39","","247","250","10.1021/ic990764j","","","0.7107","MoK/a","","0.0763","0.0763","","","0.0768","0.0768","","","","","","5.637","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300082","15.393","0.005","18.126","0.006","12.421","0.004","90","","90","","90","","3466","2","298.2","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C18 H45 O9 P3 Ru S5 -","- C18 O9 P3 Ru S5 -","- C72 O36 P12 Ru4 S20 -","4","1","","Md. Munkir Hossain; Kazuko Matsumoto","Pentasulfide S52- as the First Tridentate Chelating Ligand in Ru(P(OE)3)3S5 (E = Me and Et)","Inorganic Chemistry","2000","39","","247","250","10.1021/ic990764j","","","0.7107","MoKα","","","0.0479","","","","0.0528","","","","","","2.685","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300083","8.684","0.001","11.074","0.001","11.174","0.001","66.11","0.01","71.44","0.01","87.92","0.01","926.07","0.19","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C40 H58 N2 Ti2 -","- C40 H58 N2 Ti2 -","- C40 H58 N2 Ti2 -","1","0.5","","Angel Abarca; Pilar Gómez-Sal; Avelino Martín; Miguel Mena; Josep María Poblet; Carlos Yélamos","Ammonolysis of Mono(pentamethylcyclopentadienyl) Titanium(IV) Derivatives","Inorganic Chemistry","2000","39","","642","651","10.1021/ic9907718","","","0.71073","MoKα","","0.076","0.0483","","","0.1366","0.177","","","","","","0.577","","","","has coordinates","120081","2020-10-21","18:00:00",""
"4300084","28.272","0.006","8.452","0.002","22.26","0.004","90","","111.85","0.03","90","","4937","2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H33 Cl3 N2 Ti2 -","- C20 H33 Cl3 N2 Ti2 -","- C160 H264 Cl24 N16 Ti16 -","8","1","","Angel Abarca; Pilar Gómez-Sal; Avelino Martín; Miguel Mena; Josep María Poblet; Carlos Yélamos","Ammonolysis of Mono(pentamethylcyclopentadienyl) Titanium(IV) Derivatives","Inorganic Chemistry","2000","39","","642","651","10.1021/ic9907718","","","0.71073","MOKa","","0.0756","0.0333","","0.0951","0.0806","","","","0.966","1.019","1.019","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300085","12.7642","0.0005","24.1725","0.0009","19.4012","0.0007","90","","103.564","0.001","90","","5819.1","0.4","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C16 H48 Ag3 La O8 S8 Se12 W3 -","- C16 H48 Ag3 La O8 S8 Se12 W3 -","- C64 H192 Ag12 La4 O32 S32 Se48 W12 -","4","1","","Qian-Feng Zhang; Wa-Hung Leung; Xin; Hoong-Kun Fun","Heterometallic Polymeric Clusters Containing Tetraselenotungstate Anion: One-Dimensional Helical Chain {[La(Me2SO)8][(μ-WSe4)3Ag3]}n and Cyanide-Bridged Three-Dimensional Cross-Framework {[Et4N]2[(μ4-WSe4)Cu4(CN)4]}n","Inorganic Chemistry","2000","39","","417","426","10.1021/ic990780g","","","0.71073","MoKα","","0.1251","0.054","","","0.1116","0.136","","","","","","0.945","","","","has coordinates,has disorder","179038","2020-10-21","18:00:00",""
"4300086","11.09","0.002","23.206","0.005","23.91","0.005","90","","90","","90","","6153","2","293","2","293","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C20 H40 Cu4 N6 Se4 W -","- C20 Cu4 N6 Se4 W -","- C160 Cu32 N48 Se32 W8 -","8","0.25","","Qian-Feng Zhang; Wa-Hung Leung; Xin; Hoong-Kun Fun","Heterometallic Polymeric Clusters Containing Tetraselenotungstate Anion: One-Dimensional Helical Chain {[La(Me2SO)8][(μ-WSe4)3Ag3]}n and Cyanide-Bridged Three-Dimensional Cross-Framework {[Et4N]2[(μ4-WSe4)Cu4(CN)4]}n","Inorganic Chemistry","2000","39","","417","426","10.1021/ic990780g","","","0.71073","MoKα","","0.0799","0.0428","","0.0983","0.0887","","","","0.959","1.062","1.062","","","","","has coordinates","179038","2020-10-21","18:00:00",""
"4300087","19.114","0.002","16.746","0.001","15.6554","0.001","90","","110.92","0.01","90","","4680.7","0.7","213","2","213","2","","","","","","","synthesis","7","C 1 2/c 1","-C 2yc","15","","","","- C42 H36 B Cl5 Cr3 F4 N12 -","- C42 H36 B Cl5 Cr3 F4 N12 -","- C168 H144 B4 Cl20 Cr12 F16 N48 -","4","0.5","","Rodolphe Clérac; F. Albert Cotton; Lee M. Daniels; Kim R. Dunbar; Carlos A. Murillo; Isabel Pascual","Linear Trichromium Complexes with Direct Cr to Cr Contacts. 1. Compounds with Cr3(dipyridylamide)42+ Cores","Inorganic Chemistry","2000","39","","748","751","10.1021/ic990793u","","","0.71073","MoKα","","0.0378","0.0354","","0.0924","0.0898","","","","1.093","1.106","1.106","","","","","has coordinates,has disorder","134621","2020-10-21","18:00:00",""
"4300088","19.126","0.003","16.962","0.001","15.515","0.001","90","","109.8","0.01","90","","4735.7","0.9","213","2","213","2","","","","","","","synthesis","7","C 1 2/c 1","-C 2yc","15","","","","- C42 H36 Cl5 Cr3 F6 N12 P -","- C42 H32 Cl5 Cr3 F6 N12 P -","- C168 H128 Cl20 Cr12 F24 N48 P4 -","4","0.5","","Rodolphe Clérac; F. Albert Cotton; Lee M. Daniels; Kim R. Dunbar; Carlos A. Murillo; Isabel Pascual","Linear Trichromium Complexes with Direct Cr to Cr Contacts. 1. Compounds with Cr3(dipyridylamide)42+ Cores","Inorganic Chemistry","2000","39","","748","751","10.1021/ic990793u","","","0.71073","MoKα","","0.0507","0.0475","","0.1277","0.1242","","","","1.143","1.163","1.163","","","","","has coordinates,has disorder","134621","2020-10-21","18:00:00",""
"4300089","18.634","0.005","29.357","0.017","16.142","0.003","90","","90","","90","","8830","6","213","2","213","2","","","","","","","synthesis","5","P n a 21","P 2c -2n","33","","","","- C46 H38 Cl2 Cr3 N12 -","- C46 H38 Cl2 Cr3 N12 -","- C368 H304 Cl16 Cr24 N96 -","8","2","","Rodolphe Clérac; F. Albert Cotton; Lee M. Daniels; Kim R. Dunbar; Carlos A. Murillo; Isabel Pascual","Linear Trichromium Complexes with Direct Cr to Cr Contacts. 1. Compounds with Cr3(dipyridylamide)42+ Cores","Inorganic Chemistry","2000","39","","748","751","10.1021/ic990793u","","","0.71073","MoKα","","0.0702","0.0536","","0.1366","0.1195","","","","1.137","1.096","1.096","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300090","18.475","0.002","14.965","0.004","16.469","0.0013","90","","90","","90","","4553.3","1.4","213","2","213","2","","","","","","","synthesis","5","P c a 21","P 2c -2ac","29","","","","- C47 H40 Cl2 Cr3 N12 -","- C47 H40 Cl2 Cr3 N12 -","- C188 H160 Cl8 Cr12 N48 -","4","1","","Rodolphe Clérac; F. Albert Cotton; Lee M. Daniels; Kim R. Dunbar; Carlos A. Murillo; Isabel Pascual","Linear Trichromium Complexes with Direct Cr to Cr Contacts. 1. Compounds with Cr3(dipyridylamide)42+ Cores","Inorganic Chemistry","2000","39","","748","751","10.1021/ic990793u","","","0.71073","MoKα","","0.0628","0.0499","","0.1236","0.1127","","","","1.063","1.053","1.053","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300091","12.996","0.002","14.1381","0.0008","11.3306","0.0013","90","","90","","90","","2081.9","0.4","213","2","213","2","","","","","","","synthesis","5","P n n 2","P 2 -2n","34","","","","- C41 H34 Cl4 Cr3 N12 -","- C41 H31 Cl4 Cr3 N12 -","- C82 H62 Cl8 Cr6 N24 -","2","0.5","","Rodolphe Clérac; F. Albert Cotton; Lee M. Daniels; Kim R. Dunbar; Carlos A. Murillo; Isabel Pascual","Linear Trichromium Complexes with Direct Cr to Cr Contacts. 1. Compounds with Cr3(dipyridylamide)42+ Cores","Inorganic Chemistry","2000","39","","748","751","10.1021/ic990793u","","","0.71073","MoKα","","0.0528","0.0444","","0.1176","0.1091","","","","1.11","1.093","1.093","","","","","has coordinates,has disorder","134621","2020-10-21","18:00:00",""
"4300092","14.414","0.002","14.414","0.002","10.585","0.001","90","","90","","90","","2199.2","0.5","295","2","295","2","","","","","","","synthesis","6","P -4 n 2","P -4 -2n","118","","","","- C44 H40 Cl2 Cr3 N12 O -","- C45.04 H32 Cl2 Cr3 N12 -","- C90.08 H64 Cl4 Cr6 N24 -","2","0.25","","Rodolphe Clérac; F. Albert Cotton; Lee M. Daniels; Kim R. Dunbar; Carlos A. Murillo; Isabel Pascual","Linear Trichromium Complexes with Direct Cr to Cr Contacts. 1. Compounds with Cr3(dipyridylamide)42+ Cores","Inorganic Chemistry","2000","39","","748","751","10.1021/ic990793u","","","1.54184","CuKα","","0.1448","0.0719","","0.1881","0.1469","","","","1.077","1.131","1.131","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300093","16.849","0.005","15.46","0.007","20.479","0.003","90","","110.96","0.03","90","","4982","3","213","2","213","2","","","","","","","synthesis","4","P 1 21/c 1","-P 2ybc","14","","","","- C56 H42 Cr3 N12 -","- C56 H42 Cr3 N12 -","- C224 H168 Cr12 N48 -","4","1","","Rodolphe Clérac; F. Albert Cotton; Lee M. Daniels; Kim R. Dunbar; Carlos A. Murillo; Isabel Pascual","Linear Trichromium Complexes with Direct Cr to Cr Contacts. 1. Compounds with Cr3(dipyridylamide)42+ Cores","Inorganic Chemistry","2000","39","","748","751","10.1021/ic990793u","","","0.71073","MoKα","","0.0987","0.0701","","0.1967","0.1644","","","","1.081","1.095","1.095","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4300094","17.442","0.004","11.375","0.002","28.162","0.006","90","","93.54","0.03","90","","5577","2","140","2","140","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","(Me4N)[Co(PyPePS)2].0.5H2O","","","- C28 H29 Co N5 O2.5 S2 -","- C28 H29 Co N5 O2.5 S2 -","- C224 H232 Co8 N40 O20 S16 -","8","1","","Laurie A. Tyler; Juan C. Noveron; Marilyn M. Olmstead; Pradip K. Mascharak","Co(III) Complexes with Coordinated Carboxamido Nitrogens and Thiolato Sulfurs as Models for Co-Containing Nitrile Hydratase and Their Conversion to the Corresponding Sulfinato Species","Inorganic Chemistry","2000","39","","357","362","10.1021/ic990794m","","","0.71073","MoKα","","0.115","0.0588","","","0.1139","0.1388","","","","","","0.985","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300095","21.51","0.004","13.485","0.002","10.0512","0.0016","90","","90","","90","","2915.5","0.8","140","2","140","2","","","","","","","","6","P n a 21","P 2c -2n","33","(Me4N)[Co(PyPePRS)2].CH3CN","","","- C26 H39 Co N6 O2 S2 -","- C26 H39 Co N6 O2 S2 -","- C104 H156 Co4 N24 O8 S8 -","4","1","","Laurie A. Tyler; Juan C. Noveron; Marilyn M. Olmstead; Pradip K. Mascharak","Co(III) Complexes with Coordinated Carboxamido Nitrogens and Thiolato Sulfurs as Models for Co-Containing Nitrile Hydratase and Their Conversion to the Corresponding Sulfinato Species","Inorganic Chemistry","2000","39","","357","362","10.1021/ic990794m","","","0.71073","MoKα","","0.0441","0.0343","","","0.0719","0.0766","","","","","","1.012","","","","has coordinates","120081","2020-10-21","18:00:00",""
"4300096","15.05","0.003","11.333","0.002","16.478","0.003","90","","97.06","0.02","90","","2789.2","0.9","140","2","140","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","Na[Co(PyPepSo2)2].2CH3OH.H2O","","","- C26 H26 Co N4 Na O9 S2 -","- C26 H26 Co N4 Na O9 S2 -","- C104 H104 Co4 N16 Na4 O36 S8 -","4","1","","Laurie A. Tyler; Juan C. Noveron; Marilyn M. Olmstead; Pradip K. Mascharak","Co(III) Complexes with Coordinated Carboxamido Nitrogens and Thiolato Sulfurs as Models for Co-Containing Nitrile Hydratase and Their Conversion to the Corresponding Sulfinato Species","Inorganic Chemistry","2000","39","","357","362","10.1021/ic990794m","","","0.71073","MoKα","","0.0604","0.0405","","","0.0844","0.0935","","","","","","1.017","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4300097","9.7489","0.0011","13.1151","0.0013","20.998","0.003","90","","100.481","0.011","90","","2640","0.6","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","Na[Co(PyPePRSO2)2].H2O.CH3OH","","","- C21 H30 Co N4 Na O8 S2 -","- C21 H30 Co N4 Na O8 S2 -","- C84 H120 Co4 N16 Na4 O32 S8 -","4","1","","Laurie A. Tyler; Juan C. Noveron; Marilyn M. Olmstead; Pradip K. Mascharak","Co(III) Complexes with Coordinated Carboxamido Nitrogens and Thiolato Sulfurs as Models for Co-Containing Nitrile Hydratase and Their Conversion to the Corresponding Sulfinato Species","Inorganic Chemistry","2000","39","","357","362","10.1021/ic990794m","","","0.71073","MoKα","","0.103","0.0451","","","0.0934","0.1175","","","","","","0.89","","","","has coordinates,has disorder","120081","2020-10-21","18:00:00",""
"4300098","18.602","0.003","18.964","0.004","21.684","0.009","89.79","0.03","88.02","0.02","71.9","0.02","7266","4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C99 H101 Cl5 Cu4 N12 O41 -","- C99 H101 Cl5 Cu4 N12 O41 -","- C198 H202 Cl10 Cu8 N24 O82 -","2","1","","O. Danny Fox; N. Kent Dalley; Roger G. Harrison","Synthesis and Characterization of a Novel Tetranuclear Copper(II) Resorc[4]arene Complex Possessing Four Structurally Different Copper Centers","Inorganic Chemistry","2000","39","","620","622","10.1021/ic990798r","","","0.71073","MoKα","","0.1323","0.1056","","","0.3058","0.3365","","","","","","1.42","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300099","9.48","0.006","10.243","0.008","11.232","0.006","86.76","0.04","66.62","0.05","83.92","0.04","995.4","1.2","294","","","","","","","","","","","5","P -1","-P 1","2","","","","- C36 H30 Cl10 Cu3 P2 -","- C36.16 H30.16 Cl10 Cu3 P2 -","- C36.16 H30.16 Cl10 Cu3 P2 -","1","0.5","","Susan Lorenzo; Caitlin Horn; Donald Craig; Marcia Scudder; Ian Dance","Crystal Supramolecular Motifs: Columns of Embracing Ph3PMe+ or Ph3PCl+ Cations Controlling Formation of [Cu3X82- (X = Cl, Br)","Inorganic Chemistry","2000","39","","401","405","10.1021/ic990803r","","","0.71073","MoKα","","","0.026","","","","0.043","","","","","","1.6","","","","has coordinates","192057","2020-10-21","18:00:00",""
"4300100","9.795","0.004","10.472","0.004","11.392","0.004","86.67","0.03","66.67","0.03","83.14","0.03","1065.2","0.7","294","","","","","","","","","","","5","P -1","-P 1","2","","","","- C38 H36 Br8 Cu3 P2 -","- C38 H36 Br8 Cu3 P2 -","- C38 H36 Br8 Cu3 P2 -","1","0.5","","Susan Lorenzo; Caitlin Horn; Donald Craig; Marcia Scudder; Ian Dance","Crystal Supramolecular Motifs: Columns of Embracing Ph3PMe+ or Ph3PCl+ Cations Controlling Formation of [Cu3X82- (X = Cl, Br)","Inorganic Chemistry","2000","39","","401","405","10.1021/ic990803r","","","0.71073","MoKα","","","0.026","","","","0.036","","","","","","1.41","","","","has coordinates","192057","2020-10-21","18:00:00",""
"4300101","13.655","0.006","17.009","0.004","16.145","0.008","90","","120.49","0.02","90","","3231","2","294","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C37 H31 Cl3 P2 -","- C37 H31 Cl3 P2 -","- C148 H124 Cl12 P8 -","4","1","","Susan Lorenzo; Caitlin Horn; Donald Craig; Marcia Scudder; Ian Dance","Crystal Supramolecular Motifs: Columns of Embracing Ph3PMe+ or Ph3PCl+ Cations Controlling Formation of [Cu3X82- (X = Cl, Br)","Inorganic Chemistry","2000","39","","401","405","10.1021/ic990803r","","","0.71073","MoKα","","","0.058","","","","0.077","","","","","","2.13","","","","has coordinates","192057","2020-10-21","18:00:00",""
"4300102","10.865","0.002","17.006","0.002","18.572","0.002","90","","100.44","0.01","90","","3374.7","0.8","296.2","","296.2","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C36 H37 Ir N O P S2 -","- C36 H37 Ir N O P S2 -","- C144 H148 Ir4 N4 O4 P4 S8 -","4","1","","Shoji Matsukawa; Shigeki Kuwata; Masanobu Hidai","Syntheses, Structures, and Reactivities of Mono- and Dinuclear Iridium Thiolato Complexes Containing Nitrosyl Ligands","Inorganic Chemistry","2000","39","","791","798","10.1021/ic990805b","","","0.7107","MoKα","","0.0369","0.0369","","","0.0369","0.0369","","","","","","2.235","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300103","10.217","0.001","11.448","0.002","23.81","0.004","87.36","0.01","87.84","0.01","74.79","0.01","2683.6","0.7","296.2","","296.2","","","","","","","","","7","P -1","-P 1","2","","","","- C48 H58 Ir2 N2 O2 P2 S4 -","- C48 H58 Ir2 N2 O2 P2 S4 -","- C96 H116 Ir4 N4 O4 P4 S8 -","2","1","","Shoji Matsukawa; Shigeki Kuwata; Masanobu Hidai","Syntheses, Structures, and Reactivities of Mono- and Dinuclear Iridium Thiolato Complexes Containing Nitrosyl Ligands","Inorganic Chemistry","2000","39","","791","798","10.1021/ic990805b","","","0.7107","MoKα","","0.0466","0.0466","","","0.0433","0.0433","","","","","","1.727","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300104","12.538","0.003","24.206","0.002","15.678","0.003","90","","93.64","0.02","90","","4748.6","1.5","296.2","","296.2","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C45 H50 Cl2 Ir2 N2 O2 P2 S2 -","- C45 H50 Cl2 Ir2 N2 O2 P2 S2 -","- C180 H200 Cl8 Ir8 N8 O8 P8 S8 -","4","1","","Shoji Matsukawa; Shigeki Kuwata; Masanobu Hidai","Syntheses, Structures, and Reactivities of Mono- and Dinuclear Iridium Thiolato Complexes Containing Nitrosyl Ligands","Inorganic Chemistry","2000","39","","791","798","10.1021/ic990805b","","","0.7107","MoKα","","0.0461","0.0461","","","0.0461","0.0461","","","","","","1.76","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300105","12.71","0.003","13.838","0.003","16.732","0.002","93.18","0.01","91.66","0.01","117.33","0.01","2605.4","0.9","296.2","","296.2","","","","","","","","","8","P -1","-P 1","2","","","","- C47 H57 Cl4 Ir2 N O2 P2 S3 -","- C47 H56 Cl4 Ir2 N O2 P2 S3 -","- C94 H112 Cl8 Ir4 N2 O4 P4 S6 -","2","1","","Shoji Matsukawa; Shigeki Kuwata; Masanobu Hidai","Syntheses, Structures, and Reactivities of Mono- and Dinuclear Iridium Thiolato Complexes Containing Nitrosyl Ligands","Inorganic Chemistry","2000","39","","791","798","10.1021/ic990805b","","","0.7107","MoKα","","0.032","0.032","","","0.0342","0.0342","","","","","","2.43","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300106","23.296","0.002","14.912","0.002","19.719","0.002","90","","101.492","0.009","90","","6712.9","1.3","296.2","","296.2","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C72 H72 Cl2 Ir2 P2 S4 -","- C72 H72 Cl2 Ir2 P2 S4 -","- C288 H288 Cl8 Ir8 P8 S16 -","4","1","","Shoji Matsukawa; Shigeki Kuwata; Masanobu Hidai","Syntheses, Structures, and Reactivities of Mono- and Dinuclear Iridium Thiolato Complexes Containing Nitrosyl Ligands","Inorganic Chemistry","2000","39","","791","798","10.1021/ic990805b","","","0.7107","MoKα","","0.0398","0.0398","","","0.0439","0.0439","","","","","","1.559","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300107","10.215","0.004","17.634","0.007","22.473","0.008","90","","97.67","0.03","90","","4012","3","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C47 H38 Br N4 O Os P2 -","- C47 H38 Br N4 O Os P2 -","- C188 H152 Br4 N16 O4 Os4 P8 -","4","1","","Kausikisankar Pramanik; Maya Shivakumar; Prasanta Ghosh; Animesh Chakravorty","Azo Anion Radical Complexes of Osmium and Related Nonradical Species","Inorganic Chemistry","2000","39","","195","199","10.1021/ic9908322","","","0.71073","MoKα","","0.1697","0.0866","","0.2689","0.2012","","","","1.032","1.066","1.066","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4300108","15.323","0.007","15.201","0.006","19.542","0.007","90","","92.51","0.03","90","","4547","3","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C49 H42 Br Cl2 N3 O Os P2 -","- C49 H42 Br Cl2 N3 O Os P2 -","- C196 H168 Br4 Cl8 N12 O4 Os4 P8 -","4","1","","Kausikisankar Pramanik; Maya Shivakumar; Prasanta Ghosh; Animesh Chakravorty","Azo Anion Radical Complexes of Osmium and Related Nonradical Species","Inorganic Chemistry","2000","39","","195","199","10.1021/ic9908322","","","0.71073","MoKα","","0.1233","0.0629","","0.1734","0.1424","","","","1.058","1.13","1.13","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4300109","8.093","0.001","12.975","0.001","6.914","0.001","87.64","0.01","88.38","0.01","86.39","0.01","723.72","0.15","296","2","296.2","","","","","","","","","5","P -1","-P 1","2","","","","- C12 H11 Cl3 N3 Ru -","- C12 H11 Cl3 N3 Ru -","- C24 H22 Cl6 N6 Ru2 -","2","1","","Dusan Hesek; Yoshihisa Inoue; Simon R. L. Everitt; Hitoshi Ishida; Mieko Kunieda; Michael G. B. Drew","Novel Synthetic Routes to Several New, Differentially Substituted Ruthenium Tris(4,4'-disubstituted-2,2-bipyridine) Complexes","Inorganic Chemistry","2000","39","","308","316","10.1021/ic990840i","","","0.7107","MoKα","","0.0447","0.0356","","","0.1065","0.1185","","","","","","1.115","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4300110","10.314","0.009","25.82","0.016","12.191","0.011","90","","103.405","0.01","90","","3158","4","293","2","293","2","","","","","","","","8","P 1 21 1","P 2yb","4","","","","- C54 H50 Cl6 F12 N8 O2 P2 Ru -","- C54 H50 Cl6 F12 N8 O2 P2 Ru -","- C108 H100 Cl12 F24 N16 O4 P4 Ru2 -","2","1","","Dusan Hesek; Yoshihisa Inoue; Simon R. L. Everitt; Hitoshi Ishida; Mieko Kunieda; Michael G. B. Drew","Novel Synthetic Routes to Several New, Differentially Substituted Ruthenium Tris(4,4'-disubstituted-2,2-bipyridine) Complexes","Inorganic Chemistry","2000","39","","308","316","10.1021/ic990840i","","","0.71073","MoKα","","0.1092","0.0627","","","0.1696","0.2007","","","","","","0.982","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300111","13.8956","0.0004","13.8956","0.0004","13.8956","0.0004","90","","90","","90","","2683.07","0.13","213","2","213","2","","","","","","","","5","I m -3 m","-I 4 2 3","229","","","","- Be Cl18 H53 O24 Zr6 -","- Be Cl18 O24 Zr6 -","- Be2 Cl36 O48 Zr12 -","2","0.0208333","","Xiaobing Xie; Timothy Hughbanks","Reduced Zirconium Halide Clusters in Aqueous Solution","Inorganic Chemistry","2000","39","","555","561","10.1021/ic9908423","","","0.71073","MoKα","","0.0451","0.0245","","0.0734","0.0687","","","","1.078","1.185","1.185","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300112","14.029","0.003","14.029","0.003","14.029","0.003","90","","90","","90","","2761.1","1","213","2","213","2","","","","","","","","5","I m -3 m","-I 4 2 3","229","","","","- Cl18 H53 Mn O24 Zr6 -","- Cl18 Mn O24 Zr6 -","- Cl36 Mn2 O48 Zr12 -","2","0.0208333","","Xiaobing Xie; Timothy Hughbanks","Reduced Zirconium Halide Clusters in Aqueous Solution","Inorganic Chemistry","2000","39","","555","561","10.1021/ic9908423","","","0.71073","MoKα","","0.0463","0.0278","","0.0825","0.0692","","","","1.195","1.262","1.262","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300113","11.5375","0.0002","11.5375","0.0002","15.7169","0.0004","90","","90","","90","","2092.14","0.07","213","2","213","2","","","","","","","","5","P 42/m n m","-P 4n 2n","136","","","","- B Cl18 H38.45 O16.97 Zr6 -","- B Cl18 O16.96 Zr6 -","- B2 Cl36 O33.92 Zr12 -","2","0.125","","Xiaobing Xie; Timothy Hughbanks","Reduced Zirconium Halide Clusters in Aqueous Solution","Inorganic Chemistry","2000","39","","555","561","10.1021/ic9908423","","","0.71073","MoKα","","0.0529","0.0259","","0.0712","0.0574","","","","0.988","1.109","1.109","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300114","11.7288","0.0006","11.7288","0.0006","15.9307","0.0012","90","","90","","90","","2191.5","0.2","213","2","213","2","","","","","","","","6","P 42/m n m","-P 4n 2n","136","","","","- B Br6 Cl12 H38 O17 Zr6 -","- B Br6 Cl12 H2 O17.14 Zr6 -","- B2 Br12 Cl24 H4 O34.28 Zr12 -","2","0.125","","Xiaobing Xie; Timothy Hughbanks","Reduced Zirconium Halide Clusters in Aqueous Solution","Inorganic Chemistry","2000","39","","555","561","10.1021/ic9908423","","","0.71073","MoKα","","0.0509","0.0241","","0.0613","0.0581","","","","0.943","1.101","1.101","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300115","13.8962","0.0003","13.8962","0.0003","13.8962","0.0003","90","","90","","90","","2683.42","0.1","213","2","213","2","","","","","","","","6","I m -3 m","-I 4 2 3","229","","","","- B Cl18 H52.5 O24 Rb0.44 Zr6 -","- B Cl18 O24 Rb0.432 Zr6 -","- B2 Cl36 O48 Rb0.864 Zr12 -","2","0.0208333","","Xiaobing Xie; Timothy Hughbanks","Reduced Zirconium Halide Clusters in Aqueous Solution","Inorganic Chemistry","2000","39","","555","561","10.1021/ic9908423","","","0.71073","MoKα","","0.0413","0.0264","","","0.0646","0.0669","","","","","","1.109","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300116","14.384","0.004","10.265","0.005","23.571","0.005","90","","90","","90","","3480","2","293","2","293","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","rac-(mu!2$-Oxo)-bis[dichloro-(1,5,6-trimethylbenzimidazole)-(pyridine) -oxo-rhenium(v)]","","- C30 H34 Cl4 N6 O3 Re2 -","- C30 H34 Cl4 N6 O3 Re2 -","- C120 H136 Cl16 N24 O12 Re8 -","4","0.5","","Enzo Alessio; Ennio Zangrando; Elisabetta Iengo; Michela Macchi; Patricia A. Marzilli; Luigi G. Marzilli","Understanding the Orientation and Dynamic Motion of Planar Heterocyclic N-Donor Ligands by Exploiting the Symmetry Properties of Mixed-Ligand μ-Oxorhenium(V) Dinuclear Complexes [ReOCl2(L)(L')]-O-[ReOCl2(L)(L')]: A Combined X-ray Structural and Dynamic NMR Investigation","Inorganic Chemistry","2000","39","","294","303","10.1021/ic990858t","","","0.71073","MoKα","","0.1816","0.0628","","0.0965","0.0831","","","","0.836","1.154","1.154","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300117","17.113","0.003","20.744","0.004","23.302","0.006","90","","90","","90","","8272","3","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","meso-(mu!2$-Oxo)-bis[dichloro-(1,5,6-trimethylbenzimidazole)-(3,5-luti dine)-oxo-rhenium(v)] acetone solvate","","- C35.5 H45 Cl4 N6 O3.5 Re2 -","- C35.5 H41 Cl4 N6 O3.5 Re2 -","- C284 H328 Cl32 N48 O28 Re16 -","8","1","","Enzo Alessio; Ennio Zangrando; Elisabetta Iengo; Michela Macchi; Patricia A. Marzilli; Luigi G. Marzilli","Understanding the Orientation and Dynamic Motion of Planar Heterocyclic N-Donor Ligands by Exploiting the Symmetry Properties of Mixed-Ligand μ-Oxorhenium(V) Dinuclear Complexes [ReOCl2(L)(L')]-O-[ReOCl2(L)(L')]: A Combined X-ray Structural and Dynamic NMR Investigation","Inorganic Chemistry","2000","39","","294","303","10.1021/ic990858t","","","0.8","synchrotron","","0.0582","0.0522","","0.1385","0.1354","","","","1.097","1.146","1.146","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300118","12.6295","0.0007","20.7874","0.0009","18.3301","0.0013","90","","90","","90","","4812.3","0.5","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C17 H23 Cu Gd N6 O12 -","- C17 H23 Cu Gd N6 O12 -","- C136 H184 Cu8 Gd8 N48 O96 -","8","1","","Jean-Pierre Costes; Françoise Dahan; Arnaud Dupuis; Jean-Pierre Laurent","Is Ferromagnetism an Intrinsic Property of the CuII/GdIIICouple? 1. Structures and Magnetic Properties of Two Novel Dinuclear Complexes with a μ-Phenolato-μ-Oximato (Cu,Gd) Core","Inorganic Chemistry","2000","39","","169","173","10.1021/ic990864p","","","0.71073","MoKα","","0.0573","0.0264","","","0.0535","0.0678","","","","","","1.069","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300119","12.7246","0.0016","13.5691","0.0017","14.531","0.0019","90","","94.629","0.016","90","","2500.8","0.6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H25 Cu Gd N6 O14 -","- C16 H25 Cu Gd N6 O14 -","- C64 H100 Cu4 Gd4 N24 O56 -","4","1","","Jean-Pierre Costes; Françoise Dahan; Arnaud Dupuis; Jean-Pierre Laurent","Is Ferromagnetism an Intrinsic Property of the CuII/GdIIICouple? 1. Structures and Magnetic Properties of Two Novel Dinuclear Complexes with a μ-Phenolato-μ-Oximato (Cu,Gd) Core","Inorganic Chemistry","2000","39","","169","173","10.1021/ic990864p","","","0.71073","MoKα","","0.0364","0.0279","","","0.0578","0.0608","","","","","","1.157","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300120","9.0246","0.0011","16.5198","0.0014","20.286","0.002","90","","90","","90","","3024.3","0.5","293","2","293","2","","","","","","","","7","P c a 21","P 2c -2ac","29","","","","- C21 H36 Cl3 Cu Gd N2 O10 -","- C21 H36 Cl3 Cu Gd N2 O10 -","- C84 H144 Cl12 Cu4 Gd4 N8 O40 -","4","1","","Jean-Pierre Costes; Françoise Dahan; Arnaud Dupuis","Influence of Anionic Ligands (X) on the Nature and Magnetic Properties of Dinuclear LCuGdX3.nH2O Complexes (LH2 Standing for Tetradentate Schiff Base Ligands Deriving from 2-Hydroxy-3-methoxybenzaldehyde and X Being Cl, N3C2, and CF3COO)","Inorganic Chemistry","2000","39","","165","168","10.1021/ic990865h","","","0.71073","MoKα","","0.0314","0.021","","","0.0513","0.0553","","","","","","0.979","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300121","9.6185","0.0014","24.159","0.003","13.256","0.002","90","","105.347","0.012","90","","2970.5","0.7","213","2","213","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","[Mo(S2C2Me2)3](Et4N)(MeCN)","","- C22 H41 Mo N2 S6 -","- C22 H41 Mo N2 S6 -","- C88 H164 Mo4 N8 S24 -","4","1","","Booyong S. Lim; James P. Donahue; R. H. Holm","Synthesis and Structures of Bis(dithiolene)molybdenum Complexes Related to the Active Sites of the DMSO Reductase Enzyme Family","Inorganic Chemistry","2000","39","","263","273","10.1021/ic9908672","","","0.71073","MoKα","","0.0745","0.0438","","0.1319","0.1161","","","","1.025","1.093","1.093","","","","","has coordinates,has disorder","134621","2020-10-21","18:00:00",""
"4300122","9.476","0.003","19.967","0.004","19.285","0.006","90","","97.75","0.03","90","","3615.5","1.8","213","2","213","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","[Mo(CO)(SePh)(S2C2Me2)2](Bu4N)","","- C31 H53 Mo N O S4 Se -","- C31 H53 Mo N O S4 Se -","- C124 H212 Mo4 N4 O4 S16 Se4 -","4","1","","Booyong S. Lim; James P. Donahue; R. H. Holm","Synthesis and Structures of Bis(dithiolene)molybdenum Complexes Related to the Active Sites of the DMSO Reductase Enzyme Family","Inorganic Chemistry","2000","39","","263","273","10.1021/ic9908672","","","0.71073","MoKα","","0.1314","0.0535","","0.0968","0.0806","","","","1.05","1.209","1.209","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300123","13.1097","0.001","13.9789","0.0015","16.694","0.0014","90","","94.558","0.007","90","","3049.7","0.5","213","2","213","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[MoO(S2C2Me2)2](Et4N)2","","- C24 H52 Mo N2 O S4 -","- C24 H52 Mo N2 O S4 -","- C96 H208 Mo4 N8 O4 S16 -","4","1","","Booyong S. Lim; James P. Donahue; R. H. Holm","Synthesis and Structures of Bis(dithiolene)molybdenum Complexes Related to the Active Sites of the DMSO Reductase Enzyme Family","Inorganic Chemistry","2000","39","","263","273","10.1021/ic9908672","","","0.71073","MoKα","","0.0453","0.0301","","0.0814","0.0769","","","","1.089","1.163","1.163","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300124","9.5576","0.0012","19.684","0.002","19.248","0.002","90","","98.081","0.007","90","","3585.2","0.7","213","2","213","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[Mo(CO)(S2C2Me2)2](Bu4N)","","- C31 H53 Mo N O S5 -","- C31 H53 Mo N O S5 -","- C124 H212 Mo4 N4 O4 S20 -","4","1","","Booyong S. Lim; James P. Donahue; R. H. Holm","Synthesis and Structures of Bis(dithiolene)molybdenum Complexes Related to the Active Sites of the DMSO Reductase Enzyme Family","Inorganic Chemistry","2000","39","","263","273","10.1021/ic9908672","","","0.71073","MoKα","","0.0982","0.0445","","0.0796","0.0706","","","","1.114","1.289","1.289","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300125","11.609","0.003","29.268","0.01","26.953","0.008","90","","101.23","0.02","90","","8983","5","213","2","213","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","[Mo2(??SePh)2(S2C2Ph2)4](Et4N)2(2MeCN)(Et2O)","","- C92 H106 Mo2 N4 O S8 Se2 -","- C92 H106 Mo2 N4 O S8 Se2 -","- C368 H424 Mo8 N16 O4 S32 Se8 -","4","1","","Booyong S. Lim; James P. Donahue; R. H. Holm","Synthesis and Structures of Bis(dithiolene)molybdenum Complexes Related to the Active Sites of the DMSO Reductase Enzyme Family","Inorganic Chemistry","2000","39","","263","273","10.1021/ic9908672","","","0.71073","MoKα","","0.0919","0.0442","","","0.08","0.0995","","","","","","1.09","","","","has coordinates,has disorder","120081","2020-10-21","18:00:00",""
"4300126","12.7822","0.0001","12.7822","0.0001","27.3827","0.0003","90","","90","","90","","4473.91","0.07","213","2","213","2","","","","","","","","6","I -4 2 d","I -4 2bw","122","","[MoO(S2C2Me2)2](Et4N)","","- C16 H32 Mo N O S4 -","- C16 H32.016 Mo N O S4 -","- C128 H256.128 Mo8 N8 O8 S32 -","8","0.5","","Booyong S. Lim; James P. Donahue; R. H. Holm","Synthesis and Structures of Bis(dithiolene)molybdenum Complexes Related to the Active Sites of the DMSO Reductase Enzyme Family","Inorganic Chemistry","2000","39","","263","273","10.1021/ic9908672","","","0.71073","MoKα","","0.0703","0.0353","","0.0622","0.0567","","","","1.09","1.21","1.21","","","","","has coordinates,has disorder","134621","2020-10-21","18:00:00",""
"4300127","35.3419","0.0002","15.3984","0.0003","15.1147","0.0002","90","","113.582","0.001","90","","7538.62","0.19","213","2","213","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","[Mo(SC6H2-2,4,6-Pri3)(S2C2Me2)2](Et4N)","","- C31 H55 Mo N S5 -","- C31 H55 Mo N S5 -","- C248 H440 Mo8 N8 S40 -","8","1","","Booyong S. Lim; James P. Donahue; R. H. Holm","Synthesis and Structures of Bis(dithiolene)molybdenum Complexes Related to the Active Sites of the DMSO Reductase Enzyme Family","Inorganic Chemistry","2000","39","","263","273","10.1021/ic9908672","","","0.71073","MoKα","","0.0537","0.0316","","0.0767","0.0711","","","","1.074","1.181","1.181","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300128","18.4054","0.0018","15.2554","0.0012","19.4653","0.0016","90","","113.314","0.006","90","","5019.2","0.8","213","2","213","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[Mo(SC6H2-2,4,6-Pri3)(S2C2Ph2)2](Et4N)","","- C51 H63 Mo N S5 -","- C51 H63 Mo N S5 -","- C204 H252 Mo4 N4 S20 -","4","1","","Booyong S. Lim; James P. Donahue; R. H. Holm","Synthesis and Structures of Bis(dithiolene)molybdenum Complexes Related to the Active Sites of the DMSO Reductase Enzyme Family","Inorganic Chemistry","2000","39","","263","273","10.1021/ic9908672","","","0.71073","MoKα","","0.0795","0.0381","","","0.0724","0.0811","","","","","","1.026","","","","has coordinates","120081","2020-10-21","18:00:00",""
"4300129","25.5665","0.0007","16.8041","0.0005","17.1866","0.0005","90","","90","","90","","7383.7","0.4","213","2","213","2","","","","","","","","7","P b c n","-P 2n 2ab","60","","[Mo(CO)(SeC6H2-2,4,6-Pri3)(S2C2Me2)2](Et4N)","","- C32 H55 Mo N O S4 Se -","- C32 H55 Mo N O S4 Se -","- C256 H440 Mo8 N8 O8 S32 Se8 -","8","1","","Booyong S. Lim; James P. Donahue; R. H. Holm","Synthesis and Structures of Bis(dithiolene)molybdenum Complexes Related to the Active Sites of the DMSO Reductase Enzyme Family","Inorganic Chemistry","2000","39","","263","273","10.1021/ic9908672","","","0.71073","MoKα","","0.072","0.0361","","0.079","0.069","","","","1.033","1.094","1.094","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300130","18.334","0.002","19.919","0.003","17.809","0.002","90","","90.099","0.003","90","","6503.7","1.4","213","2","213","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[Mo(OC6H3-2,6-Pri2)(S2C2Me2)2](Et4N)","","- C28 H49 Mo N O S4 -","- C28 H49 Mo N O S4 -","- C224 H392 Mo8 N8 O8 S32 -","8","2","","Booyong S. Lim; James P. Donahue; R. H. Holm","Synthesis and Structures of Bis(dithiolene)molybdenum Complexes Related to the Active Sites of the DMSO Reductase Enzyme Family","Inorganic Chemistry","2000","39","","263","273","10.1021/ic9908672","","","0.71073","MoKα","","0.1097","0.0613","","0.1539","0.1372","","","","1.028","1.127","1.127","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300131","7.0975","0.0002","7.7209","0.0002","13.7181","0.0003","93.586","0.001","94.123","0.001","95.551","0.001","744.45","0.03","213","2","213","2","","","","","","","","5","P -1","-P 1","2","","[Mo(CO)2(S2C2Me2)2]","","- C10 H12 Mo O2 S4 -","- C10 H12 Mo O2 S4 -","- C20 H24 Mo2 O4 S8 -","2","1","","Booyong S. Lim; James P. Donahue; R. H. Holm","Synthesis and Structures of Bis(dithiolene)molybdenum Complexes Related to the Active Sites of the DMSO Reductase Enzyme Family","Inorganic Chemistry","2000","39","","263","273","10.1021/ic9908672","","","0.71073","MoKα","","0.0307","0.0256","","0.065","0.0638","","","","1.027","1.087","1.087","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300132","7.0301","0.0003","8.9791","0.0003","14.8274","0.0005","83.99","","81.602","0.002","72.108","0.002","879.37","0.06","213","2","213","2","","","","","","","","4","P -1","-P 1","2","","[Mo(S2C2Me2)3]","","- C12 H18 Mo S6 -","- C12 H18 Mo S6 -","- C24 H36 Mo2 S12 -","2","1","","Booyong S. Lim; James P. Donahue; R. H. Holm","Synthesis and Structures of Bis(dithiolene)molybdenum Complexes Related to the Active Sites of the DMSO Reductase Enzyme Family","Inorganic Chemistry","2000","39","","263","273","10.1021/ic9908672","","","0.71073","MoKα","","0.0932","0.0499","","0.107","0.0999","","","","0.951","1.157","1.157","","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4300133","14.962","0.0003","16.004","0.0003","15.915","","90","","107.942","0.001","90","","3625.55","0.1","213","2","213","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","[Mo2(??S)2(S2C2Me2)4](PPh4)2(2DMF)","","- C70 H78 Mo2 N2 O2 P2 S10 -","- C70 H78 Mo2 N2 O2 P2 S10 -","- C140 H156 Mo4 N4 O4 P4 S20 -","2","0.5","","Booyong S. Lim; James P. Donahue; R. H. Holm","Synthesis and Structures of Bis(dithiolene)molybdenum Complexes Related to the Active Sites of the DMSO Reductase Enzyme Family","Inorganic Chemistry","2000","39","","263","273","10.1021/ic9908672","","","0.71073","MoKα","","0.0875","0.0395","","0.0642","0.0588","","","","1.029","1.248","1.248","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300134","15.408","0.003","17.295","0.003","22.425","0.005","73.68","0.01","77.32","0.01","74.18","0.01","5451.4","1.9","293","2","293","2","","","","","","","","8","P -1","-P 1","2","1, Au2Na(dppn)3(PF6)3 4.5CH3CN 0.5 Et2O","","","- C107 H72 Au2 F18 N10.5 Na O0.5 P9 -","- C107 H72 Au2 F18 N10.5 Na O0.5 P9 -","- C214 H144 Au4 F36 N21 Na2 O P18 -","2","1","","Vincent J. Catalano; Heidi M. Kar; Byron L. Bennett","Gold(I) and Silver(I) Metallocryptates Based on 2,9-Bis(diphenylphosphino)-1,8-naphthyridine","Inorganic Chemistry","2000","39","","121","127","10.1021/ic9908827","","","0.71073","MoKα","","0.105","0.0549","","0.1359","0.1128","","","","1.063","1.16","1.16","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4300135","10.9365","0.0018","29.86","0.005","10.864","0.0016","90","","118.179","0.01","90","","3127.3","0.9","298","2","298","2","","","","","","","","6","C 1 c 1","C -2yc","9","2","","","- C32 H24 Au2 Cl2 N2 P2 -","- C32 H24 Au2 Cl2 N2 P2 -","- C128 H96 Au8 Cl8 N8 P8 -","4","1","","Vincent J. Catalano; Heidi M. Kar; Byron L. Bennett","Gold(I) and Silver(I) Metallocryptates Based on 2,9-Bis(diphenylphosphino)-1,8-naphthyridine","Inorganic Chemistry","2000","39","","121","127","10.1021/ic9908827","","","0.71073","MoKα","","0.0487","0.0446","","","0.1158","0.1181","","","","","","1.055","","","","has coordinates","134573","2020-10-21","18:00:00",""
"4300136","28.825","0.007","17.013","0.003","23.916","0.007","90","","115.23","","90","","10610","4","293","2","293","2","","","","","","","","9","C 1 2/c 1","-C 2yc","15","","","","- C101 H84 Ag3 Cl2 F18 N6 O2 P9 S2 -","- C101 H84 Ag3 Cl2 F18 N6 O2 P9 S2 -","- C404 H336 Ag12 Cl8 F72 N24 O8 P36 S8 -","4","0.5","","Vincent J. Catalano; Heidi M. Kar; Byron L. Bennett","Gold(I) and Silver(I) Metallocryptates Based on 2,9-Bis(diphenylphosphino)-1,8-naphthyridine","Inorganic Chemistry","2000","39","","121","127","10.1021/ic9908827","","","0.71073","MoKα","","0.1719","0.0797","","0.2531","0.1835","","","","1.027","1.163","1.163","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300137","9.713","0.0014","12.2659","0.0017","13.953","0.002","88.062","0.002","87.613","0.002","69.041","0.002","1550.7","0.4","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H30 Gd N P2 Se2 -","- C34 H30 Gd N P2 Se2 -","- C68 H60 Gd2 N2 P4 Se4 -","2","1","","Christopher G. Pernin; James A. Ibers","Syntheses, Structures, and Properties of the Bis(cyclopentadienyl) Rare-Earth Imidodiphosphinochalcogenido Compounds Cp2Ln[N(QPPh2)2] (Ln = La, Gd, Er, or Yb for Q = Se; Ln = Yb for Q = S)","Inorganic Chemistry","2000","39","","1216","1221","10.1021/ic990889o","","","0.71073","MoKα","","0.0558","0.0323","","","0.0632","0.0698","","","","","","0.732","","","","has coordinates","120081","2020-10-21","18:00:00",""
"4300138","9.704","0.002","12.222","0.003","13.98","0.004","88.23","0.004","87.487","0.004","69.107","0.004","1547.3","0.7","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H30 Er N P2 Se2 -","- C34 H30 Er N P2 Se2 -","- C68 H60 Er2 N2 P4 Se4 -","2","1","","Christopher G. Pernin; James A. Ibers","Syntheses, Structures, and Properties of the Bis(cyclopentadienyl) Rare-Earth Imidodiphosphinochalcogenido Compounds Cp2Ln[N(QPPh2)2] (Ln = La, Gd, Er, or Yb for Q = Se; Ln = Yb for Q = S)","Inorganic Chemistry","2000","39","","1216","1221","10.1021/ic990889o","","","0.71073","MoKα","","0.0327","0.0278","","","0.0686","0.0704","","","","","","1.083","","","","has coordinates","120081","2020-10-21","18:00:00",""
"4300139","9.7959","0.001","12.4134","0.0013","13.9077","0.0014","88.106","0.002","88.327","0.002","68.481","0.002","1572.2","0.3","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H30 La N P2 Se2 -","- C34 H30 La N P2 Se2 -","- C68 H60 La2 N2 P4 Se4 -","2","1","","Christopher G. Pernin; James A. Ibers","Syntheses, Structures, and Properties of the Bis(cyclopentadienyl) Rare-Earth Imidodiphosphinochalcogenido Compounds Cp2Ln[N(QPPh2)2] (Ln = La, Gd, Er, or Yb for Q = Se; Ln = Yb for Q = S)","Inorganic Chemistry","2000","39","","1216","1221","10.1021/ic990889o","","","0.71073","MoKα","","0.0346","0.0257","","","0.0604","0.0631","","","","","","0.963","","","","has coordinates","120081","2020-10-21","18:00:00",""
"4300140","13.8799","0.0018","12.6747","0.0016","17.18","0.002","90","","91.102","0.003","90","","3021.8","0.7","153","2","153","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C34 H30 N P2 S2 Yb -","- C34 H30 N P2 S2 Yb -","- C136 H120 N4 P8 S8 Yb4 -","4","1","","Christopher G. Pernin; James A. Ibers","Syntheses, Structures, and Properties of the Bis(cyclopentadienyl) Rare-Earth Imidodiphosphinochalcogenido Compounds Cp2Ln[N(QPPh2)2] (Ln = La, Gd, Er, or Yb for Q = Se; Ln = Yb for Q = S)","Inorganic Chemistry","2000","39","","1216","1221","10.1021/ic990889o","","","0.71073","MoKα","","0.0241","0.0218","","","0.0601","0.0609","","","","","","1.144","","","","has coordinates","120081","2020-10-21","18:00:00",""
"4300141","12.087","0.004","12.429","0.004","23.99","0.007","89.406","0.005","86.368","0.005","81.664","0.005","3558.8","1.9","153","2","153","2","","","","","","","","7","P -1","-P 1","2","","","","- C76 H76 N2 O2 P4 Se4 Yb2 -","- C76 H76 N2 O2 P4 Se4 Yb2 -","- C152 H152 N4 O4 P8 Se8 Yb4 -","2","1","","Christopher G. Pernin; James A. Ibers","Syntheses, Structures, and Properties of the Bis(cyclopentadienyl) Rare-Earth Imidodiphosphinochalcogenido Compounds Cp2Ln[N(QPPh2)2] (Ln = La, Gd, Er, or Yb for Q = Se; Ln = Yb for Q = S)","Inorganic Chemistry","2000","39","","1216","1221","10.1021/ic990889o","","","0.71073","MoKα","","0.0455","0.0321","","","0.0771","0.081","","","","","","1.053","","","","has coordinates","120081","2020-10-21","18:00:00",""
"4300142","12.6344","0.0002","13.5978","0.0002","14.1401","0.0002","77.402","0.002","81.351","0.002","73.253","0.002","2260.25","0.06","133","2","133","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H54 B19 N O0.5 P2 -","- C38 H54 B19 N O0.5 P2 -","- C76 H108 B38 N2 O P4 -","2","1","","Joel A. Dopke; Douglas R. Powell; Donald F. Gaines","Synthesis and Characterization of New 19-Vertex Macropolyhedral Boron Hydrides","Inorganic Chemistry","2000","39","","463","467","10.1021/ic990896c","","","0.71073","MoKα","","0.1063","0.0645","","","0.1725","0.1934","","","","","","1.086","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4300143","11.9887","0.0004","12.0792","0.0004","14.9021","0.0004","90","","104.247","0.001","90","","2091.66","0.11","180","2","180","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H27 N2 S -","- C24 H27 N2 S -","- C96 H108 N8 S4 -","4","1","","Jinkun Huang; Hans-Jörg Schanz; E. D. Stevens; Steven P. Nolan; Kenneth B. Capps; Andreas Bauer; Carl D. Hoff","Structural and Solution Calorimetric Studies of Sulfur Binding to Nucleophilic Carbenes","Inorganic Chemistry","2000","39","","1042","1045","10.1021/ic990906+","","","","","","","","","","","","","","","","","","","","","has coordinates","179039","2020-10-21","18:00:00",""
"4300144","7.0433","0.0014","7.0433","0.0014","34.011","0.008","90","","90","","120","","1461.2","0.5","150","2","150","2","","","","","","","","4","P 31 2 1","P 31 2""","152","","","","- C23 H32 N2 S -","- C23 H32 N2 S -","- C69 H96 N6 S3 -","3","0.5","","Jinkun Huang; Hans-Jörg Schanz; E. D. Stevens; Steven P. Nolan; Kenneth B. Capps; Andreas Bauer; Carl D. Hoff","Structural and Solution Calorimetric Studies of Sulfur Binding to Nucleophilic Carbenes","Inorganic Chemistry","2000","39","","1042","1045","10.1021/ic990906+","","","","","","","","","","","","","","","","","","","","","has coordinates","179039","2020-10-21","18:00:00",""
"4300145","6.703","0.002","8.137","0.001","9.801","0.002","105.56","0.01","105.58","0.02","102.35","0.01","471.9","0.2","153.2","","153.2","","","","","","","","","4","P -1","-P 1","2","","","","- Fe4 Mn3 O24 V6 -","- Fe4 Mn2.5 O24 V6 -","- Fe4 Mn2.5 O24 V6 -","1","0.5","","Xiandong Wang; Douglas A. Vander Griend; Charlotte L. Stern; Kenneth R. Poeppelmeier","Site-Specific Vanadates Co4Fe3.33(VO4)6 and Mn3Fe4(VO4)6","Inorganic Chemistry","2000","39","","136","140","10.1021/ic9909274","","","0.7107","MoKα","","0.0425","0.0425","","0.0526","0.0526","","","","4.933","4.933","4.933","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300146","4.965","0.001","10.211","0.001","17.188","0.003","90","","90","","90","","871.4","0.2","153.2","","153.2","","","","","","","","CoO/Fe2O3/V2O5-flux","4","P n m a","-P 2ac 2n","62","","","","- Co4 Fe3.3 O24 V6 -","- Co8 Fe4 O24 V6 -","- Co16 Fe8 O48 V12 -","2","0.25","","Xiandong Wang; Douglas A. Vander Griend; Charlotte L. Stern; Kenneth R. Poeppelmeier","Site-Specific Vanadates Co4Fe3.33(VO4)6 and Mn3Fe4(VO4)6","Inorganic Chemistry","2000","39","","136","140","10.1021/ic9909274","","","0.7107","MoKalpha","","","0.0338","","","0.0417","","","","","3.034","3.034","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300147","13.444","0.007","14.576","0.005","19.641","0.007","98.21","0.03","101.67","0.04","105.8","0.04","3546","3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C58 H45 F18 N14 O Os2 P3 -","- C58 H44 F18.07 N14 O Os2 P3 -","- C116 H88 F36.14 N28 O2 Os4 P6 -","2","1","","Parimal Paul; Beena Tyagi; Anvarhusen K. Bilakhiya; Parthasarathi Dastidar; Eringathodi Suresh","Metal-Assisted Unusual Hydroxylation at the Carbon Atom of the Triazine Ring in Dinuclear Ruthenium(II) and Osmium(II) Complexes Bridged by 2,4,6-Tris(2-pyridyl)-1,3,5-triazine: Synthesis, Structural Characterization, Stereochemistry, and Electrochemical Studies","Inorganic Chemistry","2000","39","","14","22","10.1021/ic990938x","","","0.7093","","","0.1308","0.0929","","","0.2588","0.2787","","","","","","1.067","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300148","24.584","0.007","14.309","0.004","41.044","0.013","90","","92.84","0.02","90","","14420","7","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C58 H47 F18 N14 O2 P3 Ru2 -","- C58 H F12 N14 O2 P2 Ru2 -","- C464 H8 F96 N112 O16 P16 Ru16 -","8","1","","Parimal Paul; Beena Tyagi; Anvarhusen K. Bilakhiya; Parthasarathi Dastidar; Eringathodi Suresh","Metal-Assisted Unusual Hydroxylation at the Carbon Atom of the Triazine Ring in Dinuclear Ruthenium(II) and Osmium(II) Complexes Bridged by 2,4,6-Tris(2-pyridyl)-1,3,5-triazine: Synthesis, Structural Characterization, Stereochemistry, and Electrochemical Studies","Inorganic Chemistry","2000","39","","14","22","10.1021/ic990938x","","","0.7093","MoKα","","0.2677","0.1796","","","0.4789","0.5029","","","","","","1.679","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300149","12.8718","0.0002","15.4366","0.0001","16.1842","0.0002","72.02","","74.19","","83.831","0.001","2942.04","0.06","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 Mo6 N4 O33 P2 -","- C36 Mo6 N4 O33 P2 -","- C72 Mo12 N8 O66 P4 -","2","1","","Ulrich Kortz","Polyoxometalate-Diphosphate Complexes. 6.1Possible Intermediates in the Molybdate-Catalyzed Hydrolysis of Pyrophosphate: Structure of Hexamolybdopyrophosphate [(O3POPO3)Mo6O18(H2O)4]4-","Inorganic Chemistry","2000","39","","625","626","10.1021/ic990959r","","","0.71073","MoKα","","0.0918","0.0696","","","0.184","0.2108","","","","","","1.118","","","","has coordinates","120081","2020-10-21","18:00:00",""
"4300150","8.5891","0.0008","8.9195","0.0008","12.5198","0.0011","86.851","0.001","75.513","0.001","68.927","0.002","865.89","0.14","193","2","193","2","","","","","","","","4","P -1","-P 1","2","Hexakis(trifluoromethyl)cyclotriphosphazene","","","- C6 F18 N3 P3 -","- C6 F18 N3 P3 -","- C12 F36 N6 P6 -","2","1","","Rajendra Prasad Singh; Ashwani Vij; Robert L. Kirchmeier; Jean'ne M. Shreeve","A Novel Synthesis of Hexakis(trifluoromethyl)cyclotriphosphazene. Single-Crystal X-ray Structures of N3P3(CF3)6 and N3P3F6","Inorganic Chemistry","2000","39","","375","377","10.1021/ic9909781","","","0.71073","MoKα","","0.087","0.0632","","","0.156","0.1727","","","","","","1.046","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4300151","6.9057","0.0002","12.1727","0.0001","8.6512","0.0002","90","","90","","90","","727.23","0.03","193","2","193","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- F6 N3 P3 -","- F6 N3 P3 -","- F24 N12 P12 -","4","0.5","","Rajendra Prasad Singh; Ashwani Vij; Robert L. Kirchmeier; Jean'ne M. Shreeve","A Novel Synthesis of Hexakis(trifluoromethyl)cyclotriphosphazene. Single-Crystal X-ray Structures of N3P3(CF3)6 and N3P3F6","Inorganic Chemistry","2000","39","","375","377","10.1021/ic9909781","","","0.71073","MoKα","","0.0462","0.03","","","0.0718","0.077","","","","","","1.098","","","","has coordinates","134573","2020-10-21","18:00:00",""
"4300152","14.927","0.005","14.927","0.005","56.047","0.013","90","","90","","120","","10815","6","153","2","153","2","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","","","- C72 H60 N3 P6 S6 Y -","- C72 H60 N3 P6 S6 Y -","- C432 H360 N18 P36 S36 Y6 -","6","0.166667","","Christopher G. Pernin; James A. Ibers","Soluble Yttrium Chalcogenides: Syntheses, Structures, and NMR Properties of Y[η3-N(SPPh2)2]3 and Y[η2-N(SePPh2)2]2[η3-N(SePPh2)2]","Inorganic Chemistry","2000","39","","1222","1226","10.1021/ic990984x","","","0.71073","MoKα","","0.0822","0.0424","","","0.0797","0.0908","","","","","","0.938","","","","has coordinates","179039","2020-10-21","18:00:00",""
"4300153","13.3511","0.0017","38.539","0.007","14.108","0.002","90","","94.085","0.013","90","","7240.7","1.9","153","2","153","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C73 H62 Cl2 N3 P6 Se6 Y -","- C73 H62 Cl2 N3 P6 Se6 Y -","- C292 H248 Cl8 N12 P24 Se24 Y4 -","4","1","","Christopher G. Pernin; James A. Ibers","Soluble Yttrium Chalcogenides: Syntheses, Structures, and NMR Properties of Y[η3-N(SPPh2)2]3 and Y[η2-N(SePPh2)2]2[η3-N(SePPh2)2]","Inorganic Chemistry","2000","39","","1222","1226","10.1021/ic990984x","","","0.71073","MoKα","","0.0685","0.037","","","0.0696","0.0767","","","","","","0.871","","","","has coordinates","120081","2020-10-21","18:00:00",""
"4300154","21.545","0.004","13.894","0.003","24.76","0.005","90","","95.17","0.03","90","","7382","3","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C76 H70 Cl0 N3 O P6 Se6 Y -","- C76 H70 N3 O P6 Se6 Y -","- C304 H280 N12 O4 P24 Se24 Y4 -","4","1","","Christopher G. Pernin; James A. Ibers","Soluble Yttrium Chalcogenides: Syntheses, Structures, and NMR Properties of Y[η3-N(SPPh2)2]3 and Y[η2-N(SePPh2)2]2[η3-N(SePPh2)2]","Inorganic Chemistry","2000","39","","1222","1226","10.1021/ic990984x","","","0.71073","MoKα","","0.1451","0.0398","","","0.0637","0.0883","","","","","","0.608","","","","has coordinates","120081","2020-10-21","18:00:00",""
"4300155","11.267","0.003","14.994","0.003","20.487","0.005","101.71","0.02","100.88","0.02","101.798","0.012","3220.6","1.4","183","2","183","2","","","","","","","","5","P -1","-P 1","2","Zn2DPX","","","- C79 H75.5 N8 O Zn2 -","- C79 H75.5 N8 O Zn2 -","- C158 H151 N16 O2 Zn4 -","2","1","","Christopher J. Chang; Yongqi Deng; Alan F. Heyduk; C. K. Chang; Daniel G. Nocera","Xanthene-Bridged Cofacial Bisporphyrins","Inorganic Chemistry","2000","39","","959","966","10.1021/ic990987+","","","","","","","0.0565","","","0.1355","","","","","","","","","","","has coordinates","277859","2022-09-15","00:05:25",""
"4300156","11.2141","0.0001","14.9539","0.0005","20.6915","0.0007","101.81","0.002","101.044","0.002","101.722","0.002","3225.7","0.2","183","2","183","2","","","","","","","","5","P -1","-P 1","2","Cu2DPX","","","- C79 H82 Cu2 N8 O -","- C79 H82 Cu2 N8 O -","- C158 H164 Cu4 N16 O2 -","2","1","","Christopher J. Chang; Yongqi Deng; Alan F. Heyduk; C. K. Chang; Daniel G. Nocera","Xanthene-Bridged Cofacial Bisporphyrins","Inorganic Chemistry","2000","39","","959","966","10.1021/ic990987+","","","","","","","0.0909","","","0.1994","","","","","","","","","","","has coordinates","277859","2022-09-15","00:05:25",""
"4300157","24.1671","0.0004","10.669","","50.508","0.0009","90","","99.553","0.002","90","","12842","0.3","183","2","183","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C79 H82 N8 Ni2 O -","- C79 H82 N8 Ni2 O -","- C632 H656 N64 Ni16 O8 -","8","1","","Christopher J. Chang; Yongqi Deng; Alan F. Heyduk; C. K. Chang; Daniel G. Nocera","Xanthene-Bridged Cofacial Bisporphyrins","Inorganic Chemistry","2000","39","","959","966","10.1021/ic990987+","","","","","","","0.0768","","","0.146","","","","","","","","","","","has coordinates","179039","2020-10-21","18:00:00",""
"4300158","16.8117","0.0007","10.5521","0.0005","20.0591","0.0009","90","","112.238","0.001","90","","3293.8","0.3","193","","193","","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C22 H34 B Cl4 F3 N6 O5 S W -","- C22 H34 B Cl4 F3 N6 O5 S W -","- C88 H136 B4 Cl16 F12 N24 O20 S4 W4 -","4","1","","Todd W. Crane; Peter S. White; Joseph L. Templeton","Deprotonation of Cationic Tungsten(IV) Aqua-Oxo-Alkyne Complexes To Form Dioxo-Vinyl Tungsten(VI) Complexes","Inorganic Chemistry","2000","39","","1081","1091","10.1021/ic990994y","","","0.7093","MolybdenumKα","","0.032","0.031","","0.03","0.03","","","","","1.15","1.15","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300159","7.9595","0.0007","8.6224","0.0008","16.4166","0.0015","76.759","0.002","76.158","0.002","78.26","0.002","1051.61","0.17","193","","193","","","","","","","","","7","P -1","-P 1","2","","","","- C17.35 H25 B Cl0.71 N6 O2 W -","- C18 H25 B Cl2 N6 O2 W -","- C36 H50 B2 Cl4 N12 O4 W2 -","2","1","","Todd W. Crane; Peter S. White; Joseph L. Templeton","Deprotonation of Cationic Tungsten(IV) Aqua-Oxo-Alkyne Complexes To Form Dioxo-Vinyl Tungsten(VI) Complexes","Inorganic Chemistry","2000","39","","1081","1091","10.1021/ic990994y","","","0.7093","MolybdenumKα","","0.05","0.044","","0.048","0.048","","","","","3.31","3.31","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300160","14.791","0.001","10.176","0.001","19.542","0.002","90","","111.806","0.001","90","","2730.9","0.4","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17 H45 Ge N3 Si4 -","- C17 H45 Ge N3 Si4 -","- C68 H180 Ge4 N12 Si16 -","4","1","","Stephen R. Foley; Yuanlin Zhou; Glenn P. A. Yap; Darrin S. Richeson","Synthesis of MII[N(SiMe3)2][Me3SiNC(tBu)NSiMe3] (M = Sn, Ge) from Amidinate Precursors: Active Catalysts for Phenyl Isocyanate Cyclization","Inorganic Chemistry","2000","39","","924","929","10.1021/ic991004b","","","0.71073","MoKα","","0.0603","0.0442","","","0.0886","0.0912","","","","","","1.057","","","","has coordinates","120081","2020-10-21","18:00:00",""
"4300161","10.998","0.001","12.154","0.001","20.084","0.002","90","","90","","90","","2684.6","0.4","203","2","203","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C16 H42 N4 Si4 Sn -","- C16 H42 N4 Si4 Sn -","- C64 H168 N16 Si16 Sn4 -","4","0.5","","Stephen R. Foley; Yuanlin Zhou; Glenn P. A. Yap; Darrin S. Richeson","Synthesis of MII[N(SiMe3)2][Me3SiNC(tBu)NSiMe3] (M = Sn, Ge) from Amidinate Precursors: Active Catalysts for Phenyl Isocyanate Cyclization","Inorganic Chemistry","2000","39","","924","929","10.1021/ic991004b","","","0.71073","MoKα","","0.0456","0.0362","","","0.0975","0.1002","","","","","","1.058","","","","has coordinates","120081","2020-10-21","18:00:00",""
"4300162","20.6267","0.0011","23.0079","0.0013","26.366","0.0015","90","","90.914","0.001","90","","12511.1","1.2","298","2","298","2","","","","","","","","9","C 1 2/c 1","-C 2yc","15","","","","- C116 H112 Ag5 Cl4 F6 N2 O6 P11 S4 -","- C116 H78 Ag5 Cl3.96 F6 N2 O6 P11 S4 -","- C464 H312 Ag20 Cl15.84 F24 N8 O24 P44 S16 -","4","0.5","","C. W. Liu; Ben-Jie Liaw; Ju-Chung Wang; Tai-Chiun Keng","Solid State Structures of [Ag5(dppm)4(S2CC(CN)P(O)(OEt)2)2][PF6] and Ag4(dppm)4(S2CC(CN)P(O)(OEt)2)2: Variable Coordination Modes of 1,1-Dithiolate to Silver(I)","Inorganic Chemistry","2000","39","","1329","1332","10.1021/ic991012s","","","0.71073","MoKα","","0.0594","0.0545","","","0.1523","0.1593","","","","","","1.103","","","","has coordinates,has disorder","134573","2020-10-21","18:00:00",""
"4300163","20.7446","0.0013","23.369","0.0014","23.9971","0.0015","90","","90.423","0.001","90","","11633","1.2","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C118 H118 Ag4 N2 O7 P10 S4 -","- C117 Ag4 N2 O7 P10 S4 -","- C468 Ag16 N8 O28 P40 S16 -","4","1","","C. W. Liu; Ben-Jie Liaw; Ju-Chung Wang; Tai-Chiun Keng","Solid State Structures of [Ag5(dppm)4(S2CC(CN)P(O)(OEt)2)2][PF6] and Ag4(dppm)4(S2CC(CN)P(O)(OEt)2)2: Variable Coordination Modes of 1,1-Dithiolate to Silver(I)","Inorganic Chemistry","2000","39","","1329","1332","10.1021/ic991012s","","","0.71073","MoKα","","0.101","0.0708","","","0.1497","0.1685","","","","","","1.114","","","","has coordinates,has disorder","134573","2020-10-21","18:00:00",""
"4300164","18.726","0.008","18.726","0.008","13.944","0.006","90","","90","","120","","4235","3","295","2","295","2","","","","","","","","7","P -6 c 2","P -6c 2","188","","tris(acetonitrile)-(hydrogen tris(pyrazol-1-yl)borate)-ruthenium(ii) hexafluorophosphate dichloromethane/diethylether solvate","","- C15 H19 B F6 N9 P Ru -","- C23.0833 H19 B F4 N9 P0.666667 Ru -","- C138.5 H114 B6 F24 N54 P4 Ru6 -","6","0.5","","Eva Rüba; Walter Simanko; Kurt Mereiter; Roland Schmid; Karl Kirchner","Comparing the Isoelectronic Complexes [RuTp(CH3CN)3]PF6 (Tp = Hydridotris(pyrazolyl)borate) and [RuCp(CH3CN)3]PF6. Structure and Acetonitrile Exchange Kinetics","Inorganic Chemistry","2000","39","","382","384","10.1021/ic991013k","","","0.71073","MoKα","","0.0757","0.0514","","","0.1095","0.1255","","","","","","1.118","","","","has coordinates","134573","2020-10-21","18:00:00",""
"4300165","13.545","0.003","22.339","0.005","23.07","0.005","90","","106.45","0.03","90","","6695","3","213","2","213","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","[(Cl4cat)MoFe3S4(PBut3)3(CH3CN)].3CH2Cl2","","","- C47 H90 Cl10 Fe3 Mo N O2 P3 S4 -","- C47 H90 Cl10 Fe3 Mo N O2 P3 S4 -","- C188 H360 Cl40 Fe12 Mo4 N4 O8 P12 S16 -","4","1","","Frank Osterloh; Brent M. Segal; Catalina Achim; R. H. Holm","Reduced Mono-, Di-, and Tetracubane-Type Clusters Containing the [MoFe3S4]2+ Core Stabilized by Tertiary Phosphine Ligation","Inorganic Chemistry","2000","39","","980","989","10.1021/ic991016x","","","0.71073","MoKα","","0.0444","0.0319","","","0.0806","0.0853","","","","","","1.033","","","","has coordinates","179039","2020-10-21","18:00:00",""
"4300166","23.493","0.001","11.4994","0.0006","18.265","0.001","90","","90","","90","","4934.4","0.4","213","2","213","2","","","","","","","","9","P n a 21","P 2c -2n","33","[(Cl4cat)(CH3CN)MoFe3S4(PPri)3]","","","- C35 H66 Cl4 Fe3 Mo N O2 P3 S4 -","- C35 H66 Cl4 Fe3 Mo N O2 P3 S4 -","- C140 H264 Cl16 Fe12 Mo4 N4 O8 P12 S16 -","4","1","","Frank Osterloh; Brent M. Segal; Catalina Achim; R. H. Holm","Reduced Mono-, Di-, and Tetracubane-Type Clusters Containing the [MoFe3S4]2+ Core Stabilized by Tertiary Phosphine Ligation","Inorganic Chemistry","2000","39","","980","989","10.1021/ic991016x","","","0.71073","MoKα","","0.2038","0.0714","","","0.1348","0.1711","","","","","","1.024","","","","has coordinates","120081","2020-10-21","18:00:00",""
"4300167","13.549","0.003","14.114","0.003","23.654","0.005","76.04","0.03","86.02","0.03","62.57","0.03","3891.7","1.9","213","2","213","2","","","","","","","","8","P -1","-P 1","2","[(Cl4cat)2Mo2Fe6S8(PEt3)6]","","","- C48 H90 Cl8 Fe6 Mo2 O4 P6 S8 -","- C48 H90 Cl8 Fe6 Mo2 O4 P6 S8 -","- C96 H180 Cl16 Fe12 Mo4 O8 P12 S16 -","2","1","","Frank Osterloh; Brent M. Segal; Catalina Achim; R. H. Holm","Reduced Mono-, Di-, and Tetracubane-Type Clusters Containing the [MoFe3S4]2+ Core Stabilized by Tertiary Phosphine Ligation","Inorganic Chemistry","2000","39","","980","989","10.1021/ic991016x","","","0.71073","MoKα","","0.0937","0.0579","","","0.1464","0.1732","","","","","","1.086","","","","has coordinates","120081","2020-10-21","18:00:00",""
"4300168","32.9623","0.0003","32.9623","0.0003","35.6578","0.0004","90","","90","","90","","38742.7","0.7","213","2","213","2","","","","","","","","10","P 4/n c c :2","-P 4a 2ac","130","[{(Meida)MoFe3S4(PCy3)3}4Fe2(mu-Cl)(CH3CN)2](BPh4)3.2CH3CN","","","- C316 H496 B3 Cl Fe14 Mo4 N8 O16 P12 S16 -","- C314.752 H488.96 B2.948 Cl Fe14 Mo4 N8 O16 P12 S16 -","- C1259.01 H1955.84 B11.792 Cl4 Fe56 Mo16 N32 O64 P48 S64 -","4","0.25","","Frank Osterloh; Brent M. Segal; Catalina Achim; R. H. Holm","Reduced Mono-, Di-, and Tetracubane-Type Clusters Containing the [MoFe3S4]2+ Core Stabilized by Tertiary Phosphine Ligation","Inorganic Chemistry","2000","39","","980","989","10.1021/ic991016x","","","0.71073","MoKα","","0.09","0.0684","","","0.2129","0.2373","","","","","","1.075","","","","has coordinates","179039","2020-10-21","18:00:00",""
"4300169","13.274","0.003","18.655","0.004","14.114","0.003","90","","116","0.03","90","","3141.3","1.4","140","2","140","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","","","- C35 H43 N4 O2 Pd -","- C35 H43 N4 O2 Pd -","- C140 H172 N16 O8 Pd4 -","4","0.5","","Pamela A. Lord; Marilyn M. Olmstead; Alan L. Balch","Redox Characteristics of Nickel and Palladium Complexes of the Open-Chain Tetrapyrrole Octaethylbilindione: A Biliverdin Model","Inorganic Chemistry","2000","39","","1128","1134","10.1021/ic9910209","","","0.71073","MoKα","","0.055","0.0419","","","0.0834","0.09","","","","","","1.032","","","","has coordinates","120081","2020-10-21","18:00:00",""
"4300170","15.121","0.003","16.777","0.003","14.628","0.003","90","","90","","90","","3710.9","1.2","130","2","130","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C35 H43 I3 N4 Ni O2 -","- C35 H43 I3 N4 Ni O2 -","- C140 H172 I12 N16 Ni4 O8 -","4","0.5","","Pamela A. Lord; Marilyn M. Olmstead; Alan L. Balch","Redox Characteristics of Nickel and Palladium Complexes of the Open-Chain Tetrapyrrole Octaethylbilindione: A Biliverdin Model","Inorganic Chemistry","2000","39","","1128","1134","10.1021/ic9910209","","","1.54178","CuKα","","0.0704","0.0536","","","0.1256","0.1359","","","","","","1.067","","","","has coordinates","120081","2020-10-21","18:00:00",""
"4300171","15.2236","0.0006","16.7638","0.0007","14.6289","0.0006","90","","90","","90","","3733.4","0.3","90","2","90","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C35 H43 I3 N4 O2 Pd -","- C35 H43 I3 N4 O2 Pd -","- C140 H172 I12 N16 O8 Pd4 -","4","0.5","","Pamela A. Lord; Marilyn M. Olmstead; Alan L. Balch","Redox Characteristics of Nickel and Palladium Complexes of the Open-Chain Tetrapyrrole Octaethylbilindione: A Biliverdin Model","Inorganic Chemistry","2000","39","","1128","1134","10.1021/ic9910209","","","0.71073","MoKα","","0.067","0.0364","","","0.085","0.0935","","","","","","1.013","","","","has coordinates","179039","2020-10-21","18:00:00",""
"4300172","16.122","0.001","17.151","0.001","37.508","0.002","90","","90","","90","","10371.3","1","213","2","213","2","","","","","","","synthesis","6","I b c a","-I 2b 2c","73","","","","- C46 H44 Cl7 Cr3 N12 O -","- C46 H32 Cl7 Cr3 N12 O -","- C368 H256 Cl56 Cr24 N96 O8 -","8","0.5","","Rodolphe Clérac; F. Albert Cotton; Lee M. Daniels; Kim R. Dunbar; Carlos A. Murillo; Isabel Pascual","Linear Trichromium Complexes with Direct Cr to Cr Contacts. 2. Compounds with Cr3(dipyridylamide)43+ Cores","Inorganic Chemistry","2000","39","","752","756","10.1021/ic991022t","","","0.71073","MoKα","","0.0752","0.064","","0.1848","0.1656","","","","1.069","1.064","1.064","","","","","has coordinates,has disorder","134621","2020-10-21","18:00:00",""
"4300173","11.657","0.002","28.35","0.006","15.019","0.003","90","","104.41","0.03","90","","4807.3","1.7","213","2","213","2","","","","","","","synthesis","6","P 1 21/n 1","-P 2yn","14","","","","- C41 H34 Al Cl8 Cr3 N12 -","- C41 H32 Al Cl8 Cr3 N12 -","- C164 H128 Al4 Cl32 Cr12 N48 -","4","1","","Rodolphe Clérac; F. Albert Cotton; Lee M. Daniels; Kim R. Dunbar; Carlos A. Murillo; Isabel Pascual","Linear Trichromium Complexes with Direct Cr to Cr Contacts. 2. Compounds with Cr3(dipyridylamide)43+ Cores","Inorganic Chemistry","2000","39","","752","756","10.1021/ic991022t","","","0.71073","MoKα","","0.0706","0.0535","","0.1341","0.1166","","","","1.117","1.109","1.109","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300174","11.67","0.005","28.398","0.004","15.031","0.011","90","","104.514","0.011","90","","4822","4","213","2","213","2","","","","","","","synthesis","6","P 1 21/n 1","-P 2yn","14","","","","- C41 H34 Cl8 Cr3 Fe N12 -","- C41 H34 Cl8 Cr3 Fe N12 -","- C164 H136 Cl32 Cr12 Fe4 N48 -","4","1","","Rodolphe Clérac; F. Albert Cotton; Lee M. Daniels; Kim R. Dunbar; Carlos A. Murillo; Isabel Pascual","Linear Trichromium Complexes with Direct Cr to Cr Contacts. 2. Compounds with Cr3(dipyridylamide)43+ Cores","Inorganic Chemistry","2000","39","","752","756","10.1021/ic991022t","","","0.71073","MoKα","","0.0455","0.0399","","0.1012","0.0949","","","","1.084","1.084","1.084","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300175","13.571","0.003","34.607","0.009","11.424","0.003","90","","113.108","0.003","90","","4935","2","213","2","213","2","","","","","","","synthesis","7","P 1 21/c 1","-P 2ybc","14","","","","- C44 H41 Cl2 Cr3 I3 N12 O1.5 -","- C44.01 H32 Cl2 Cr3 I3 N12 O1.5 -","- C176.04 H128 Cl8 Cr12 I12 N48 O6 -","4","1","","Rodolphe Clérac; F. Albert Cotton; Lee M. Daniels; Kim R. Dunbar; Carlos A. Murillo; Isabel Pascual","Linear Trichromium Complexes with Direct Cr to Cr Contacts. 2. Compounds with Cr3(dipyridylamide)43+ Cores","Inorganic Chemistry","2000","39","","752","756","10.1021/ic991022t","","","0.71073","MoKα","","0.0992","0.0716","","0.1735","0.1496","","","","1.14","1.132","1.132","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4300176","11.545","0.002","21.426","0.004","20.238","0.004","90","","92.78","0.03","90","","5000.2","1.6","213","2","213","2","","","","","","","synthesis","7","P 1 21/n 1","-P 2yn","14","","","","- C42 H36 Cl3.5 Cr3 F6 N12 P -","- C42.004 H32 Cl6.009 Cr3 F6 N12 P -","- C168.016 H128 Cl24.036 Cr12 F24 N48 P4 -","4","1","","Rodolphe Clérac; F. Albert Cotton; Lee M. Daniels; Kim R. Dunbar; Carlos A. Murillo; Isabel Pascual","Linear Trichromium Complexes with Direct Cr to Cr Contacts. 2. Compounds with Cr3(dipyridylamide)43+ Cores","Inorganic Chemistry","2000","39","","752","756","10.1021/ic991022t","","","0.71073","MoKα","","0.137","0.0899","","0.268","0.2094","","","","1.114","1.1","1.1","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4300177","23.878","0.002","29.488","0.001","14.245","0.008","90","","90","","90","","10030","6","213","2","213","2","","","","","","","synthesis","7","P n a 21","P 2c -2n","33","","","","- C42 H36 B2 Cl4 Cr3 F9 N12 -","- C42 H36 B2 Cl4 Cr3 F9 N12 -","- C336 H288 B16 Cl32 Cr24 F72 N96 -","8","2","","Rodolphe Clérac; F. Albert Cotton; Lee M. Daniels; Kim R. Dunbar; Carlos A. Murillo; Isabel Pascual","Linear Trichromium Complexes with Direct Cr to Cr Contacts. 2. Compounds with Cr3(dipyridylamide)43+ Cores","Inorganic Chemistry","2000","39","","752","756","10.1021/ic991022t","","","0.71073","MoKα","","0.0917","0.0676","","0.1733","0.1506","","","","1.077","1.048","1.048","","","","","has coordinates,has disorder","134621","2020-10-21","18:00:00",""
"4300178","11.499","0.003","20.976","0.001","19.862","0.003","90","","92.804","0.004","90","","4785","1.5","213","2","213","2","","","","","","","synthesis","7","P 1 21/n 1","-P 2yn","14","","","","- C47 H48 B Cl3 Cr3 F5 N12 -","- C46.99 H34 B Cl3 Cr3 F5 N12 -","- C187.96 H136 B4 Cl12 Cr12 F20 N48 -","4","1","","Rodolphe Clérac; F. Albert Cotton; Lee M. Daniels; Kim R. Dunbar; Carlos A. Murillo; Isabel Pascual","Linear Trichromium Complexes with Direct Cr to Cr Contacts. 2. Compounds with Cr3(dipyridylamide)43+ Cores","Inorganic Chemistry","2000","39","","752","756","10.1021/ic991022t","","","0.71073","MoKα","","0.0693","0.0631","","0.1546","0.1486","","","","1.096","1.12","1.12","","","","","has coordinates,has disorder","134621","2020-10-21","18:00:00",""
"4300179","6.4717","0.0001","14.9458","0.0003","3.57625","0.00007","90","","93.496","0.001","90","","345.268","0.011","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C2 N3 Na -","- C2 N3 Na -","- C8 N12 Na4 -","4","1","","Barbara Jürgens; Elisabeth Irran; Julius Schneider; Wolfgang Schnick","Trimerization of NaC2N3 to Na3C6N9 in the Solid: Ab Initio Crystal Structure Determination of Two Polymorphs of NaC2N3 and of Na3C6N9 from X-ray Powder Diffractometry","Inorganic Chemistry","2000","39","","665","670","10.1021/ic991044f","powder diffraction","","","","","","","","","","","","","1.11","","","","","","","has coordinates,has Fobs","179039","2020-10-21","18:00:00",""
"4300180","5.6393","0.0007","5.6393","","5.6393","","90","","90","","90","","179.34","0.02","","","295","2","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","","- Cl Na -","- Cl Na -","- Cl4 Na4 -","4","0.0208333","","Barbara Jürgens; Elisabeth Irran; Julius Schneider; Wolfgang Schnick","Trimerization of NaC2N3 to Na3C6N9 in the Solid: Ab Initio Crystal Structure Determination of Two Polymorphs of NaC2N3 and of Na3C6N9 from X-ray Powder Diffractometry","Inorganic Chemistry","2000","39","","665","670","10.1021/ic991044f","powder diffraction","","","","","","","","","","","","","1.11","","","","","","","has coordinates,has Fobs","202022","2020-10-21","18:00:00",""
"4300181","6.5015","0.0005","14.951","0.002","3.605","0.0003","90","","90","","90","","350.42","0.06","","","","","","","","","","","","3","P b n m","-P 2c 2ab","62","","","","- C2 N3 Na -","- C2 N3 Na -","- C8 N12 Na4 -","4","0.5","","Barbara Jürgens; Elisabeth Irran; Julius Schneider; Wolfgang Schnick","Trimerization of NaC2N3 to Na3C6N9 in the Solid: Ab Initio Crystal Structure Determination of Two Polymorphs of NaC2N3 and of Na3C6N9 from X-ray Powder Diffractometry","Inorganic Chemistry","2000","39","","665","670","10.1021/ic991044f","powder diffraction","","","","","","","","","","","","","1.27","","","","","","","has coordinates,has Fobs","120081","2020-10-21","18:00:00",""
"4300182","11.0482","0.0001","23.3806","0.0003","3.51616","0.00003","90","","97.9131","0.0009","90","","899.623","0.016","","","295","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C6 N9 Na3 -","- C6 N9 Na3 -","- C24 N36 Na12 -","4","1","","Barbara Jürgens; Elisabeth Irran; Julius Schneider; Wolfgang Schnick","Trimerization of NaC2N3 to Na3C6N9 in the Solid: Ab Initio Crystal Structure Determination of Two Polymorphs of NaC2N3 and of Na3C6N9 from X-ray Powder Diffractometry","Inorganic Chemistry","2000","39","","665","670","10.1021/ic991044f","powder diffraction","","","","","","","","","","","","","0.8","","","","","","","has coordinates,has Fobs","289785","2024-02-12","08:29:27",""
"4300183","9.174","0.002","13.522","0.003","14.838","0.003","95.79","0.03","92.03","0.03","104.84","0.03","1766.6","0.7","130","2","130","2","","","","","","","","6","P -1","-P 1","2","","","","- C36.78 H46 Cl2.57 Fe N4 O -","- C36.782 H46 Cl2.564 Fe N4 O -","- C73.564 H92 Cl5.128 Fe2 N8 O2 -","2","1","","Teresa J. Neal; Seong-Joo Kang; Ilona Turowska-Tyrk; Charles E. Schulz; W. Robert Scheidt","Magnetic Interactions in the High-Spin Iron(III) Oxooctaethylchlorinato Derivative [Fe(oxoOEC)(Cl)] and Its π-Cation Radical [Fe(oxoOEC.)(Cl)]SbCl6","Inorganic Chemistry","2000","39","","872","880","10.1021/ic991052w","","","0.71073","MoKα","","0.1657","0.095","","0.2163","0.1687","","","","1.035","1.08","1.08","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300184","19.8419","0.0013","10.027","0.002","22.417","0.004","90","","96.13","0.02","90","","4434.5","1.2","127","2","127","2","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C37 H46 Cl9 Fe N4 O Sb -","- C37 H46 Cl9 Fe N4 O Sb -","- C148 H184 Cl36 Fe4 N16 O4 Sb4 -","4","1","","Teresa J. Neal; Seong-Joo Kang; Ilona Turowska-Tyrk; Charles E. Schulz; W. Robert Scheidt","Magnetic Interactions in the High-Spin Iron(III) Oxooctaethylchlorinato Derivative [Fe(oxoOEC)(Cl)] and Its π-Cation Radical [Fe(oxoOEC.)(Cl)]SbCl6","Inorganic Chemistry","2000","39","","872","880","10.1021/ic991052w","","","0.71073","MoKα","","0.0583","0.0411","","0.2061","0.1104","","","","1.045","0.775","0.775","","","","","has coordinates","179039","2020-10-21","18:00:00",""
"4300185","13.0776","0.0003","13.3976","0.0002","15.5236","0.0003","72.086","0.001","75.9","0.001","84.375","0.001","2509.25","0.09","173","","173","","","","","","","","","6","P -1","-P 1","2","","","","- C60 H51 B Cl Fe N9 -","- C59.96 H48 B Cl Fe N8.96 -","- C119.92 H96 B2 Cl2 Fe2 N17.92 -","2","1","","Pramatha Payra; Huichang Zhang; Wai Him Kwok; Maosheng Duan; Judith Gallucci; Michael K. Chan","Structural Trends in First-Row Transition-Metal Bis(benzimidazole) Complexes","Inorganic Chemistry","2000","39","","1076","1080","10.1021/ic991075a","","","0.71073","MoKα","","0.0743","0.0441","","0.0987","0.0863","","","","1.061","1.092","1.092","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300186","10.553","0.001","11.193","0.002","15.51","0.002","110.44","0.01","92.03","0.01","110.26","0.009","1584.8","0.4","223","","223","","","","","","","","","6","P -1","-P 1","2","","","","- C33 H34 Cl2 Co N6 O3 -","- C33 H27 Cl2 Co N6 O3 -","- C66 H54 Cl4 Co2 N12 O6 -","2","1","","Pramatha Payra; Huichang Zhang; Wai Him Kwok; Maosheng Duan; Judith Gallucci; Michael K. Chan","Structural Trends in First-Row Transition-Metal Bis(benzimidazole) Complexes","Inorganic Chemistry","2000","39","","1076","1080","10.1021/ic991075a","","","0.71069","MoKα","","0.1101","0.0511","","0.1598","0.1308","","","","1.311","1.413","1.413","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300187","17.71","0.004","21.293","0.004","21.814","0.003","90","","106.74","0.01","90","","7877","3","213","","213","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C74 H71 Cl4 N19 Ni2 O19 -","- C74 H67 Cl4 N19 Ni2 O19 -","- C296 H268 Cl16 N76 Ni8 O76 -","4","1","","Pramatha Payra; Huichang Zhang; Wai Him Kwok; Maosheng Duan; Judith Gallucci; Michael K. Chan","Structural Trends in First-Row Transition-Metal Bis(benzimidazole) Complexes","Inorganic Chemistry","2000","39","","1076","1080","10.1021/ic991075a","","","0.71069","MoKα","","0.2187","0.0706","","0.2306","0.1694","","","","1.034","1.288","1.288","","","","","has coordinates,has disorder","179039","2020-10-21","18:00:00",""
"4300188","14.1489","0.0002","13.3826","0.0002","15.9805","0.0002","90","","106.575","0.001","90","","2900.16","0.07","193","","193","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C30 H22 Cl2 Cu N6 O8 -","- C30 H22 Cl2 Cu N6 O8 -","- C120 H88 Cl8 Cu4 N24 O32 -","4","1","","Pramatha Payra; Huichang Zhang; Wai Him Kwok; Maosheng Duan; Judith Gallucci; Michael K. Chan","Structural Trends in First-Row Transition-Metal Bis(benzimidazole) Complexes","Inorganic Chemistry","2000","39","","1076","1080","10.1021/ic991075a","","","0.71073","MoKα","","0.0527","0.0426","","0.1214","0.1146","","","","1.037","1.076","1.076","","","","","has coordinates","179039","2020-10-21","18:00:00",""
"4300189","9.497","0.003","13.665","0.005","19.355","0.006","90","","100.57","0.02","90","0.009","2469.2","1.4","293","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C34 H70 Cl4 N12 Ni2 O18 -","- C34 H66 Cl4 N12 Ni2 O18 -","- C68 H132 Cl8 N24 Ni4 O36 -","2","0.5","","Bim Graham; Martin J. Grannas; Milton T. W. Hearn; Christopher M. Kepert; Leone Spiccia; Brian W. Skelton; Allan H. White","Coordination Chemistry of a Novel Tetramacrocyclic Ligand Derived from 1,4,7-Triazacyclononane: Synthesis, Structure, and Properties of Nickel(II) and Copper(II) Complexes","Inorganic Chemistry","2000","39","","1092","1099","10.1021/ic991082z","","","0.71073","MoKα","","0.111","0.063","","0.078","","0.07","","","1.931","","","2.321","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4300190","22.883","0.007","15.131","0.006","20.298","0.008","90","","97.2","0.03","90","","6973","4","293","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C34 H96 Cl6 N12 Ni3 O39 -","- C34 H66 Cl6 N12 Ni3 O39 -","- C136 H264 Cl24 N48 Ni12 O156 -","4","1","","Bim Graham; Martin J. Grannas; Milton T. W. Hearn; Christopher M. Kepert; Leone Spiccia; Brian W. Skelton; Allan H. White","Coordination Chemistry of a Novel Tetramacrocyclic Ligand Derived from 1,4,7-Triazacyclononane: Synthesis, Structure, and Properties of Nickel(II) and Copper(II) Complexes","Inorganic Chemistry","2000","39","","1092","1099","10.1021/ic991082z","","","0.71073","MoKα","","0.365","0.115","","0.125","","0.098","","","1.984","","","2.774","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4300191","16.713","0.007","16.714","0.006","14.775","0.014","90","","108.24","0.05","90","","3920","4","293","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C34 H100 Cl8 Cu4 N12 O49 -","- C34 H66 Cl8 Cu4 N12 O49 -","- C68 H132 Cl16 Cu8 N24 O98 -","2","0.5","","Bim Graham; Martin J. Grannas; Milton T. W. Hearn; Christopher M. Kepert; Leone Spiccia; Brian W. Skelton; Allan H. White","Coordination Chemistry of a Novel Tetramacrocyclic Ligand Derived from 1,4,7-Triazacyclononane: Synthesis, Structure, and Properties of Nickel(II) and Copper(II) Complexes","Inorganic Chemistry","2000","39","","1092","1099","10.1021/ic991082z","","","0.71073","MoKα","","0.14","0.084","","0.121","","0.099","","","1.084","","","1.333","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4300192","9.5705","0.0001","13.0646","0.0001","20.1298","0.0002","90","","103.162","0.0008","90","","2450.81","0.04","273.2","","273.2","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C34 H66 Cl4 Cu2 N12 O19 -","- C34 H66 Cl4 Cu2 N12 O20 -","- C68 H132 Cl8 Cu4 N24 O40 -","2","0.5","","Bim Graham; Martin J. Grannas; Milton T. W. Hearn; Christopher M. Kepert; Leone Spiccia; Brian W. Skelton; Allan H. White","Coordination Chemistry of a Novel Tetramacrocyclic Ligand Derived from 1,4,7-Triazacyclononane: Synthesis, Structure, and Properties of Nickel(II) and Copper(II) Complexes","Inorganic Chemistry","2000","39","","1092","1099","10.1021/ic991082z","","","0.7107","MoKalpha","","","0.0424","","","0.0545","","","","","4.029","4.029","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300193","21.4717","0.001","6.8615","0.0003","18.8797","0.0009","90","","90","","90","","2781.5","0.2","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C9 H36 N15 Nd O15 -","- C9 H30 N15 Nd O15 -","- C36 H120 N60 Nd4 O60 -","4","1","","Wolfgang Runde; Mary P. Neu; Craig Van Pelt; Brian L. Scott","Single Crystal and Solution Complex Structure of Nd(CO3)45-. The First Characterization of a Mononuclear Lanthanide(III) Carbonato Complex","Inorganic Chemistry","2000","39","","1050","1051","10.1021/ic991087w","","","0.71073","MoKα","","0.0215","0.0192","","","0.0498","0.0508","","","","","","1.112","","","","has coordinates","120081","2020-10-21","18:00:00",""
"4300194","13.7952","0.0001","22.3133","0.0002","34.4393","0.0002","90","","90.933","0.001","90","","10599.6","0.14","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C18 H83 Na6 O102.5 Sb2 Sn3 W18 -","- C18 Na6 O102.5 Sb2 Sn3 W18 -","- C72 Na24 O410 Sb8 Sn12 W72 -","4","1","","Gerta Sazani; Michael H. Dickman; Michael T. Pope","Organotin Derivatives of α-[XIIIW9O33]9- (X = As, Sb) Heteropolytungstates. Solution- and Solid-State Characterization of [{(C6H5Sn)2O}2H(α-AsW9O33)2]9- and [(C6H5Sn)3Na3(α-SbW9O33)2]6-","Inorganic Chemistry","2000","39","","939","943","10.1021/ic991095c","","","0.71073","MoKα","","0.0901","0.0716","","","0.1506","0.1573","","","","","","1.188","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300195","15.272","0.006","15.303","0.006","16.76","0.007","93.59","0.03","106.187","0.019","112.23","0.03","3419","3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 As2 Na4 O93.88 Sn4 W18 -","- C24 As2 Na4 O93.88 Sn4 W18 -","- C24 As2 Na4 O93.88 Sn4 W18 -","1","0.5","","Gerta Sazani; Michael H. Dickman; Michael T. Pope","Organotin Derivatives of α-[XIIIW9O33]9- (X = As, Sb) Heteropolytungstates. Solution- and Solid-State Characterization of [{(C6H5Sn)2O}2H(α-AsW9O33)2]9- and [(C6H5Sn)3Na3(α-SbW9O33)2]6-","Inorganic Chemistry","2000","39","","939","943","10.1021/ic991095c","","","0.71073","MoKα","","0.1157","0.1062","","","0.306","0.3187","","","","","","1.114","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4300196","9.4257","0.0005","13.4119","0.0007","13.614","0.0007","72.842","0.001","82.082","0.001","75.414","0.001","1587.69","0.14","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C20 H41 F6 N5 O9 Rh S2 -","- C20 H41 F6 N5 O9 Rh S2 -","- C40 H82 F12 N10 O18 Rh2 S4 -","2","1","","Andreja Bakac; Ilia A. Guzei","Hydrogen Atom and Hydride Transfer in the Reactions of Chromium(IV) and Chromium(V) Complexes with Rhodium Hydrides. Crystal Structure of a Superoxorhodium(III) Product","Inorganic Chemistry","2000","39","","736","740","10.1021/ic991098p","","","0.71073","MoKα","","0.0641","0.0549","","","0.156","0.1639","","","","","","1.071","","","","has coordinates,has disorder","120081","2020-10-21","18:00:00",""
"4300197","8.901","0.005","18.141","0.01","12.705","0.007","90","","101.66","0.02","90","","2009.3","1.9","298","","298","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","tpo1","","","- C38 H47 B12 O P2 -","- C38 H44 B12 O P2 -","- C76 H88 B24 O2 P4 -","2","0.5","","Toralf Peymann; Carolyn B. Knobler; M. Frederick Hawthorne","A Study of the Sequential Acid-Catalyzed Hydroxylation of Dodecahydro-closo-Dodecaborate(2-)","Inorganic Chemistry","2000","39","","1163","1170","10.1021/ic991105+","","","","","","","0.0576","","","0.1427","","","","","","","","","","","has coordinates","179039","2020-10-21","18:00:00",""
"4300198","8.876","0.004","18.472","0.008","12.711","0.005","90","","101.175","0.014","90","","2044.6","1.5","298","","298","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","b12o2p","","","- C38 H48 B12 O2 P2 -","- C38 H45.74 B12 O2 P2 -","- C76 H91.48 B24 O4 P4 -","2","0.5","","Toralf Peymann; Carolyn B. Knobler; M. Frederick Hawthorne","A Study of the Sequential Acid-Catalyzed Hydroxylation of Dodecahydro-closo-Dodecaborate(2-)","Inorganic Chemistry","2000","39","","1163","1170","10.1021/ic991105+","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","179039","2020-10-21","18:00:00",""
"4300199","25.305","0.017","16.533","0.011","12.813","0.008","90","","118.79","0.02","90","","4698.2","5.3","","","298","","","","","","","","","7","C 1 c 1","C -2yc","9","tptis","bis(methyltriphenylphosphonium) (cpCl~2~TiO)-undecahydro-closo-dodecaborate (2-)","","- C43 H52 B12 Cl2 O P2 Ti -","- C43 H52 B12 Cl2 O P2 Ti -","- C172 H208 B48 Cl8 O4 P8 Ti4 -","4","1","","Toralf Peymann; Carolyn B. Knobler; M. Frederick Hawthorne","A Study of the Sequential Acid-Catalyzed Hydroxylation of Dodecahydro-closo-Dodecaborate(2-)","Inorganic Chemistry","2000","39","","1163","1170","10.1021/ic991105+","","","","","","","0.0851","","","0.2137","","","","","","","","","","","has coordinates","179039","2020-10-21","18:00:00",""
"4300200","15.509","0.008","9.93","0.005","17.265","0.009","90","","112.36","0.02","90","","2459.2","2.2","298","","298","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","tpoms","","","- C14 H28 B12 N O3 S -","- C12 H28 B12 N2 O6 S2 -","- C48 H112 B48 N8 O24 S8 -","4","1","","Toralf Peymann; Carolyn B. Knobler; M. Frederick Hawthorne","A Study of the Sequential Acid-Catalyzed Hydroxylation of Dodecahydro-closo-Dodecaborate(2-)","Inorganic Chemistry","2000","39","","1163","1170","10.1021/ic991105+","","","","","","","0.0611","","","0.1608","","","","","","","","","","","has coordinates","179040","2020-10-21","18:00:00",""
"4300201","12.501","0.001","22.807","0.002","18.125","0.002","90","","90.94","0.02","90","","5166.9","0.8","293","","293","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C53.75 H38.75 Cl2.25 N5 O4 S Tl -","- C53 H39 Cl3 N5 O4 S Tl -","- C212 H156 Cl12 N20 O16 S4 Tl4 -","4","1","","Jo-Yu Tung; Jyh-Iuan Jang; Chu-Chieh Lin; Jyh-Horung Chen; Lian-Pin Hwang","Metal Complexes of N-Tosylamidoporphyrin: cis-Acetato-N-tosylimido- -meso-tetraphenylporphyrinatothallium(III) and trans-Acetato-N-tosylimido- -meso-tetraphenylporphyrinatogallium(III)","Inorganic Chemistry","2000","39","","1106","1112","10.1021/ic9911318","","","0.71073","MoKα","","0.093","0.0487","","","0.0585","0.0705","","","","","","1.2","","","","has coordinates","130086","2020-10-21","18:00:00",""
"4300202","11.5126","0.0008","12.9912","0.0009","16.7857","0.0011","82.661","0.001","72.578","0.001","73.461","0.001","2293.8","0.3","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","","","- C53 H38 Ga N5 O4 S -","- C53 H38 Ga N5 O4 S -","- C106 H76 Ga2 N10 O8 S2 -","2","1","","Jo-Yu Tung; Jyh-Iuan Jang; Chu-Chieh Lin; Jyh-Horung Chen; Lian-Pin Hwang","Metal Complexes of N-Tosylamidoporphyrin: cis-Acetato-N-tosylimido- -meso-tetraphenylporphyrinatothallium(III) and trans-Acetato-N-tosylimido- -meso-tetraphenylporphyrinatogallium(III)","Inorganic Chemistry","2000","39","","1106","1112","10.1021/ic9911318","","","0.71073","MoKα","","0.1785","0.0543","","","0.0915","0.117","","","","","","0.834","","","","has coordinates","130086","2020-10-21","18:00:00",""
"4300203","7.937","0.003","8.831","0.005","11.031","0.009","103.63","0.05","94.55","0.05","100.61","0.04","732.4","0.8","200","2","200","2","","","","","","","","6","P -1","-P 1","2","[Ag2(hfpd)2([14]aneS4)]n","[Ag2(hfpd)2([14]aneS4)]n","","- C20 H22 Ag2 F12 O4 S4 -","- C20 H22 Ag2 F12 O4 S4 -","- C20 H22 Ag2 F12 O4 S4 -","1","0.5","","Alexander J. Blake; Neil R. Champness; Steven M. Howdle; Paul B. Webb","Silver(I) Coordination Polymers Using Thioether Macrocycle Building Blocks","Inorganic Chemistry","2000","39","","1035","1038","10.1021/ic991145d","","","0.71073","MoKα","","0.04","0.0362","","","0.0839","0.0876","","","","","","1.098","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4300204","14.98","0.003","7.228","0.002","15.224","0.004","90","","101.9","0.02","90","","1613","0.7","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","[Ag(hfpd)([9]aneS3)]n","[Ag(hfpd)([9]aneS3)]n","","- C11 H13 Ag F6 O2 S3 -","- C11 H13 Ag F6 O2 S3 -","- C44 H52 Ag4 F24 O8 S12 -","4","1","","Alexander J. Blake; Neil R. Champness; Steven M. Howdle; Paul B. Webb","Silver(I) Coordination Polymers Using Thioether Macrocycle Building Blocks","Inorganic Chemistry","2000","39","","1035","1038","10.1021/ic991145d","","","0.71073","MoKα","","0.0433","0.039","","","0.0862","0.0906","","","","","","1.083","","","","has coordinates,has disorder","171491","2020-10-21","18:00:00",""
"4300205","8.744","0.0003","24.2608","0.0003","12.7236","0.0004","90","","102.844","0.002","90","","2631.6","0.13","213","2","213","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H37 N O S4 W -","- C22 H37 N O S4 W -","- C88 H148 N4 O4 S16 W4 -","4","1","","Kie-Moon Sung; R. H. Holm","Synthesis and Structures of Bis(dithiolene)-Tungsten(IV) Complexes Related to the Active Sites of Tungstoenzymes","Inorganic Chemistry","2000","39","","1275","1281","10.1021/ic991153u","","","0.71073","MoKα","","0.0614","0.036","","","0.0687","0.0731","","","","","","1.004","","","","has coordinates,has disorder","134573","2020-10-21","18:00:00",""
"4300206","10.1257","0.0002","16.1756","0.0001","25.8216","0.0005","88.915","0.001","82.5","","84.242","0.001","4171.89","0.12","213","2","213","2","","","","","","","","6","P -1","-P 1","2","","","","- C23 H37 N O S5 W -","- C23 H37 N O S5 W -","- C138 H222 N6 O6 S30 W6 -","6","3","","Kie-Moon Sung; R. H. Holm","Synthesis and Structures of Bis(dithiolene)-Tungsten(IV) Complexes Related to the Active Sites of Tungstoenzymes","Inorganic Chemistry","2000","39","","1275","1281","10.1021/ic991153u","","","0.71073","MoKα","","0.0584","0.0386","","","0.0742","0.0772","","","","","","1.014","","","","has coordinates","134573","2020-10-21","18:00:00",""
"4300207","25.4814","0.0005","16.9145","0.0002","17.1093","0.0004","90","","90","","90","","7374.2","0.2","213","2","213","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C32 H55 N O S5 W -","- C32 H55 N O S5 W -","- C256 H440 N8 O8 S40 W8 -","8","1","","Kie-Moon Sung; R. H. Holm","Synthesis and Structures of Bis(dithiolene)-Tungsten(IV) Complexes Related to the Active Sites of Tungstoenzymes","Inorganic Chemistry","2000","39","","1275","1281","10.1021/ic991153u","","","0.71073","MoKα","","0.0786","0.0612","","0.1171","0.1132","","","","1.191","1.299","1.299","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300208","19.2516","0.0004","19.2618","0.0003","19.3633","0.0004","103.497","0.001","104.794","0.001","116.17","0.001","5713.9","0.2","213","2","213","2","","","","","","","","7","P -1","-P 1","2","","","","- C23 H37 N O S4 Se W -","- C23 H37 N O S4 Se W -","- C184 H296 N8 O8 S32 Se8 W8 -","8","4","","Kie-Moon Sung; R. H. Holm","Synthesis and Structures of Bis(dithiolene)-Tungsten(IV) Complexes Related to the Active Sites of Tungstoenzymes","Inorganic Chemistry","2000","39","","1275","1281","10.1021/ic991153u","","","0.71073","MoKα","","0.1021","0.0479","","","0.0716","0.0823","","","","","","0.951","","","","has coordinates,has disorder","134573","2020-10-21","18:00:00",""
"4300209","25.5714","0.0007","16.8328","0.0004","17.2163","0.0005","90","","90","","90","","7410.6","0.3","213","2","213","2","","","","","","","","7","P b c n","-P 2n 2ab","60","","","","- C32 H55 N O S4 Se W -","- C32 H55 N O S4 Se W -","- C256 H440 N8 O8 S32 Se8 W8 -","8","1","","Kie-Moon Sung; R. H. Holm","Synthesis and Structures of Bis(dithiolene)-Tungsten(IV) Complexes Related to the Active Sites of Tungstoenzymes","Inorganic Chemistry","2000","39","","1275","1281","10.1021/ic991153u","","","0.71073","MoKα","","0.0393","0.0286","","","0.0728","0.0788","","","","","","1.019","","","","has coordinates","134573","2020-10-21","18:00:00",""
"4300215","15.8538","0.0008","13.4781","0.0004","31.9115","0.0012","90","","103.044","0.003","90","","6642.9","0.5","213","2","213","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C70 H68 Cl3 Co3 N13 -","- C70 H65 Cl3 Co3 N13 -","- C280 H260 Cl12 Co12 N52 -","4","1","","F. Albert Cotton; Carlos A. Murillo; Hong-Cai Zhou","A Dinuclear Cation with Both Four- and Five-Coordinate Cobalt(II)","Inorganic Chemistry","2000","39","","1039","1041","10.1021/ic991186+","","","","","","","0.044","","","0.1009","","","","","","","","","","","has coordinates","179040","2020-10-21","18:00:00",""
"4300216","16.904","0.003","17.328","0.004","23.828","0.005","98.21","0.03","99.91","0.03","105.84","0.03","6480","2","158","2","158","2","","","","","","","","8","P -1","-P 1","2","","","","- C63 H72 Co2 F12 Li N9 O3 P2 -","- C63 H72 Co2 F12 Li N9 O3 P2 -","- C252 H288 Co8 F48 Li4 N36 O12 P8 -","4","2","","F. Albert Cotton; Carlos A. Murillo; Hong-Cai Zhou","A Dinuclear Cation with Both Four- and Five-Coordinate Cobalt(II)","Inorganic Chemistry","2000","39","","1039","1041","10.1021/ic991186+","","","","","","","0.0613","","","0.1409","","","","","","","","","","","has coordinates","277859","2022-09-15","00:05:25",""
"4300217","19.268","0.0007","20.562","0.007","27.777","0.007","74.784","0.006","76.967","0.01","75.952","0.014","10146","4","213","2","213","2","","","","","","","","5","P -1","-P 1","2","","","","- C104 H100 Cl8 Co5 N18 -","- C104 H99 Cl8 Co5 N18 -","- C416 H396 Cl32 Co20 N72 -","4","2","","F. Albert Cotton; Carlos A. Murillo; Hong-Cai Zhou","A Dinuclear Cation with Both Four- and Five-Coordinate Cobalt(II)","Inorganic Chemistry","2000","39","","1039","1041","10.1021/ic991186+","","","","","","","0.1175","","","0.2801","","","","","","","","","","","has coordinates","277859","2022-09-15","00:05:25",""
"4300218","8.92","0.003","10.911","0.002","8.373","0.001","106.86","0.01","97.37","0.02","92.28","0.02","770.9","0.3","296.2","","","","","","","","","","","7","P -1","-P 1","2","","","","- C18 H26 K N2 Ni O4 S10 -","- C18 K N2 Ni O4 S10 -","- C18 K N2 Ni O4 S10 -","1","0.5","","Nobuhiro Takamatsu; Tomoyuki Akutagawa; Tatsuo Hasegawa; Takayoshi Nakamura; Tamotsu Inabe; Wataru Fujita; Kunio Awaga","One-Dimensional Antiferromagnetic Chain in [Ni(dmit)2]- Salts of [K+ or Rb+(4,13-diaza-18-crown-6)] Supramolecular Cation","Inorganic Chemistry","2000","39","","870","871","10.1021/ic991198v","","","0.7107","MoKα","","","0.0425","","","0.0461","","","","1.084","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300219","8.815","0.005","11.04","0.02","8.51","0.01","107.8","0.1","97.53","0.09","91.5","0.1","779.8","1.8","296.2","","","","","","","","","","","7","P -1","-P 1","2","","","","- C18 H26 N2 Ni O4 Rb S10 -","- C18 N2 Ni O4 Rb S10 -","- C18 N2 Ni O4 Rb S10 -","1","0.5","","Nobuhiro Takamatsu; Tomoyuki Akutagawa; Tatsuo Hasegawa; Takayoshi Nakamura; Tamotsu Inabe; Wataru Fujita; Kunio Awaga","One-Dimensional Antiferromagnetic Chain in [Ni(dmit)2]- Salts of [K+ or Rb+(4,13-diaza-18-crown-6)] Supramolecular Cation","Inorganic Chemistry","2000","39","","870","871","10.1021/ic991198v","","","0.7107","MoKα","","","0.0578","","","","0.0686","","","","","","5.564","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300220","10.2039","0.0011","15.1935","0.0015","22.096","0.002","90","","98.299","0.006","90","","3389.7","0.6","193","2","193","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","[(CF3)2Tp]Sn(CF3SO3).(CF3)2PzH","","","- C21 H6 B F27 N8 O3 S Sn -","- C21 H6 B F27 N8 O3 S Sn -","- C84 H24 B4 F108 N32 O12 S4 Sn4 -","4","1","","H. V. Rasika Dias; Wiechang Jin","Low-Valent Gallium, Indium, and Tin Compounds That Contain a Highly Fluorinated Tris(pyrazolyl)borate Ligand: Syntheses and Characterization of [HB(3,5-(CF3)2Pz)3]Ga, [HB(3,5-(CF3)2Pz)3]In, and [HB(3,5-(CF3)2Pz)3]Sn(CF3SO3)","Inorganic Chemistry","2000","39","","815","819","10.1021/ic9912171","","","0.71073","MoKα","","0.0347","0.029","","","0.0749","0.0783","","","","","","1.068","","","","has coordinates","120081","2020-10-21","18:00:00",""
"4300221","19.159","0.003","19.159","0.003","20.717","0.004","90","","90","","120","","6585.7","1.9","183","2","183","2","","","","","","","","7","P -3","-P 3","147","[(CF3)2Tp]Ga-GaI3.2(toluene)","","","- C29 H20 B F18 Ga2 I3 N6 -","- C29 H3 B F18 Ga2 I3 N6 -","- C174 H18 B6 F108 Ga12 I18 N36 -","6","1","","H. V. Rasika Dias; Wiechang Jin","Low-Valent Gallium, Indium, and Tin Compounds That Contain a Highly Fluorinated Tris(pyrazolyl)borate Ligand: Syntheses and Characterization of [HB(3,5-(CF3)2Pz)3]Ga, [HB(3,5-(CF3)2Pz)3]In, and [HB(3,5-(CF3)2Pz)3]Sn(CF3SO3)","Inorganic Chemistry","2000","39","","815","819","10.1021/ic9912171","","","0.71073","MoKα","","0.0854","0.0624","","","0.1505","0.1628","","","","","","1.085","","","","has coordinates","120081","2020-10-21","18:00:00",""
"4300222","17.766","0.011","17.159","0.01","25.958","0.009","90","","106.3","0.04","90","","7595","7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C73 H93 Cl3 N4 O24 -","- C72.6 H88 Cl1.8 N4 O24 -","- C290.4 H352 Cl7.2 N16 O96 -","4","1","","O. Danny Fox; Jenny F.-Y. Leung; Jesse M. Hunter; N. Kent Dalley; Roger G. Harrison","Metal-Assembled Cobalt(II) Resorc[4]arene-Based Cage Molecules That Reversibly Capture Organic Molecules from Water and Act as NMR Shift Reagents","Inorganic Chemistry","2000","39","","783","790","10.1021/ic991235i","","","0.71073","MoKα","","0.1854","0.0819","","0.28","0.1872","","","","1.055","1.203","1.203","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300223","20.118","0.002","20.118","0.002","54.351","0.015","90","","90","","90","","21998","7","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C122.52 H160 Ba4 Co4 N8 O75 -","- C122.4 H104 Ba4 Co4 N8 O75.28 -","- C489.6 H416 Ba16 Co16 N32 O301.12 -","4","0.25","","O. Danny Fox; Jenny F.-Y. Leung; Jesse M. Hunter; N. Kent Dalley; Roger G. Harrison","Metal-Assembled Cobalt(II) Resorc[4]arene-Based Cage Molecules That Reversibly Capture Organic Molecules from Water and Act as NMR Shift Reagents","Inorganic Chemistry","2000","39","","783","790","10.1021/ic991235i","","","0.71073","MoKα","","0.197","0.0988","","0.3745","0.2586","","","","1.059","1.195","1.195","","","","","has coordinates","179040","2020-10-21","18:00:00",""
"4300224","11.2868","0.0002","11.8235","0.0002","19.2928","0.0002","83.9944","0.0004","76.9762","0.0003","74.8476","0.0007","2418.32","0.06","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C45 H68 B2 Co N12 -","- C45 H68 B2 Co N12 -","- C90 H136 B4 Co2 N24 -","2","1","","Arnold L. Rheingold; Louise M. Liable-Sands; Swiatoslaw Trofimenko","Analogues of the Tp* Ligand Containing a 3-Me but Non-Methyl 5-R Groups","Inorganic Chemistry","2000","39","","1333","1335","10.1021/ic991239n","","","0.71073","MoKα","","0.0817","0.0676","","","0.1422","0.1503","","","","","","1.248","","","","has coordinates","134573","2020-10-21","18:00:00",""
"4300225","11.4344","0.0002","19.4277","0.0003","18.5445","0.0003","90","","99.1385","0.0006","90","","4067.26","0.12","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C42 H64 Mo O5 -","- C42 H64 Mo O5 -","- C168 H256 Mo4 O20 -","4","1","","Tracy A. Hanna; Christopher D. Incarvito; Arnold L. Rheingold","Synthesis and Structural Characterization of a 4-Coordinate Molybdenum(VI) Dioxo Diaryloxide, MoO2(O-2,6-t-Bu2C6H3)2.HO-2,6-t-Bu2C6H3","Inorganic Chemistry","2000","39","","630","631","10.1021/ic991271h","","","0.71073","MoKα","","0.065","0.0486","","","0.1505","0.1675","","","","","","1.25","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4300226","5.3534","0.0004","5.5989","0.0004","10.5851","0.0009","90","","101.055","0.009","90","","311.38","0.04","223","2","223","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","Ammonium Pentafluorosulfanylnitramide","","- F5 H4 N3 O2 S -","- F5 H4 N3 O2 S -","- F10 H8 N6 O4 S2 -","2","0.5","","Michael E. Sitzmann; Richard Gilardi; Ray J. Butcher; William M. Koppes; Alfred G. Stern; Joseph S. Thrasher; Nirupam J. Trivedi; Zhen-Yu Yang","Pentafluorosulfanylnitramide Salts","Inorganic Chemistry","2000","39","","843","850","10.1021/ic991281i","","","1.54178","CuKα","","0.0519","0.0468","","","0.1305","0.1354","","","","","","1.097","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300227","5.17","0.002","5.426","0.001","10.577","0.004","90","","101.49","0.03","90","","290.76","0.17","293","2","293","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","Potassium Pentafluorosulfanylnitramide","","- F5 K N2 O2 S -","- F5 K N2 O2 S -","- F10 K2 N4 O4 S2 -","2","0.5","","Michael E. Sitzmann; Richard Gilardi; Ray J. Butcher; William M. Koppes; Alfred G. Stern; Joseph S. Thrasher; Nirupam J. Trivedi; Zhen-Yu Yang","Pentafluorosulfanylnitramide Salts","Inorganic Chemistry","2000","39","","843","850","10.1021/ic991281i","","","0.71073","MoKα","","0.046","0.0417","","","0.1051","0.1128","","","","","","1.074","","","","has coordinates","120081","2020-10-21","18:00:00",""
"4300228","5.3674","0.0003","12.6148","0.0009","12.5444","0.0012","90","","93.926","0.009","90","","847.37","0.11","293","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Guanidinium Pentafluorosulfanylnitramide","","- C H6 F5 N5 O2 S -","- C H6 F5 N5 O2 S -","- C4 H24 F20 N20 O8 S4 -","4","1","","Michael E. Sitzmann; Richard Gilardi; Ray J. Butcher; William M. Koppes; Alfred G. Stern; Joseph S. Thrasher; Nirupam J. Trivedi; Zhen-Yu Yang","Pentafluorosulfanylnitramide Salts","Inorganic Chemistry","2000","39","","843","850","10.1021/ic991281i","","","1.54178","CuKα","","0.0573","0.0556","","","0.1494","0.1518","","","","","","1.11","","","","has coordinates","120081","2020-10-21","18:00:00",""
"4300229","7.0662","0.0008","8.0961","0.001","8.3129","0.0009","92.18","0.009","107.875","0.009","99.145","0.007","444.95","0.09","293","2","294","2","","","","","","","","6","P -1","-P 1","2","","Aminoguanidinium Pentafluorosulfanylnitramide","","- C H7 F5 N6 O2 S -","- C H7 F5 N6 O2 S -","- C2 H14 F10 N12 O4 S2 -","2","1","","Michael E. Sitzmann; Richard Gilardi; Ray J. Butcher; William M. Koppes; Alfred G. Stern; Joseph S. Thrasher; Nirupam J. Trivedi; Zhen-Yu Yang","Pentafluorosulfanylnitramide Salts","Inorganic Chemistry","2000","39","","843","850","10.1021/ic991281i","","","1.54178","CuKα","","0.0628","0.0418","","","0.1","0.1139","","","","","","1.017","","","","has coordinates","120081","2020-10-21","18:00:00",""
"4300230","3.599","0.001","7.279","0.001","13.938","0.002","90","","93.27","0.02","90","","364.54","0.12","293","2","293","2","","","","","","","","4","P 1 c 1","P -2yc","7","","Aminoguanidinium Dinitramide, monoclinic (alpha) polymorph","","- C H7 N7 O4 -","- C H7 N7 O4 -","- C2 H14 N14 O8 -","2","1","","Michael E. Sitzmann; Richard Gilardi; Ray J. Butcher; William M. Koppes; Alfred G. Stern; Joseph S. Thrasher; Nirupam J. Trivedi; Zhen-Yu Yang","Pentafluorosulfanylnitramide Salts","Inorganic Chemistry","2000","39","","843","850","10.1021/ic991281i","","","1.54178","CuKα","","0.0353","0.0348","","","0.0836","0.0848","","","","","","1.153","","","","has coordinates","120081","2020-10-21","18:00:00",""
"4300231","7.097","0.003","7.36","0.003","8.251","0.003","105.34","0.03","94.59","0.04","115.12","0.03","367.1","0.3","293","2","294","2","","","","","","","","4","P -1","-P 1","2","","Aminoguanidinium Dinitramide, triclinic (beta) polymorph","","- C H7 N7 O4 -","- C H7 N7 O4 -","- C2 H14 N14 O8 -","2","1","","Michael E. Sitzmann; Richard Gilardi; Ray J. Butcher; William M. Koppes; Alfred G. Stern; Joseph S. Thrasher; Nirupam J. Trivedi; Zhen-Yu Yang","Pentafluorosulfanylnitramide Salts","Inorganic Chemistry","2000","39","","843","850","10.1021/ic991281i","","","1.54178","CuKα","","0.0764","0.0481","","","0.1113","0.128","","","","","","1.051","","","","has coordinates","120081","2020-10-21","18:00:00",""
"4300232","13.8313","0.0009","23.3259","0.0015","14.3529","0.0009","90","","115.191","0.001","90","","4190.2","0.5","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C86 H122 Li6 O6 -","- C86 H122 Li6 O6 -","- C172 H244 Li12 O12 -","2","0.5","","Maarten B. Dinger; Michael J. Scott","Alkali Salts of C3-Symmetric, Linked Aryloxides: Selective Binding of Substrates with Metal Aggregates","Inorganic Chemistry","2000","39","","1238","1254","10.1021/ic991309q","","","0.71073","MoKα","","0.0934","0.0608","","","0.1385","0.1568","","","","","","1.021","","","","has coordinates,has disorder","120081","2020-10-21","18:00:00",""
"4300233","14.3125","0.0002","18.2525","0.0004","21.9963","0.0004","90","","93.497","0.001","90","","5735.59","0.18","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C112.67 H175.34 Na6 O12.66 -","- C112.64 H175.28 Na6 O12.66 -","- C225.28 H350.56 Na12 O25.32 -","2","0.5","","Maarten B. Dinger; Michael J. Scott","Alkali Salts of C3-Symmetric, Linked Aryloxides: Selective Binding of Substrates with Metal Aggregates","Inorganic Chemistry","2000","39","","1238","1254","10.1021/ic991309q","","","0.71073","MoKα","","0.1152","0.0731","","","0.2002","0.235","","","","","","1.052","","","","has coordinates","120081","2020-10-21","18:00:00",""
"4300234","14.423","0.0016","14.423","0.0016","50.468","0.008","90","","90","","120","","9092","2","173","2","173","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C106.6 H163.2 Cl17.2 Na6 O6 -","- C106.58 H158 Cl17.18 Na6 O6 -","- C319.74 H474 Cl51.54 Na18 O18 -","3","0.166667","","Maarten B. Dinger; Michael J. Scott","Alkali Salts of C3-Symmetric, Linked Aryloxides: Selective Binding of Substrates with Metal Aggregates","Inorganic Chemistry","2000","39","","1238","1254","10.1021/ic991309q","","","0.71073","MoKα","","0.0755","0.0681","","","0.182","0.1928","","","","","","1.098","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4300235","14.436","","18.3559","0.0001","22.1571","0.0002","90","","94.538","0.001","90","","5852.91","0.06","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C114 H178 K6 O13 -","- C114 H178 K6 O13 -","- C228 H356 K12 O26 -","2","0.5","","Maarten B. Dinger; Michael J. Scott","Alkali Salts of C3-Symmetric, Linked Aryloxides: Selective Binding of Substrates with Metal Aggregates","Inorganic Chemistry","2000","39","","1238","1254","10.1021/ic991309q","","","0.71073","MoKα","","0.1236","0.0683","","","0.1759","0.2105","","","","","","1.053","","","","has coordinates","120081","2020-10-21","18:00:00",""
"4300236","18.5828","0.0005","18.6385","0.0006","28.3267","0.0009","90","","90","","90","","9811.1","0.5","173","2","173","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","","","- C93 H136 K6 O12.25 -","- C93 H136 K6 O12.25 -","- C372 H544 K24 O49 -","4","0.5","","Maarten B. Dinger; Michael J. Scott","Alkali Salts of C3-Symmetric, Linked Aryloxides: Selective Binding of Substrates with Metal Aggregates","Inorganic Chemistry","2000","39","","1238","1254","10.1021/ic991309q","","","0.71073","MoKα","","0.1292","0.0733","","","0.1935","0.2362","","","","","","1.008","","","","has coordinates","120081","2020-10-21","18:00:00",""
"4300237","14.0195","0.0006","26.7815","0.0012","14.3197","0.0007","90","","98.025","0.001","90","","5323.9","0.4","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C104.67 H168.67 Na6 O10.67 -","- C104.72 H168.8 Na6 O10.68 -","- C209.44 H337.6 Na12 O21.36 -","2","0.5","","Maarten B. Dinger; Michael J. Scott","Alkali Salts of C3-Symmetric, Linked Aryloxides: Selective Binding of Substrates with Metal Aggregates","Inorganic Chemistry","2000","39","","1238","1254","10.1021/ic991309q","","","0.71073","MoKα","","0.1334","0.0828","","","0.2233","0.2622","","","","","","1.017","","","","has coordinates","120081","2020-10-21","18:00:00",""
"4300238","14.2323","0.0002","14.8545","0.0003","18.3521","0.0004","105.439","0.001","109.517","0.001","99.182","0.001","3390.56","0.12","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C144 H178 Na6 O12 -","- C144.14 H170 Na6 O12 -","- C144.14 H170 Na6 O12 -","1","0.5","","Maarten B. Dinger; Michael J. Scott","Alkali Salts of C3-Symmetric, Linked Aryloxides: Selective Binding of Substrates with Metal Aggregates","Inorganic Chemistry","2000","39","","1238","1254","10.1021/ic991309q","","","0.71073","MoKα","","0.1462","0.0833","","","0.2221","0.2719","","","","","","1.033","","","","has coordinates,has disorder","120081","2020-10-21","18:00:00",""
"4300239","17.5872","0.0003","18.4231","0.0003","24.0992","0.0003","75.143","0.001","89.762","0.001","64.039","0.001","6733.07","0.19","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C142 H175 Na6 O12.5 -","- C142 H175 Na6 O12.5 -","- C284 H350 Na12 O25 -","2","1","","Maarten B. Dinger; Michael J. Scott","Alkali Salts of C3-Symmetric, Linked Aryloxides: Selective Binding of Substrates with Metal Aggregates","Inorganic Chemistry","2000","39","","1238","1254","10.1021/ic991309q","","","0.71073","MoKα","","0.1246","0.0755","","","0.184","0.2221","","","","","","1.1","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4300240","18.3501","0.0008","20.471","0.0009","19.9503","0.0009","90","","102.172","0.001","90","","7325.8","0.6","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C150 H216 Na6 O13 -","- C150 H216 Na6 O13 -","- C300 H432 Na12 O26 -","2","0.5","","Maarten B. Dinger; Michael J. Scott","Alkali Salts of C3-Symmetric, Linked Aryloxides: Selective Binding of Substrates with Metal Aggregates","Inorganic Chemistry","2000","39","","1238","1254","10.1021/ic991309q","","","0.71073","MoKα","","0.1962","0.0727","","","0.2032","0.2582","","","","","","0.987","","","","has coordinates","120081","2020-10-21","18:00:00",""
"4300241","24.1127","0.0012","24.1127","0.0012","37.981","0.002","90","","90","","120","","19124.4","1.7","173","2","173","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C134 H206 Na6 O12 -","- C134 H206 Na6 O12 -","- C804 H1236 Na36 O72 -","6","0.333333","","Maarten B. Dinger; Michael J. Scott","Alkali Salts of C3-Symmetric, Linked Aryloxides: Selective Binding of Substrates with Metal Aggregates","Inorganic Chemistry","2000","39","","1238","1254","10.1021/ic991309q","","","0.71073","MoKα","","0.0795","0.0552","","","0.1469","0.166","","","","","","1.02","","","","has coordinates","179040","2020-10-21","18:00:00",""
"4300242","19.9111","0.0013","15.5275","0.001","24.8733","0.0016","90","","91.051","0.001","90","","7688.8","0.9","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C153.6 H234 Na6 O18.4 -","- C153.6 H234 Na6 O18.4 -","- C307.2 H468 Na12 O36.8 -","2","0.5","","Maarten B. Dinger; Michael J. Scott","Alkali Salts of C3-Symmetric, Linked Aryloxides: Selective Binding of Substrates with Metal Aggregates","Inorganic Chemistry","2000","39","","1238","1254","10.1021/ic991309q","","","0.71073","MoKα","","0.1241","0.0747","","","0.2032","0.2396","","","","","","1.029","","","","has coordinates,has disorder","289785","2024-02-12","08:29:27",""
"4300243","24.8459","0.0013","25.3049","0.0014","21.5905","0.0012","90","","91.816","0.001","90","","13567.6","1.3","135","2","135","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C134.4 H209.4 Na6 O12.5 -","- C134.4 H206.9 Na6 O12.5 -","- C537.6 H827.6 Na24 O50 -","4","1","","Maarten B. Dinger; Michael J. Scott","Alkali Salts of C3-Symmetric, Linked Aryloxides: Selective Binding of Substrates with Metal Aggregates","Inorganic Chemistry","2000","39","","1238","1254","10.1021/ic991309q","","","0.71073","MoKα","","0.1501","0.0968","","","0.2774","0.3336","","","","","","1.113","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4300244","15.609","0.004","6.8766","0.0015","15.17","0.005","90","","113.05","0.017","90","","1498.3","0.7","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H18 N4 O4 -","- C14 H18 N4 O4 -","- C56 H72 N16 O16 -","4","1","","Maarten B. Dinger; Michael J. Scott","Alkali Salts of C3-Symmetric, Linked Aryloxides: Selective Binding of Substrates with Metal Aggregates","Inorganic Chemistry","2000","39","","1238","1254","10.1021/ic991309q","","","0.71073","MoKα","","0.0945","0.0444","","","0.1046","0.1379","","","","","","1.017","","","","has coordinates","120081","2020-10-21","18:00:00",""
"4300245","24.8459","0.0013","25.3049","0.0014","21.5905","0.0012","90","","91.816","0.001","90","","13567.6","1.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C134.4 H209.4 Na6 O12.5 -","- C134.4 H206.9 Na6 O12.5 -","- C537.6 H827.6 Na24 O50 -","4","1","","Maarten B. Dinger; Michael J. Scott","Alkali Salts of C3-Symmetric, Linked Aryloxides: Selective Binding of Substrates with Metal Aggregates","Inorganic Chemistry","2000","39","","1238","1254","10.1021/ic991309q","","","0.71073","MoKα","","0.15","0.0967","","","0.2776","0.3295","","","","","","1.098","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4300246","17.737","0.002","17.737","0.002","15.6915","0.0006","90","","90","","90","","4936.6","0.8","213","2","213","2","","","","","","","synthesized","6","I 41/a :2","-I 4ad","88","","1,1,2,2-bis(n-propylamine)-bis(trimethylphosphine)-tetrachloro- -di-molybdenum (II, II)","","- C12 H36 Cl4 Mo2 N2 P2 -","- C12 H36 Cl4 Mo2 N2 P2 -","- C96 H288 Cl32 Mo16 N16 P16 -","8","0.5","","F. Albert Cotton; Evgeny V. Dikarev; Santiago Herrero","Mixed Chloride/Amine Complexes of Dimolybdenum(II,II). 6. Stepwise Substitution of Amines by Tertiary Phosphines and Vice Versa: Stereochemical Hysteresis","Inorganic Chemistry","2000","39","","609","616","10.1021/ic9913684","","","0.71073","MoKα","","0.0326","0.0276","","0.067","0.0625","","","","1.175","1.172","1.172","","","","","has coordinates","179040","2020-10-21","18:00:00",""
"4300247","10.963","0.003","10.117","0.002","13.323","0.004","90","","90.05","0.02","90","","1477.7","0.7","213","2","213","2","","","","","","","synthesized","6","P 1 21 1","P 2yb","4","","1,1,2,2-bis(cyclohexylamine)-bis(trimethylphosphine)-tetrachloro- -di-molybdenum (II, II)","","- C18 H44 Cl4 Mo2 N2 P2 -","- C18 H44 Cl4 Mo2 N2 P2 -","- C36 H88 Cl8 Mo4 N4 P4 -","2","1","","F. Albert Cotton; Evgeny V. Dikarev; Santiago Herrero","Mixed Chloride/Amine Complexes of Dimolybdenum(II,II). 6. Stepwise Substitution of Amines by Tertiary Phosphines and Vice Versa: Stereochemical Hysteresis","Inorganic Chemistry","2000","39","","609","616","10.1021/ic9913684","","","0.71073","MoKα","","0.0381","0.0358","","0.094","0.0909","","","","1.096","1.08","1.08","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300248","9.329","0.003","10.206","0.002","18.975","0.003","85.45","0.02","87.1","0.01","80.88","0.01","1776.9","0.7","213","2","213","2","","","","","","","synthesized","6","P -1","-P 1","2","","1,1,2,2-bis(cyclohexylamine)-bis(dimethylphenyl phosphine)-tetrachloro- -di-molybdenum (II, II)","","- C28 H48 Cl4 Mo2 N2 P2 -","- C28 H48 Cl4 Mo2 N2 P2 -","- C56 H96 Cl8 Mo4 N4 P4 -","2","1","","F. Albert Cotton; Evgeny V. Dikarev; Santiago Herrero","Mixed Chloride/Amine Complexes of Dimolybdenum(II,II). 6. Stepwise Substitution of Amines by Tertiary Phosphines and Vice Versa: Stereochemical Hysteresis","Inorganic Chemistry","2000","39","","609","616","10.1021/ic9913684","","","0.71073","MoKα","","0.0739","0.0547","","0.1391","0.1222","","","","1.155","1.146","1.146","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"4300249","16.8291","0.0009","7.4348","0.0004","12.9117","0.0007","90","","98.71","0.001","90","","1596.89","0.15","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C15 H16 N O2 Re S2 -","- C15 H16 N O2 Re S2 -","- C60 H64 N4 O8 Re4 S8 -","4","1","","Gábor Lente; Ilia A. Guzei; James H. Espenson","Kinetics and Mechanism of the Monomerization of a Re(V) Dithiolato Dimer with Monodentate Ligands. Electronic and Steric Effects","Inorganic Chemistry","2000","39","","1311","1319","10.1021/ic991431p","","","0.71073","MoKα","","0.0281","0.0234","","","0.0604","0.0621","","","","","","1.014","","","","has coordinates","134573","2020-10-21","18:00:00",""
"4300250","26.5431","0.0013","9.465","0.0005","15.6416","0.0007","90","","117.385","0.001","90","","3489.3","0.3","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C13 H21 N2 O Re S3 -","- C13 H21 N2 O Re S3 -","- C104 H168 N16 O8 Re8 S24 -","8","1","","Gábor Lente; Ilia A. Guzei; James H. Espenson","Kinetics and Mechanism of the Monomerization of a Re(V) Dithiolato Dimer with Monodentate Ligands. Electronic and Steric Effects","Inorganic Chemistry","2000","39","","1311","1319","10.1021/ic991431p","","","0.71073","MoKα","","0.0227","0.0193","","","0.0499","0.0513","","","","","","1.024","","","","has coordinates","134573","2020-10-21","18:00:00",""
"4320808","14.536","0.002","22.359","0.003","18.125","0.002","90","","93.7","0.02","90","","5878.5","1.3","301.2","","301.2","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C72 H58 N8 Ru -","- C74 H54 N8 Ru -","- C296 H216 N32 Ru4 -","4","1","","Xian-Ru Sun; Jie-Sheng Huang; Kung-Kai Cheung; Chi-Ming Che","Ruthenium Complexes with a Terminal Hydrazido Ligand. Synthesis, Spectroscopy, and X-ray Crystal Structure","Inorganic Chemistry","2000","39","","820","826","10.1021/ic990467e","","","0.7107","MoKalpha","","","0.0457","","","0.0618","","","","","1.577","1.577","","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320809","5.6635","0.0019","5.6635","","5.6635","","90","","90","","90","","181.66","0.06","","","423","2","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","","- Cl Na -","- Cl Na -","- Cl4 Na4 -","4","0.0208333","","Barbara Jürgens; Elisabeth Irran; Julius Schneider; Wolfgang Schnick","Trimerization of NaC2N3 to Na3C6N9 in the Solid: Ab Initio Crystal Structure Determination of Two Polymorphs of NaC2N3 and of Na3C6N9 from X-ray Powder Diffractometry","Inorganic Chemistry","2000","39","","665","670","10.1021/ic991044f","powder diffraction","","","","","","","","","","","","","1.27","","","","","","","has coordinates,has Fobs","179311","2020-10-21","18:00:00",""
"4320810","13.007","0.002","13.007","0.002","11.581","0.002","90","","90","","90","","1959.3","0.5","200","2","200","2","","","","","","","","5","P 42/n m c :2","-P 4ac 2a","137","","","","- C6 H15 I Li N -","- C6 H15 I Li N -","- C48 H120 I8 Li8 N8 -","8","0.5","","C. Doriat; R. Köppe; E. Baum; G. Stösser; H. Köhnlein; H. Schnöckel","Molecular Lattice Fragment of LiI. Crystal Structure and ab Initio Calculations of [LiI(NEt3)]4","Inorganic Chemistry","2000","39","","1534","1537","10.1021/ic9903432","","","0.71069","MoKa","","0.0345","0.018","","0.0419","0.0349","","","","1.134","1.133","1.133","","","","","has coordinates,has disorder","179311","2020-10-21","18:00:00",""
"4320811","12.337","0.002","14.531","0.005","15.649","0.002","90","","90","","90","","2805.4","1.1","254","2","254","2","","","","","","","","6","C m c a","-C 2ac 2","64","","","","- C16 H32 Cl4 In2 N6 O4 -","- C16 H32 Cl4 In2 N6 O4 -","- C64 H128 Cl16 In8 N24 O16 -","4","","","Cory Steffek; Jeff McMurran; Brett Pleune; J. Kouvetakis; Thomas E. Concolino; Arnold L. Rheingold","Synthesis of Cl2InN3, Br2InN3, and Related Adducts","Inorganic Chemistry","2000","39","","1615","1617","10.1021/ic990387a","","","0.71073","MoKα","","0.0998","0.051","","","0.1244","0.1515","","","","","","0.844","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320812","19.605","0.006","14.458","0.007","13.627","0.005","90","","118.94","0.02","90","","3380","2","294","","294","","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C10.73 H17.46 K6 O23 S4 W3 -","- C9.36 H9 K5 O20.5 S3 W2.5 -","- C37.44 H36 K20 O82 S12 W10 -","4","0.5","","Michael Brorson; Alan Hazell; Claus J. H. Jacobsen; Iver Schmidt; Jørgen Villadsen","Preparation and Crystal Structures of Formato Complexes of the [M^IV^~3~O~4~]^4+^ and [M^IV^~3~S~4~]^4+^ (M = Mo,W) Clusters. Convenient Precursors to the Corresponding Aqua Complexes","Inorganic Chemistry","2000","39","","1346","1350","10.1021/ic9906656","","","0.56087","AgKα","","","0.046","","","0.055","","","","","1.224","1.224","","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4320813","11.011","0.002","13.31","0.002","9.993","0.001","106.817","0.007","91.651","0.009","88.34","0.009","1401","0.4","294","","294","","","","","","","","","6","P -1","-P 1","2","","","","- C9 H26.8 K0.8 Mo3 N3.2 O24 -","- C9 H22 K2 Mo3 N2 O24 -","- C18 H44 K4 Mo6 N4 O48 -","2","1","","Michael Brorson; Alan Hazell; Claus J. H. Jacobsen; Iver Schmidt; Jørgen Villadsen","Preparation and Crystal Structures of Formato Complexes of the [M^IV^~3~O~4~]^4+^ and [M^IV^~3~S~4~]^4+^ (M = Mo,W) Clusters. Convenient Precursors to the Corresponding Aqua Complexes","Inorganic Chemistry","2000","39","","1346","1350","10.1021/ic9906656","","","0.71073","MoKα","","","0.026","","","0.034","","","","","0.887","0.887","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4320814","14.744","0.003","8.85","0.003","10.062","0.003","90","","131.609","0.019","90","","981.7","0.6","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C2 H10 Co N2 O4 P -","- C2 H10 Co2 N2 O8 P2 -","- C8 H40 Co8 N8 O32 P8 -","4","0.5","","Hong-Ming Yuan; Jie-Sheng Chen; Guang-Shan Zhu; Ji-Yang Li; Ji-Hong Yu; Guang-Di Yang; Ru-Ren Xu","The First Organo-Templated Cobalt Phosphate with a Zeolite Topology","Inorganic Chemistry","2000","39","","1476","1479","10.1021/ic990719b","","","0.71073","MoKα","","0.0413","0.0311","","","0.0869","0.0935","","","","","","0.691","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320815","10.3387","0.0013","13.222","0.002","17.394","0.004","90","","90","","90","","2377.7","0.7","293","2","293","2","","","","","","","","4","P c a b","-P 2bc 2ac","61","","","","- C6 H4 Cu2 O12 -","- C6 H4 Cu2 O12 -","- C48 H32 Cu16 O96 -","8","1","","Catalina Ruiz-Pérez; Joaquín Sanchiz; María Hernández Molina; Francesc Lloret; Miguel Julve","Ferromagnetism in Malonato-Bridged Copper(II) Complexes. Synthesis, Crystal Structures, and Magnetic Properties of {[Cu(H2O)3][Cu(mal)2(H2O)]}n and {[Cu(H2O)4]2[Cu(mal)2(H2O)]}[Cu(mal)2(H2O)2]{[Cu(H2O)4][Cu(mal)2(H2O)2]} (H2mal = malonic Acid)","Inorganic Chemistry","2000","39","","1363","1370","10.1021/ic9908165","","","0.71073","MoKα","","0.0539","0.0367","","","0.1138","0.122","","","","","","1.083","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4320816","21.1","0.004","21.088","0.004","14.007","0.002","90","","115.93","0.02","90","","5605","2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C24 H16 Cu8 O56 -","- C24 H16 Cu8 O56 -","- C96 H64 Cu32 O224 -","4","0.5","","Catalina Ruiz-Pérez; Joaquín Sanchiz; María Hernández Molina; Francesc Lloret; Miguel Julve","Ferromagnetism in Malonato-Bridged Copper(II) Complexes. Synthesis, Crystal Structures, and Magnetic Properties of {[Cu(H2O)3][Cu(mal)2(H2O)]}n and {[Cu(H2O)4]2[Cu(mal)2(H2O)]}[Cu(mal)2(H2O)2]{[Cu(H2O)4][Cu(mal)2(H2O)2]} (H2mal = malonic Acid)","Inorganic Chemistry","2000","39","","1363","1370","10.1021/ic9908165","","","0.71073","MoKα","","0.0566","0.0395","","","0.1139","0.1224","","","","","","1.095","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4320817","9.3542","0.0001","18.1148","0.0002","19.7675","0.0002","90","","90","","90","","3349.59","0.06","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C22 H44 N7 O13 Yb -","- C22 H44 N7 O13 Yb -","- C88 H176 N28 O52 Yb4 -","4","1","","C. Den Auwer; M. C. Charbonnel; M. G. B. Drew; M. Grigoriev; M. J. Hudson; P. B. Iveson; C. Madic; M. Nierlich; M. T. Presson; R. Revel; M. L. Russell; P. Thuéry","Crystallographic, X-ray Absorption, and IR Studies of Solid- and Solution-State Structures of Tris(nitrato)N,N,N',N'-Tetraethylmalonamide Complexes of Lanthanides. Comparison with the Americium Complex","Inorganic Chemistry","2000","39","","1487","1495","10.1021/ic990817x","","","0.71073","MoKα","","0.0187","0.0176","","0.0422","","0.0411","","","1.056","","","1.061","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320818","11.2627","0.0004","20.5992","0.0008","22.2126","0.0008","90","","102.572","0.001","90","","5029.8","0.3","273","2","273","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C66 H132 N21 Nd3 O39 -","- C66 H97 N21 Nd3 O39 -","- C132 H194 N42 Nd6 O78 -","2","1","","C. Den Auwer; M. C. Charbonnel; M. G. B. Drew; M. Grigoriev; M. J. Hudson; P. B. Iveson; C. Madic; M. Nierlich; M. T. Presson; R. Revel; M. L. Russell; P. Thuéry","Crystallographic, X-ray Absorption, and IR Studies of Solid- and Solution-State Structures of Tris(nitrato)N,N,N',N'-Tetraethylmalonamide Complexes of Lanthanides. Comparison with the Americium Complex","Inorganic Chemistry","2000","39","","1487","1495","10.1021/ic990817x","","","0.71073","MoKα","","0.0608","0.0351","","0.1115","","0.0822","","","1.008","","","1.055","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320819","18.5761","0.0002","14.1731","0.0002","8.4049","0.0002","90","","90","","90","","2212.85","0.07","173","2","173","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C19 H24 N6 O3 Si W -","- C19 H21 N6 O3 Si W -","- C76 H84 N24 O12 Si4 W4 -","4","0.5","","Eric E. Pullen; Daniel Rabinovich; Christopher D. Incarvito; Thomas E. Concolino; Arnold L. Rheingold","Syntheses and Structures of Methyltris(pyrazolyl)silane Complexes of the Group 6 Metals","Inorganic Chemistry","2000","39","","1561","1567","10.1021/ic990945l","","","0.71073","MoKα","","0.033","0.0289","","","0.1141","0.1221","","","","","","1.072","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320820","18.6624","0.0004","14.1761","0.0002","8.4402","0.0002","90","","90","","90","","2232.94","0.08","173","2","173","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C19 H21 Mo N6 O3 Si -","- C19 H21 Mo N6 O3 Si -","- C76 H84 Mo4 N24 O12 Si4 -","4","0.5","","Eric E. Pullen; Daniel Rabinovich; Christopher D. Incarvito; Thomas E. Concolino; Arnold L. Rheingold","Syntheses and Structures of Methyltris(pyrazolyl)silane Complexes of the Group 6 Metals","Inorganic Chemistry","2000","39","","1561","1567","10.1021/ic990945l","","","0.71073","MoKα","","0.0412","0.0359","","","0.1269","0.1337","","","","","","1.17","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320821","8.0132","0.0006","13.7886","0.0009","9.6481","0.0007","90","","97.1566","0.0011","90","","1057.72","0.13","173","2","173","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C19 H24 Cr N6 O3 Si -","- C19 H21 Cr N6 O3 Si -","- C38 H42 Cr2 N12 O6 Si2 -","2","0.5","","Eric E. Pullen; Daniel Rabinovich; Christopher D. Incarvito; Thomas E. Concolino; Arnold L. Rheingold","Syntheses and Structures of Methyltris(pyrazolyl)silane Complexes of the Group 6 Metals","Inorganic Chemistry","2000","39","","1561","1567","10.1021/ic990945l","","","0.71073","MoKα","","0.0828","0.0638","","","0.1841","0.2041","","","","","","1.524","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320822","10.234","0.002","10.438","0.002","13.853","0.002","81.12","0.01","79.63","0.01","78.42","0.01","1415.2","0.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C27 H29 Cl2 Mn N3 O3 P -","- C27 H29 Cl2 Mn N3 O3 P -","- C54 H58 Cl4 Mn2 N6 O6 P2 -","2","1","","Corinne Rancurel; Daniel B. Leznoff; Jean-Pascal Sutter; Philippe Guionneau; Daniel Chasseau; Janis Kliava; Olivier Kahn","A Linear, Four-Spin Mn(II)-Nitronyl-Nitroxide-Substituted Phosphine Oxide System Exhibiting Both Antiferro- and Ferromagnetic Interactions","Inorganic Chemistry","2000","39","","1602","1605","10.1021/ic9909678","","","0.71069","MoKα","","0.0695","0.0476","","","0.1252","0.1373","","","","","","1.101","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320823","11.357","0.007","9.613","0.005","12.326","0.007","90","","97.66","0.05","90","","1333.7","1.3","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C28 H27 N2 O9 V -","- C28 H27 N2 O9 V -","- C56 H54 N4 O18 V2 -","2","1","","Kajal Krishna Rajak; Bharat Baruah; Sankar Prasad Rath; Animesh Chakravorty","Sugar Binding to VO3+. Synthesis and Structure of a New Mannopyranoside Vanadate","Inorganic Chemistry","2000","39","","1598","1601","10.1021/ic9910460","","","0.71073","MoKα","","0.08","0.0536","","0.1243","0.1012","","","","1.036","1.069","1.069","","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320824","10.868","0.003","13.864","0.003","10.625","0.003","108.622","0.015","118.977","0.014","89.344","0.016","1307.2","0.6","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C52 H50 Mn4 N2 O18 -","- C52 H50 Mn4 N2 O18 -","- C52 H50 Mn4 N2 O18 -","1","0.5","","Sheyi Wang; Michael S. Wemple; Jae Yoo; Kirsten Folting; John C. Huffman; Karl S. Hagen; David N. Hendrickson; George Christou","Tetranuclear Manganese Carboxylate Complexes with a Trigonal Pyramidal Metal Topology via Controlled Potential Electrolysis","Inorganic Chemistry","2000","39","","1501","1513","10.1021/ic991068m","","","0.71069","MoKα","","","0.0324","","","","0.037","","","","","","1.2355","","","","has coordinates,has disorder","179311","2020-10-21","18:00:00",""
"4320825","14.743","0.006","15.536","0.008","30.006","0.013","90","","102.791","0.018","90","","6702","5","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C82 H52 Mn4 N2 O18 -","- C77 H57 Mn4 N O18 -","- C308 H228 Mn16 N4 O72 -","4","1","","Sheyi Wang; Michael S. Wemple; Jae Yoo; Kirsten Folting; John C. Huffman; Karl S. Hagen; David N. Hendrickson; George Christou","Tetranuclear Manganese Carboxylate Complexes with a Trigonal Pyramidal Metal Topology via Controlled Potential Electrolysis","Inorganic Chemistry","2000","39","","1501","1513","10.1021/ic991068m","","","0.71069","MoKα","","","0.0432","","","","0.0444","","","","","","0.8451","","","","has coordinates,has disorder","179311","2020-10-21","18:00:00",""
"4320826","15.162","0.003","21.577","0.004","22.683","0.004","90","","108.035","0.015","90","","7056","2","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C74.5 H55 Cl3 Mn4 O17 -","- C74.5 H55 Cl3 Mn4 O17 -","- C298 H220 Cl12 Mn16 O68 -","4","1","","Sheyi Wang; Michael S. Wemple; Jae Yoo; Kirsten Folting; John C. Huffman; Karl S. Hagen; David N. Hendrickson; George Christou","Tetranuclear Manganese Carboxylate Complexes with a Trigonal Pyramidal Metal Topology via Controlled Potential Electrolysis","Inorganic Chemistry","2000","39","","1501","1513","10.1021/ic991068m","","","1.54178","CuKα","","0.131","0.0839","","","0.2133","0.2463","","","","","","1.046","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4320827","13.549","0.002","22.338","0.004","16.618","0.002","90","","103.74","0.008","90","","4885.6","1.3","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C53 H45 Mn4 O17 -","- C53 H45 Mn4 O17 -","- C212 H180 Mn16 O68 -","4","1","","Sheyi Wang; Michael S. Wemple; Jae Yoo; Kirsten Folting; John C. Huffman; Karl S. Hagen; David N. Hendrickson; George Christou","Tetranuclear Manganese Carboxylate Complexes with a Trigonal Pyramidal Metal Topology via Controlled Potential Electrolysis","Inorganic Chemistry","2000","39","","1501","1513","10.1021/ic991068m","","","0.71069","MoKα","","","0.0463","","","","0.0445","","","","","","0.9157","","","","has coordinates,has disorder","179311","2020-10-21","18:00:00",""
"4320828","10.5592","0.0009","10.415","0.0011","6.4924","0.0007","90","","90","","90","","714","0.12","293","2","293","2","","","","","","","","4","A m a 2","A 2 -2a","40","","","","- Eu Li P Se4 -","- Eu Li P Se4 -","- Eu4 Li4 P4 Se16 -","4","0.5","","Jennifer A. Aitken; Konstantinos Chondroudis; Victor G. Young,; Mercouri G. Kanatzidis","LiEuPSe4 and KEuPSe4: Novel Selenophosphates with the Tetrahedral [PSe4]3- Building Block","Inorganic Chemistry","2000","39","","1525","1533","10.1021/ic991090f","","","0.71073","MoKα","","0.051","0.0503","","0.125","0.1245","","","","1.068","1.082","1.082","","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320829","6.8469","0.0006","6.9521","0.0006","9.0436","0.0008","90","","107.677","0.002","90","","410.15","0.06","173","2","173","2","","","","","","","C. Konstantinos / Prof. M. Kanatzidis - MSU","4","P 1 21/m 1","-P 2yb","11","96262q","","","- Eu2 K2 P2 Se8 -","- Eu2 K2 P2 Se8 -","- Eu2 K2 P2 Se8 -","1","0.25","","Jennifer A. Aitken; Konstantinos Chondroudis; Victor G. Young,; Mercouri G. Kanatzidis","LiEuPSe4 and KEuPSe4: Novel Selenophosphates with the Tetrahedral [PSe4]3- Building Block","Inorganic Chemistry","2000","39","","1525","1533","10.1021/ic991090f","","","0.71073","MoKα","","0.0583","0.0516","","0.1242","0.12","","","","1.081","1.124","1.124","","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320830","10.0197","0.0008","12.5425","0.001","19.235","0.002","90","","102.918","0.007","90","","2356.1","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H70 N6 O32 P8 -","- C20 H70 N6 O32 P8 -","- C40 H140 N12 O64 P16 -","2","0.5","","Olga A. Gerasimchuk; Susan Mason; José M. Llinares; Maoping Song; Nathaniel W. Alcock; Kristin Bowman-James","Binding of Phosphate with a Simple Hexaaza Polyammonium Macrocycle","Inorganic Chemistry","2000","39","","1371","1375","10.1021/ic9911116","","","1.54178","CuKα","","0.051","0.0398","","0.1102","0.1041","","","","1.016","1.052","1.052","","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320831","21.671","0.002","7.6023","0.0007","9.1452","0.0009","90","","108.849","0.007","90","","1425.9","0.2","297","2","297","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Mn2(H2O)(CO2(CH2)4CO2)2","manganese adipate","","- C12 H18 Mn2 O9 -","- C12 H18 Mn2 O9 -","- C48 H72 Mn8 O36 -","4","0.5","","YooJin Kim; Duk-Young Jung","Hydrothermal Synthesis and Magnetic Behavior of a Novel Layered Coordination Polymer Generated from Manganese(II) Adipate","Inorganic Chemistry","2000","39","","1470","1475","10.1021/ic991119f","","","0.71073","MoKα","","0.0427","0.038","","0.1119","0.1012","","","","1.085","1.094","1.094","","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320832","11.285","0.002","15.234","0.003","13.41","0.002","90","","103.1","0.01","90","","2245.4","0.7","298.2","","298.2","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C22 H21 F3 N O2 S Sb -","- C22 H21 F3 N O2 S Sb -","- C88 H84 F12 N4 O8 S4 Sb4 -","4","1","","Yoshihiro Matano; Hazumi Nomura; Hitomi Suzuki","Synthesis and First X-ray Structural Analysis of Monomeric Imino-λ5-stibanes","Inorganic Chemistry","2000","39","","1340","1341","10.1021/ic991120e","","","0.7107","MoKα","","0.0327","0.0327","","","0.0436","0.0435","","","","","","1.127","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4320833","10.955","0.002","14.268","0.002","9.055","0.003","100.29","0.02","110.43","0.02","107.5","0.01","1199.6","0.6","299.2","","299.2","","","","","","","","","7","P -1","-P 1","2","","","","- C22 H21 F3 N O5 S Sb -","- C22 H21 F3 N O5 S Sb -","- C44 H42 F6 N2 O10 S2 Sb2 -","2","1","","Yoshihiro Matano; Hazumi Nomura; Hitomi Suzuki","Synthesis and First X-ray Structural Analysis of Monomeric Imino-λ5-stibanes","Inorganic Chemistry","2000","39","","1340","1341","10.1021/ic991120e","","","0.7107","MoKα","","0.0265","0.0265","","","0.0403","0.0403","","","","","","1.131","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4320834","10.7797","0.0012","10.9047","0.0012","17.0176","0.0015","106.857","0.009","95.822","0.008","100.191","0.009","1859.3","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H48 N8 O13 Zn -","- C32 H48 N8 O13 Zn -","- C64 H96 N16 O26 Zn2 -","2","1","","Haiyang He; Arthur E. Martell; Ramunas J. Motekaitis; Joseph H. Reibenspies","Interactions between Divalent Metal Ions and an Octacoordinate Macrocyclic Ligand","Inorganic Chemistry","2000","39","","1586","1592","10.1021/ic9911264","","","0.71073","MoKα","","0.2073","0.1078","","","0.1996","0.2677","","","","","","1.156","","","","has coordinates,has disorder","179311","2020-10-21","18:00:00",""
"4320835","16.234","0.005","15.976","0.009","29.829","0.011","90","","99.28","0.02","90","","7635","6","293","2","293","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C32 H47 Br0.05 Cd Cl1.95 N6 O8 Zn -","- C32 H47 Br0.049 Cd Cl1.951 N6 O8 Zn -","- C256 H376 Br0.392 Cd8 Cl15.608 N48 O64 Zn8 -","8","1","","Haiyang He; Arthur E. Martell; Ramunas J. Motekaitis; Joseph H. Reibenspies","Interactions between Divalent Metal Ions and an Octacoordinate Macrocyclic Ligand","Inorganic Chemistry","2000","39","","1586","1592","10.1021/ic9911264","","","0.71073","MoKα","","0.2686","0.0972","","","0.1522","0.1865","","","","","","0.998","","","","has coordinates,has disorder","179311","2020-10-21","18:00:00",""
"4320836","10.805","0.002","11.384","0.002","20.999","0.004","91.41","0.03","98.23","0.03","113.88","0.03","2327.8","1","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C42 H75 N3 O10 -","- C42 H75 N3 O10 -","- C84 H150 N6 O20 -","2","1","","Yizhen Sun; Arthur E. Martell; Joseph H. Reibenspies; David E. Reichert; Michael J. Welch","Synthesis and Characterization of Racemic Mixture and Meso Isomers of Bis(trans-2-aminocyclohexyl)aminepentaacetic Acid and the Stabilities of Their Gd(III) Complexes","Inorganic Chemistry","2000","39","","1480","1486","10.1021/ic991189m","","","0.71073","MoKα","","0.1377","0.0832","","","0.2336","0.28","","","","","","1.013","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320837","12.0119","0.0014","13.368","0.0015","13.7859","0.0012","89.124","0.008","66.928","0.009","71.536","0.01","1916.7","0.4","100","0.2","100","0.2","","","","","","","","5","P -1","-P 1","2","[cesium(tetrabenzo-24-crown-8)tris(acetonitrile)][nitrate]","","","- C38 H41 Cs N4 O11 -","- C38 H41 Cs N4 O11 -","- C76 H82 Cs2 N8 O22 -","2","1","","Jeffrey C. Bryan; Konstantinos Kavallieratos; Richard A. Sachleben","Unusual Ligand Coordination for Cesium","Inorganic Chemistry","2000","39","","1568","1572","10.1021/ic991203v","","","0.71073","MoKα","","0.054","0.046","","","0.124","0.128","","","","","","1.06","","","","has coordinates,has disorder","179311","2020-10-21","18:00:00",""
"4320838","12.295","0.003","13.295","0.003","13.782","0.003","89.105","0.017","66.096","0.018","70.98","0.019","1929.4","0.9","100","2","100","2","","","","","","","","6","P -1","-P 1","2","cesium tetrabenzo-24-crown-8 bis(acetonitrile) (methylene chloride) nitrate","","","- C37 H40 Cl2 Cs N3 O11 -","- C37 H40 Cl2 Cs N3 O11 -","- C74 H80 Cl4 Cs2 N6 O22 -","2","1","","Jeffrey C. Bryan; Konstantinos Kavallieratos; Richard A. Sachleben","Unusual Ligand Coordination for Cesium","Inorganic Chemistry","2000","39","","1568","1572","10.1021/ic991203v","","","0.71073","MoKα","","0.062","0.053","","","0.138","0.144","","","","","","1.05","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320839","8.059","0.003","18.074","0.004","14.259","0.003","90","","100.36","0.03","90","","2043.1","1","295","","295","","","","","","","","chemical synthesis","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H24 N18 Ni3 S6 -","- C30 H24 N18 Ni3 S6 -","- C60 H48 N36 Ni6 S12 -","2","0.5","","Juan Cano; Giovanni De Munno; Francesc Lloret; Miguel Julve","Synthesis Crystal Structure and Magnetic Properties of the Trinuclear Nickel(II) Complex Bis[(μ-thiocyanato-N)bis(μ-pyridazine-N1,N2)bis(thiocyanato-N) (pyridazine-N1)nickel(II)-N,N1,N1']nickel(II)","Inorganic Chemistry","2000","39","","1611","1614","10.1021/ic991219l","","","0.71073","MoKα","","9.28","5.54","","7.59","6.68","","","","","1.55","1.55","","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320840","10.2768","0.0005","10.3016","0.0005","18.8364","0.001","90","","90","","90","","1994.16","0.17","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C4 H22 Co4 N4 O17 P4 -","- C5.33333 H29.3333 Co5.33333 N5.33333 O22.6667 P5.33333 -","- C16 H88 Co16 N16 O68 P16 -","3","0.75","","Srinivasan Natarajan; S. Neeraj; Amitava Choudhury; C. N. R. Rao","Three-Dimensional Open-Framework Cobalt(II) Phosphates by Novel Routes","Inorganic Chemistry","2000","39","","1426","1433","10.1021/ic991223x","","","0.71073","MoKα","","0.0204","0.0201","","0.0486","0.0485","","","","1.069","1.071","1.071","","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320841","31.95","0.0006","8.3596","0.0001","15.9195","0.0003","90","","96.645","0.001","90","","4223.36","0.12","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H51 Co6 N9 O32 P8 -","- C12 H49 Co6 N9 O32.5 P8 -","- C48 H196 Co24 N36 O130 P32 -","4","1","","Srinivasan Natarajan; S. Neeraj; Amitava Choudhury; C. N. R. Rao","Three-Dimensional Open-Framework Cobalt(II) Phosphates by Novel Routes","Inorganic Chemistry","2000","39","","1426","1433","10.1021/ic991223x","","","0.71073","MoKα","","0.0672","0.0514","","0.1364","0.123","","","","1.076","1.108","1.108","","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320842","12.1079","0.0004","13.021","0.0003","19.9806","0.0007","83.201","0.002","75.194","0.002","73.809","0.002","2920.93","0.16","183","2","183","2","","","","","","","","6","P -1","-P 1","2","","","","- C57 H70.5 Cl2 N11.5 O Ru -","- C57 H68.5 Cl2 N11.5 O Ru -","- C114 H137 Cl4 N23 O2 Ru2 -","2","1","","Sven Rau; Torsten Büttner; Christian Temme; Mario Ruben; Helmar Görls; Dirk Walther; Marco Duati; Stefano Fanni; Johannes G. Vos","A Bibenzimidazole-Containing Ruthenium(II) Complex Acting as a Cation-Driven Molecular Switch","Inorganic Chemistry","2000","39","","1621","1624","10.1021/ic991225h","","","0.71073","MoKα","","0.0416","0.0375","","0.105","0.1002","","","","1.008","1.019","1.019","","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"4320843","12.1521","0.0005","16.6632","0.0006","27.464","0.001","90","","95.971","0.002","90","","5531.1","0.4","183","2","183","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C60 H64 N12 Ru -","- C58 H62 N12 Ru -","- C232 H248 N48 Ru4 -","4","0.5","","Sven Rau; Torsten Büttner; Christian Temme; Mario Ruben; Helmar Görls; Dirk Walther; Marco Duati; Stefano Fanni; Johannes G. Vos","A Bibenzimidazole-Containing Ruthenium(II) Complex Acting as a Cation-Driven Molecular Switch","Inorganic Chemistry","2000","39","","1621","1624","10.1021/ic991225h","","","0.71073","MoKα","","0.0996","0.0617","","","0.1189","0.1316","","","","","","1.034","","","","has coordinates,has disorder","179311","2020-10-21","18:00:00",""
"4320844","12.606","0.002","15.233","0.002","16.003","0.004","89.93","0.01","108","0.02","94.42","0.01","2913.1","1","213","1","213","1","","","","","","","","6","P -1","-P 1","2","","","","- C54 H74 Li2 N4 S6 Zr -","- C58 H82 Li2 N4 S6 Zr -","- C116 H164 Li4 N8 S12 Zr2 -","2","1","","Jan C. Friese; Arndt Krol; Carsten Puke; Kristin Kirschbaum; Dean M. Giolando","Trigonal Prismatic vs Octahedral Coordination Geometry: Syntheses and Structural Characterization of Hexakis(arylthiolato) Zirconate Complexes","Inorganic Chemistry","2000","39","","1496","1500","10.1021/ic991402e","","","0.71073","Mo-Kα","","0.055","0.036","","","0.049","","","","","1.651","1.651","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4320845","16.5924","0.0002","16.5924","0.0002","21.7663","0.0005","90","","90","","120","","5189.6","0.15","100","1","100","1","","","","","","","","6","R 3 2 :H","R 3 2""","155","","","","- C66 H90 Li2 O12 S6 Zr -","- C66 H42 Li2 O12 S6 Zr -","- C198 H126 Li6 O36 S18 Zr3 -","3","0.166667","","Jan C. Friese; Arndt Krol; Carsten Puke; Kristin Kirschbaum; Dean M. Giolando","Trigonal Prismatic vs Octahedral Coordination Geometry: Syntheses and Structural Characterization of Hexakis(arylthiolato) Zirconate Complexes","Inorganic Chemistry","2000","39","","1496","1500","10.1021/ic991402e","","","0.71073","MoKα","","0.0734","0.0611","","0.1689","0.1579","","","","1.1","1.126","1.126","","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320846","7.2247","0.0007","11.0427","0.0006","13.561","0.0012","94.804","0.005","98.669","0.007","99.26","0.06","1049.1","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","Na(NO3)(MeOH).Cu(3-MeOsalen)","[Sodium nitrate / methanol (1/1)] / N.N'-bis(3-methoxysalicylidene) ethane-1,2-diaminato copper(II) (1/1)","","- C19 H21 Cu N3 Na O8 -","- C19 H21 Cu N3 Na O8 -","- C38 H42 Cu2 N6 Na2 O16 -","2","1","","D. Cunningham; P. McArdle; M. Mitchell; N. Ní Chonchubhair; M. O'Gara; Federico Franceschi; Carlo Floriani","Adduct Formation between Alkali Metal Ions and Divalent Metal Salicylaldimine Complexes Having Methoxy Substituents. A Structural Investigation","Inorganic Chemistry","2000","39","","1639","1649","10.1021/ic990496p","","","0.71069","MoKα","","0.0568","0.0389","","","0.109","0.1154","","","","","","1.05","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320847","7.3554","0.0006","11.2778","0.001","13.562","0.002","96.364","0.01","101.924","0.009","96.809","0.01","1082.3","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","Na(NO3)(MeOH).Ni(3-MeOsal1,3pn)","[Sodium nitrate / methanol (1/1)] / N.Ni'-bis(3-methoxysalicylidene) propane-1,3-diaminato nickel(II) (1/1)","","- C20 H23 N3 Na Ni O8 -","- C20 H23 N3 Na Ni O8 -","- C40 H46 N6 Na2 Ni2 O16 -","2","1","","D. Cunningham; P. McArdle; M. Mitchell; N. Ní Chonchubhair; M. O'Gara; Federico Franceschi; Carlo Floriani","Adduct Formation between Alkali Metal Ions and Divalent Metal Salicylaldimine Complexes Having Methoxy Substituents. A Structural Investigation","Inorganic Chemistry","2000","39","","1639","1649","10.1021/ic990496p","","","0.71069","MoKα","","0.1108","0.1023","","","0.2831","0.2962","","","","","","1.36","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320848","9.6809","0.0011","10.0015","0.0013","11.2686","0.0013","101.03","","90.97","","100.55","","1051.3","0.2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","CsI3.Ni(3-MeOsal1,3pn)","Caesium triiodide / N.N'-bis(3-methoxysalicylidene) propane-1,3-diaminato nickel(II) (1/1)","","- C19 H20 Cs0.5 I1.5 N2 Ni O4 -","- C19 H20 Cs0.5 I1.5 N2 Ni O4 -","- C38 H40 Cs I3 N4 Ni2 O8 -","2","1","","D. Cunningham; P. McArdle; M. Mitchell; N. Ní Chonchubhair; M. O'Gara; Federico Franceschi; Carlo Floriani","Adduct Formation between Alkali Metal Ions and Divalent Metal Salicylaldimine Complexes Having Methoxy Substituents. A Structural Investigation","Inorganic Chemistry","2000","39","","1639","1649","10.1021/ic990496p","","","0.71069","MoKα","","0.0723","0.0667","","","0.1969","0.2045","","","","","","1.073","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4320849","14.4648","0.0019","20.968","0.003","28.404","0.003","90","","90","","90","","8614.9","1.9","293","2","293","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","Na.[Ni(3-MeOsal1,3pn)]2 I.EtOH","{[Sodium / N.N'-bis(3-methoxysalicylidene)propane-1,3 -diaminato nickel(II) (1/2)] / ethanol (1/1)}iodide","","- C40 H39 I N4 Na Ni2 O9 -","- C40 H39 I N4 Na Ni2 O9 -","- C320 H312 I8 N32 Na8 Ni16 O72 -","8","1","","D. Cunningham; P. McArdle; M. Mitchell; N. Ní Chonchubhair; M. O'Gara; Federico Franceschi; Carlo Floriani","Adduct Formation between Alkali Metal Ions and Divalent Metal Salicylaldimine Complexes Having Methoxy Substituents. A Structural Investigation","Inorganic Chemistry","2000","39","","1639","1649","10.1021/ic990496p","","","0.71069","MoKα","","0.1514","0.0558","","","0.1487","0.1739","","","","","","0.924","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320850","12.4904","0.0017","13.9363","0.0013","14.106","0.0012","61.033","0.007","89.567","0.009","71.579","0.01","2006.6","0.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","KI.Ni(3-MeOsal1,3pn)","Potassium iodide / N.N'-bis(3-methoxysalicylidene) propane-1,3-diaminato nickel(II) (1/1)","","- C38 H38 I2 K2 N4 Ni2 O8 -","- C38 H38 I2 K2 N4 Ni2 O8 -","- C76 H76 I4 K4 N8 Ni4 O16 -","2","1","","D. Cunningham; P. McArdle; M. Mitchell; N. Ní Chonchubhair; M. O'Gara; Federico Franceschi; Carlo Floriani","Adduct Formation between Alkali Metal Ions and Divalent Metal Salicylaldimine Complexes Having Methoxy Substituents. A Structural Investigation","Inorganic Chemistry","2000","39","","1639","1649","10.1021/ic990496p","","","0.71069","MoKα","","0.0577","0.0484","","","0.1414","0.1479","","","","","","1.049","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320851","15.752","0.003","23.276","0.008","25.206","0.006","90","","90","","90","","9242","4","293","2","293","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","CsI.[Ni (3-MeOsal1,2pn)]2.H2O","[Caesium iodide / N.N'-bis(3-methoxysalicylidene) propane-1,2-diaminato nickel(II) (1/2)] / water (1/1)","","- C38 H40 Cs I N4 Ni2 O9 -","- C38 H40 Cs I N4 Ni2 O9 -","- C304 H320 Cs8 I8 N32 Ni16 O72 -","8","1","","D. Cunningham; P. McArdle; M. Mitchell; N. Ní Chonchubhair; M. O'Gara; Federico Franceschi; Carlo Floriani","Adduct Formation between Alkali Metal Ions and Divalent Metal Salicylaldimine Complexes Having Methoxy Substituents. A Structural Investigation","Inorganic Chemistry","2000","39","","1639","1649","10.1021/ic990496p","","","0.71069","MoKα","","0.1442","0.0719","","","0.202","0.2308","","","","","","0.937","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320852","12.591","0.0002","23.488","0.0002","22.666","0.0002","90","0.0001","99.35","0.0001","90","0.0001","6614.13","0.13","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","[Cs(NO3).Ni(3-MeOsal1,3pn)]3.MeOH","[Caesium nitrate / N.N'-bis(3-methoxysalicylidene) propane-1,3-diaminatonickel(II)] (1/1)] /methanol (1/1).","","- C58 H56 Cs3 N9 Ni3 O22 -","- C58 H56 Cs3 N9 Ni3 O22 -","- C232 H224 Cs12 N36 Ni12 O88 -","4","1","","D. Cunningham; P. McArdle; M. Mitchell; N. Ní Chonchubhair; M. O'Gara; Federico Franceschi; Carlo Floriani","Adduct Formation between Alkali Metal Ions and Divalent Metal Salicylaldimine Complexes Having Methoxy Substituents. A Structural Investigation","Inorganic Chemistry","2000","39","","1639","1649","10.1021/ic990496p","","","0.71069","MoKα","","0.1118","0.0657","","","0.1875","0.21","","","","","","0.976","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320853","29.573","0.005","18.047","0.003","23.184","0.003","90","","122.86","0.01","90","","10394","3","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","[K(MeCN)]2.Ni(3-MeOsal1,3pn)3 [BPh4]2","[Potassium / acetonitrile (1/1)] / N.N'-bis(3-methoxysalicylidene) propane-1,3-diaminato nickel(II) (2/3) bis(tetraphenylborate)","","- C43 H40 B K N2 Ni O4 -","- C54.5 H53 B K N4 Ni1.5 O6 -","- C436 H424 B8 K8 N32 Ni12 O48 -","8","1","","D. Cunningham; P. McArdle; M. Mitchell; N. Ní Chonchubhair; M. O'Gara; Federico Franceschi; Carlo Floriani","Adduct Formation between Alkali Metal Ions and Divalent Metal Salicylaldimine Complexes Having Methoxy Substituents. A Structural Investigation","Inorganic Chemistry","2000","39","","1639","1649","10.1021/ic990496p","","","0.71069","MoKα","","0.1367","0.0629","","","0.2013","0.2195","","","","","","1.183","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320854","7.029","0.001","7.676","0.002","13.205","0.003","95.66","0.02","90.49","0.02","114.75","0.02","642.9","0.3","130","2","130","2","","","","","","","","4","P -1","-P 1","2","dTBDMSbipy","4,4'-di-(tert-butyldimethylsilylmethyl)-2,2'-bipyridine","","- C24 H40 N2 Si2 -","- C24 H40 N2 Si2 -","- C24 H40 N2 Si2 -","1","0.5","","Amy T. Levy; Marilyn M. Olmstead; Timothy E. Patten","Synthesis, Characterization, and Polymerization Activity of [Bis(4,4'-bis(neophyldimethylsilylmethyl)-2,2'-bipyridyl)copper(I)] + CuBr2- and Implications for Copper(I) Catalyst Structures in Atom Transfer Radical Polymerization","Inorganic Chemistry","2000","39","","1628","1634","10.1021/ic990567k","","","1.54178","CuKα","","0.0676","0.055","","","0.1378","0.1484","","","","","","1.043","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320855","7.067","0.002","8.82","0.002","12.329","0.003","100.21","0.02","90.82","0.02","109.64","0.02","710","0.3","130","2","130","2","","","","","","","","4","P -1","-P 1","2","dTHEXbipy","4,4'-di-(dimethylthexylsilylmethyl)-2,2'-bipyridine","","- C28 H48 N2 Si2 -","- C28 H48 N2 Si2 -","- C28 H48 N2 Si2 -","1","0.5","","Amy T. Levy; Marilyn M. Olmstead; Timothy E. Patten","Synthesis, Characterization, and Polymerization Activity of [Bis(4,4'-bis(neophyldimethylsilylmethyl)-2,2'-bipyridyl)copper(I)] + CuBr2- and Implications for Copper(I) Catalyst Structures in Atom Transfer Radical Polymerization","Inorganic Chemistry","2000","39","","1628","1634","10.1021/ic990567k","","","1.54178","CuKα","","0.0615","0.055","","","0.1377","0.1437","","","","","","0.976","","","","has coordinates,has disorder","179311","2020-10-21","18:00:00",""
"4320856","7.9701","0.0009","22.075","0.002","9.3996","0.0011","90","","98.42","0.009","90","","1635.9","0.3","130","2","130","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","dNEObipy","4,4'-di-(neophyldimethylsilylmethyl)-2,2'-bipyridine","","- C36 H48 N2 Si2 -","- C36 H48 N2 Si2 -","- C72 H96 N4 Si4 -","2","0.5","","Amy T. Levy; Marilyn M. Olmstead; Timothy E. Patten","Synthesis, Characterization, and Polymerization Activity of [Bis(4,4'-bis(neophyldimethylsilylmethyl)-2,2'-bipyridyl)copper(I)] + CuBr2- and Implications for Copper(I) Catalyst Structures in Atom Transfer Radical Polymerization","Inorganic Chemistry","2000","39","","1628","1634","10.1021/ic990567k","","","1.54178","CuKα","","0.0496","0.0409","","","0.0938","0.0988","","","","","","1.044","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320857","13.671","0.008","15.468","0.007","19.184","0.009","100.68","0.04","98.86","0.04","111.53","0.04","3597","4","130","2","130","2","","","","","","","","6","P -1","-P 1","2","[(dNEObipy)~2~Cu][CuBr~2~]","[bis-(4,4'-di-(neophyldimethylsilylmethyl)-2,2'-bipyridyl)copper(I)]^+^ CuBr~2~^-^","","- C72 H96 Br2 Cu2 N4 Si4 -","- C72 H96 Br2 Cu2 N4 Si4 -","- C144 H192 Br4 Cu4 N8 Si8 -","2","1","","Amy T. Levy; Marilyn M. Olmstead; Timothy E. Patten","Synthesis, Characterization, and Polymerization Activity of [Bis(4,4'-bis(neophyldimethylsilylmethyl)-2,2'-bipyridyl)copper(I)] + CuBr2- and Implications for Copper(I) Catalyst Structures in Atom Transfer Radical Polymerization","Inorganic Chemistry","2000","39","","1628","1634","10.1021/ic990567k","","","1.54178","CuKα","","0.1605","0.0828","","","0.1949","0.2454","","","","","","1.014","","","","has coordinates,has disorder","179311","2020-10-21","18:00:00",""
"4320858","13.009","0.001","13.063","0.002","14.664","0.002","79.91","0.01","79.96","0.01","71.32","0.01","2305.4","0.5","297","2","297","2","","","","","","","","6","P -1","-P 1","2","","μ-Carbonyl-bis-μ-[bis(diphenylphosphino)amine]-bis(carbonyl nickel)","","- C51 H42 N2 Ni2 O3 P4 -","- C51 H42 N2 Ni2 O3 P4 -","- C102 H84 N4 Ni4 O6 P8 -","2","1","","Eugenio Simón-Manso; Mauricio Valderrama; Verónica Arancibia; Yamil Simón-Manso; Daphne Boys","Synthesis, Spectroscopic Characterization, and Crystal Structure of the Bimetallic Complex [Ni2(μ-CO)(CO)2(μ-NH(PPh2)2)2]","Inorganic Chemistry","2000","39","","1650","1654","10.1021/ic990773s","","","0.71073","MoKα","","","0.0418","","","","0.108","","","","","","0.85","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320859","14.1105","0.0002","17.0887","0.0002","18.2851","0.0002","90","","101.568","0.0002","90","","4319.52","0.09","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H58 Cl6 O8 Ti2 -","- C30 H58 Cl6 O8 Ti2 -","- C120 H232 Cl24 O32 Ti8 -","4","1","","Steven M. Damo; Kin-Chung Lam; Arnold L. Rheingold; Marc A. Walters","Titanium Alkoxide Complexes: Condensed Phase and Gas Phase Comparisons","Inorganic Chemistry","2000","39","","1635","1638","10.1021/ic990844n","","","0.71073","MoKα","","0.0575","0.0492","","","0.1626","0.1753","","","","","","1.425","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320860","6.374","0.002","7.5841","0.0015","26.766","0.008","90","","91.87","0.02","90","","1293.2","0.6","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","[Mn(4-Bzpy)2(dicyanamide)2]n","","","- C28 H18 Mn N8 O2 -","- C28 H18 Mn N8 O2 -","- C56 H36 Mn2 N16 O4 -","2","0.5","","Albert Escuer; Franz A. Mautner; Núria Sanz; Ramon Vicente","Two New One-Dimensional Compounds with End-to-End Dicyanamide as a Bridging Ligand: Syntheses and Structural Characterization of trans-[Mn(4-bzpy)2(N(CN)2)2]n and cis-[Mn(Bpy)(N(CN)2)2]n, (4-bzpy = 4-benzoylpyridine; bpy = 2,2'-bipyridyl)","Inorganic Chemistry","2000","39","","1668","1673","10.1021/ic990905h","","","0.71069","MoKα","","0.0604","0.044","","0.1164","0.1024","","","","1.082","1.097","1.097","","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320861","6.707","0.002","17.188","0.005","13.096","0.005","90","","90.54","0.02","90","","1509.6","0.9","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","[Mn(NC5H4)2(N(CN)2)2]n","","","- C14 H8 Mn N8 -","- C14 H8 Mn N8 -","- C56 H32 Mn4 N32 -","4","0.5","","Albert Escuer; Franz A. Mautner; Núria Sanz; Ramon Vicente","Two New One-Dimensional Compounds with End-to-End Dicyanamide as a Bridging Ligand: Syntheses and Structural Characterization of trans-[Mn(4-bzpy)2(N(CN)2)2]n and cis-[Mn(Bpy)(N(CN)2)2]n, (4-bzpy = 4-benzoylpyridine; bpy = 2,2'-bipyridyl)","Inorganic Chemistry","2000","39","","1668","1673","10.1021/ic990905h","","","0.71069","MoKα","","0.0709","0.0452","","0.1223","0.0979","","","","1.051","1.053","1.053","","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320862","13.806","0.002","14.267","0.002","16.873","0.002","69.263","0.01","69.267","0.008","83.117","0.01","2906.8","0.7","298","2","293","2","","","","","","","","5","P -1","-P 1","2","complex 1","bis(tetraethylammonium)[(tris-2,2'dithiolatobiphenyl)dinickel(II)], acetonitrile solvate, 0.5 biphenyldisulfide clathrate","","- C60 H71 N3 Ni2 S7 -","- C60 H71 N3 Ni2 S7 -","- C120 H142 N6 Ni4 S14 -","2","1","","Edurne Erkizia; Rebecca R. Conry","Synthesis and Characterization of Square Planar Nickel(II)-Arylthiolate Complexes with the Biphenyl-2,2'-dithiolate Ligand","Inorganic Chemistry","2000","39","","1674","1679","10.1021/ic990931f","","","0.71073","MoKα","","0.191","0.0752","","0.2011","0.1468","","","","1.034","1.179","1.179","","","","","has coordinates,has disorder","179311","2020-10-21","18:00:00",""
"4320863","9.957","0.001","13.267","0.001","13.956","0.001","108.489","0.007","90.396","0.006","103.57","0.004","1693","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","complex 2","(tetraethylammonium)(sodium(I)-acetonitrile[(bis-2,2'dithiolatobiphenyl) nickel(II)] dimer","","- C34 H39 N2 Na Ni S4 -","- C34 H39 N2 Na Ni S4 -","- C68 H78 N4 Na2 Ni2 S8 -","2","1","","Edurne Erkizia; Rebecca R. Conry","Synthesis and Characterization of Square Planar Nickel(II)-Arylthiolate Complexes with the Biphenyl-2,2'-dithiolate Ligand","Inorganic Chemistry","2000","39","","1674","1679","10.1021/ic990931f","","","0.71073","MoKα","","0.0661","0.039","","0.0995","0.0872","","","","1.015","1.056","1.056","","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320864","11.183","0.011","9.198","0.009","10.028","0.009","90","","90","","90","","1031.5","1.7","293","2","293","2","","","","","","","","5","P m n a","-P 2ac 2","53","","potassium dicyano-octa-μ3-sulfido-tetrasulfido-octahedro- hexarhenate(III)","","- C2 K4 N2 Re6 S10 -","- C2 K4 N2 Re6 S10 -","- C4 K8 N4 Re12 S20 -","2","0.25","","Yuri V. Mironov; Vladimir E. Fedorov; Craig C. McLauchlan; James A. Ibers","Layered K4[Re6S10(CN)2] and Chainlike K4[Re6Se10(CN)4]: New Types of Chalcocyanide Cluster Compounds with Bridging Chalcogenide Ligands","Inorganic Chemistry","2000","39","","1809","1811","10.1021/ic990936c","","","0.7093","MoKα","","0.1019","0.0522","","","0.1","0.1138","","","","","","1.088","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320865","9.725","0.006","13.164","0.005","10.738","0.006","90","","106.28","0.04","90","","1319.6","1.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","potassium tetracyano-octa-μ3-seleno-di-seleno-octahedro-hexarhenate(III)","","- C4 K4 N4 Re6 Se10 -","- C4 K4 N4 Re6 Se10 -","- C8 K8 N8 Re12 Se20 -","2","0.5","","Yuri V. Mironov; Vladimir E. Fedorov; Craig C. McLauchlan; James A. Ibers","Layered K4[Re6S10(CN)2] and Chainlike K4[Re6Se10(CN)4]: New Types of Chalcocyanide Cluster Compounds with Bridging Chalcogenide Ligands","Inorganic Chemistry","2000","39","","1809","1811","10.1021/ic990936c","","","0.71073","MoKα","","0.0882","0.0545","","","0.1139","0.1199","","","","","","1.479","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320866","11.875","0.003","42.072","0.009","10.394","0.002","90","","106.09","0.03","90","","4989","2","133","2","133","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","compound 2","","- C40 H76 O15 P4 Ta2 -","- C40 H74 O15 P4 Ta2 -","- C160 H296 O60 P16 Ta8 -","4","1","","Olexandr I. Guzyr; Rolf Siefken; Debashis Chakraborty; Herbert W. Roesky; Markus Teichert","Synthesis and Structure of Organic-Soluble Binuclear Molecular Phosphonates of Tantalum, Molybdenum, and Tungsten","Inorganic Chemistry","2000","39","","1680","1683","10.1021/ic990966f","","","0.71073","MoKα","","0.0556","0.0501","","","0.0943","0.0958","","","","","","1.476","","","","has coordinates,has disorder","179311","2020-10-21","18:00:00",""
"4320867","16.992","0.002","20.189","0.003","18.107","0.004","90","","98.24","0.03","90","","6147.5","1.8","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","compound 3","","- C54 H72 Mo2 O16.5 P4 -","- C54 H72 Mo2 O16.5 P4 -","- C216 H288 Mo8 O66 P16 -","4","1","","Olexandr I. Guzyr; Rolf Siefken; Debashis Chakraborty; Herbert W. Roesky; Markus Teichert","Synthesis and Structure of Organic-Soluble Binuclear Molecular Phosphonates of Tantalum, Molybdenum, and Tungsten","Inorganic Chemistry","2000","39","","1680","1683","10.1021/ic990966f","","","0.71073","MoKα","","0.0831","0.0546","","","0.114","0.1288","","","","","","1.119","","","","has coordinates,has disorder","179311","2020-10-21","18:00:00",""
"4320868","10.955","0.0002","11.3715","0.0001","11.94","0.0002","79.681","0.001","85.018","0.001","87.772","0.001","1457.42","0.04","173","2","173","2","","","","","","","B. Luo / Prof. W. Gladfelter","5","P -1","-P 1","2","98301a","","","- C19 H50 Ga N3 Si4 -","- C19 H50 Ga N3 Si4 -","- C38 H100 Ga2 N6 Si8 -","2","1","","Bing Luo; Victor G. Young; Wayne L. Gladfelter","Syntheses and Structures of Quinuclidine-Stabilized Amido- and Azidogallanes","Inorganic Chemistry","2000","39","","1705","1709","10.1021/ic9910110","","","0.71073","MoKα","","0.0264","0.0235","","0.0651","0.0639","","","","1.05","1.081","1.081","","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320869","11.3392","0.00001","14.7854","0.00001","12.0588","0.0002","90","","112.367","0.0001","90","","1869.61","0.03","173","2","173","2","","","","","","","Bing Luo, Prof. Gladfelter","5","P 1 21/n 1","-P 2yn","14","98253","","","- C13 H33 Ga N2 Si2 -","- C13 H33 Ga N2 Si2 -","- C52 H132 Ga4 N8 Si8 -","4","1","","Bing Luo; Victor G. Young; Wayne L. Gladfelter","Syntheses and Structures of Quinuclidine-Stabilized Amido- and Azidogallanes","Inorganic Chemistry","2000","39","","1705","1709","10.1021/ic9910110","","","0.71073","MoKα","","0.0353","0.0258","","0.0613","0.0574","","","","1.044","1.062","1.062","","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320870","10.761","0.0001","19.4052","0.0003","14.3919","0.0002","90","","97.65","0.001","90","","2978.56","0.07","173","2","173","2","","","","","","","B. Luo / Prof. W. Gladfelter","4","P 1 21/n 1","-P 2yn","14","98291a","","","- C31 H50 Ga N3 -","- C31 H50 Ga N3 -","- C124 H200 Ga4 N12 -","4","1","","Bing Luo; Victor G. Young; Wayne L. Gladfelter","Syntheses and Structures of Quinuclidine-Stabilized Amido- and Azidogallanes","Inorganic Chemistry","2000","39","","1705","1709","10.1021/ic9910110","","","0.71073","MoKα","","0.0315","0.0281","","0.0649","0.063","","","","1.079","1.087","1.087","","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320871","7.158","0.0002","22.7772","0.0007","12.5316","0.0003","90","","101.647","0.0001","90","","2001.07","0.1","173","2","173","2","","","","","","","Bing Luo, Prof. W. Glatfelter","4","P 1 21/n 1","-P 2yn","14","98251","","","- C7 H15 Ga N4 -","- C7 H14.95 Ga N4 -","- C56 H119.6 Ga8 N32 -","8","2","","Bing Luo; Victor G. Young; Wayne L. Gladfelter","Syntheses and Structures of Quinuclidine-Stabilized Amido- and Azidogallanes","Inorganic Chemistry","2000","39","","1705","1709","10.1021/ic9910110","","","0.71073","MoKα","","0.0741","0.0479","","0.0929","0.084","","","","1.067","1.127","1.127","","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320872","7.0065","0.0004","11.7976","0.0006","19.52","0.0014","90","","90","","90","","1613.52","0.17","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- F24 Ge20 H69.34 N16 O38.67 -","- F24 Ge20 H69.344 N16 O38.672 -","- F24 Ge20 H69.344 N16 O38.672 -","1","0.125","","Tony Conradsson; Xiaodong Zou; Mike S. Dadachov","Synthesis and Crystal Structure of a Novel Germanate: (NH4)4[(GeO2)3(GeO1.5F3)2].0.67H2O","Inorganic Chemistry","2000","39","","1716","1720","10.1021/ic9911217","","","0.71073","MoKα","","0.0316","0.0223","","","0.0514","0.0544","","","","","","0.767","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4320873","11.36","0.006","8.9614","0.0017","11.405","0.009","90","","97.22","0.09","90","","1151.8","1.1","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C8 H18 K2 Mn O25 U -","- C8 K2 Mn O25 U -","- C16 K4 Mn2 O50 U2 -","2","1","","Klaus P. Mörtl; Jean-Pascal Sutter; Stéphane Golhen; Lahcène Ouahab; Olivier Kahn","Structure and Magnetic Characteristics of an Oxalate-Bridged U(IV)-Mn(II) Three-Dimensional Network","Inorganic Chemistry","2000","39","","1626","1627","10.1021/ic9911825","","","0.71073","MoKα","","0.0219","0.0199","","","0.0532","0.0548","","","","","","0.684","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320874","7.0884","0.0016","23.336","0.004","9.0429","0.0018","90","","103.341","0.013","90","","1455.5","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C2 H6 N O12 P3 Sn4 -","- C2 H6 N O12 P3 Sn4 -","- C8 H24 N4 O48 P12 Sn16 -","4","1","","Yun-Ling Liu; Guang-Shan Zhu; Jie-Sheng Chen; Li-Yan Na; Jia Hua; Wen-Qin Pang; Ru-Ren Xu","Synthesis and Structural Characterization of a New Open-Framework Tin(II) Phosphate: [Sn4(PO4)3]-.0.5[C4N2H12]2+","Inorganic Chemistry","2000","39","","1820","1822","10.1021/ic991241e","","","0.71073","MoKα","","0.0346","0.0289","","","0.0678","0.0698","","","","","","1.021","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320875","23.4347","0.0009","9.4689","0.0004","49.145","0.002","90","","95.234","0.001","90","","10859.8","0.8","173","2","173","2","","","","","","","Dr. S. Mandal / Prof. L. Que","5","C 1 2/c 1","-C 2yc","15","96018","","","- C48 H51 Fe3 N9 O12 -","- C48 H51 Fe3 N9 O12 -","- C384 H408 Fe24 N72 O96 -","8","1","","Sanjay K. Mandal; Victor G. Young; Lawrence Que","Polynuclear Carboxylato-Bridged Iron(II) Clusters: Synthesis, Structure, and Host-Guest Chemistry","Inorganic Chemistry","2000","39","","1831","1833","10.1021/ic9912676","","","0.71073","MoKα","","0.0583","0.0506","","0.112","0.1085","","","","1.181","1.215","1.215","","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320876","8.7909","0.0013","9.939","0.002","10.69","0.002","69.43","0.01","85.647","0.01","88.901","0.014","871.9","0.3","213","2","213","2","","","","","","","synthesized","5","P -1","-P 1","2","none","Bis(2,6-di(phenylimino)piperidinato)bisacetatodimolybdenum(II)","","- C38 H38 Mo2 N6 O4 -","- C38 H38 Mo2 N6 O4 -","- C38 H38 Mo2 N6 O4 -","1","0.5","","F. Albert Cotton; Carlos A. Murillo; Lindsay E. Roy; Hong-Cai Zhou","Heteronuclear Chains of Four Metal Atoms Including One Quadruply Bonded Dimetal Unit. Dichromium and Dimolybdenum Compounds with Appended Copper(I) Atoms","Inorganic Chemistry","2000","39","","1743","1747","10.1021/ic991274u","","","0.71073","MoKα","","0.0389","0.0383","","0.0993","0.0974","","","","1.15","1.152","1.152","","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320877","14.405","0.004","12.45","0.025","32.786","0.008","90","","93.04","0.05","90","","5872","12","213","2","213","2","","","","","","","synthesized","4","P 1 21/c 1","-P 2ybc","14","none","Tetrakis(2,6-diphenaliminopiperidinato)dimolybdenum(II)","","- C68 H64 Mo2 N12 -","- C68 H59 Mo2 N12 -","- C272 H236 Mo8 N48 -","4","1","","F. Albert Cotton; Carlos A. Murillo; Lindsay E. Roy; Hong-Cai Zhou","Heteronuclear Chains of Four Metal Atoms Including One Quadruply Bonded Dimetal Unit. Dichromium and Dimolybdenum Compounds with Appended Copper(I) Atoms","Inorganic Chemistry","2000","39","","1743","1747","10.1021/ic991274u","","","0.71073","MoKα","","0.0522","0.0442","","0.1128","0.1034","","","","1.112","1.093","1.093","","","","","has coordinates,has disorder","179311","2020-10-21","18:00:00",""
"4320878","16.956","0.008","17.409","0.003","24.674","0.005","90","","100.52","0.02","90","","7161","4","213","2","213","2","","","","","","","synthesized","6","P 1 21/n 1","-P 2yn","14","none","Tetrakis(2,6-di(phenylimino)piperidinato)acetonitriledicopper(I,I) dichromium(II,II) bis(dichlorocuperate)","","- C74 H73 Cl4 Cr2 Cu4 N15 -","- C74 H64 Cl4 Cr2 Cu4 N15 -","- C296 H256 Cl16 Cr8 Cu16 N60 -","4","1","","F. Albert Cotton; Carlos A. Murillo; Lindsay E. Roy; Hong-Cai Zhou","Heteronuclear Chains of Four Metal Atoms Including One Quadruply Bonded Dimetal Unit. Dichromium and Dimolybdenum Compounds with Appended Copper(I) Atoms","Inorganic Chemistry","2000","39","","1743","1747","10.1021/ic991274u","","","0.71073","MoKα","","0.0879","0.0698","","0.1929","0.1719","","","","1.063","1.073","1.073","","","","","has coordinates,has disorder","179311","2020-10-21","18:00:00",""
"4320879","17.0279","0.0008","17.4881","0.0008","24.6718","0.0011","90","","100.78","0.001","90","","7217.3","0.6","293","2","293","2","","","","","","","synthesized","6","P 1 21/n 1","-P 2yn","14","none","Tetrakis(2,6-diphenyliminopiperidinato)acetonitrile dimolybdenum(II)dicopper(I) bis(dichlorocuperate)","","- C74 H73 Cl4 Cu4 Mo2 N15 -","- C74 H64 Cl4 Cu4 Mo2 N15 -","- C296 H256 Cl16 Cu16 Mo8 N60 -","4","1","","F. Albert Cotton; Carlos A. Murillo; Lindsay E. Roy; Hong-Cai Zhou","Heteronuclear Chains of Four Metal Atoms Including One Quadruply Bonded Dimetal Unit. Dichromium and Dimolybdenum Compounds with Appended Copper(I) Atoms","Inorganic Chemistry","2000","39","","1743","1747","10.1021/ic991274u","","","0.71073","MoKα","","0.0567","0.033","","0.0946","0.0842","","","","0.998","1.091","1.091","","","","","has coordinates,has disorder","179311","2020-10-21","18:00:00",""
"4320880","19.56","0.005","16.257","0.004","19.05","0.004","90","","90","","90","","6058","2","296.2","","296.2","","","","","","","","","6","C m c e","-C 2ac 2","64","[Bu4N][trans-{Re6S8Cl4(pz)2}]","","","- C40 H80 Cl4 N6 Re6 S8 -","- C40 H80 Cl4 N6 Re6 S8 -","- C160 H320 Cl16 N24 Re24 S32 -","4","0.25","","Takashi Yoshimura; Keisuke Umakoshi; Yoichi Sasaki; Shoji Ishizaka; Haeng-Boo Kim; Noboru Kitamura","Emission and Metal- and Ligand-Centered-Redox Characteristics of the Hexarhenium(III) Clusters trans- and cis-[Re6(μ3-S)8Cl4(L)2]2-, Where L Is a Pyridine Derivative or Pyrazine","Inorganic Chemistry","2000","39","","1765","1772","10.1021/ic991282a","","","0.7107","MoKα","","0.0331","0.0331","","","0.04","0.04","","","","","","1.82","","","","has coordinates","269108","2021-09-13","08:22:43",""
"4320881","8.876","0.002","9.017","0.002","19.841","0.003","101.91","0.02","97.144","0.008","100.206","0.009","1507.7","0.5","213","2","213","2","","","","","","","synthesized","6","P -1","-P 1","2","","Catena(bis(μ2-dimethylsulfoxide-O,S)-bis(μ3-trifluoroacetato)- -hexakis(μ2-trifluoroacetato)-tetra-rhodium(II)-tetrakis (μ2-trifluoroacetato)-di-rhodium(II))","","- C28 H12 F36 O26 Rh6 S2 -","- C28 H12 F36 O26 Rh6 S2 -","- C28 H12 F36 O26 Rh6 S2 -","1","0.5","","F. Albert Cotton; Evgeny V. Dikarev; Marina A. Petrukhina; Salah-Eddine Stiriba","Studies of Dirhodium(II) Tetra(trifluoroacetate). 5. Remarkable Examples of the Ambidentate Character of Dimethyl Sulfoxide","Inorganic Chemistry","2000","39","","1748","1754","10.1021/ic9913076","","","0.71073","MoKα","","0.0635","0.0532","","0.1416","0.1231","","","","1.087","1.061","1.061","","","","","has coordinates,has disorder","179311","2020-10-21","18:00:00",""
"4320882","28.261","0.002","16.059","0.004","17.636","0.002","90","","92.4","0.04","90","","7997","2","213","2","213","2","","","","","","","synthesized","6","P 1 21/c 1","-P 2ybc","14","","Hexakis(μ2-dimethylsulfoxide,-O,S)-bis(dimethylsulfoxide-O)- -heptakis(tetrakis(μ2-trifluoroacetato)-di-rhodium(II))","","- C72 H48 F84 O64 Rh14 S8 -","- C72 H48 F84 O64 Rh14 S8 -","- C144 H96 F168 O128 Rh28 S16 -","2","0.5","","F. Albert Cotton; Evgeny V. Dikarev; Marina A. Petrukhina; Salah-Eddine Stiriba","Studies of Dirhodium(II) Tetra(trifluoroacetate). 5. Remarkable Examples of the Ambidentate Character of Dimethyl Sulfoxide","Inorganic Chemistry","2000","39","","1748","1754","10.1021/ic9913076","","","0.71073","MoKα","","0.0729","0.0584","","0.1437","0.128","","","","1.135","1.136","1.136","","","","","has coordinates,has disorder","179311","2020-10-21","18:00:00",""
"4320883","8.915","0.002","10.592","0.002","11.916","0.002","84.85","0.01","88.86","0.01","65.187","0.008","1017","0.4","213","2","213","2","","","","","","","synthesized","6","P -1","-P 1","2","","Catena((μ2-dimethylsulfoxide-O,O)-tetrakis(μ2- -trifluoroacetato)-di-rhodium(II))","","- C10 H6 F12 O9 Rh2 S -","- C10 H6 F12 O9 Rh2 S -","- C20 H12 F24 O18 Rh4 S2 -","2","1","","F. Albert Cotton; Evgeny V. Dikarev; Marina A. Petrukhina; Salah-Eddine Stiriba","Studies of Dirhodium(II) Tetra(trifluoroacetate). 5. Remarkable Examples of the Ambidentate Character of Dimethyl Sulfoxide","Inorganic Chemistry","2000","39","","1748","1754","10.1021/ic9913076","","","0.71073","MoKα","","0.0471","0.0428","","0.1123","0.1072","","","","1.079","1.079","1.079","","","","","has coordinates,has disorder","179311","2020-10-21","18:00:00",""
"4320884","7.4667","0.0008","11.3406","0.0012","13.547","0.0014","108","0.0019","105.796","0.002","94.3","0.002","1033.79","0.19","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H13 F6 N3 O S -","- C22 H13 F6 N3 O S -","- C44 H26 F12 N6 O2 S2 -","2","1","","Tristram Chivers; Monica P. Gibson; Masood Parvez; Ignacio Vargas-Baca","Eight- and 16-Membered Cyanuric-Sulfanuric Ring Systems: C2N4S2→C2N3S Ring Contraction","Inorganic Chemistry","2000","39","","1697","1704","10.1021/ic991314u","","","0.71073","MoKα","","0.1006","0.0523","","","0.1136","0.1293","","","","","","0.917","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4320885","13.917","0.002","15.61","0.004","13.491","0.003","95.77","0.02","114.82","0.01","76.21","0.02","2583.4","1","170","","170","","","","","","","","","4","P -1","-P 1","2","","","","- C56 H48 N8 S4 -","- C56 H48 N8 S4 -","- C112 H96 N16 S8 -","2","1","","Tristram Chivers; Monica P. Gibson; Masood Parvez; Ignacio Vargas-Baca","Eight- and 16-Membered Cyanuric-Sulfanuric Ring Systems: C2N4S2→C2N3S Ring Contraction","Inorganic Chemistry","2000","39","","1697","1704","10.1021/ic991314u","","","0.7107","MoKα","","0.0488","0.0488","","0.0303","0.0303","","","","1.864","1.864","1.864","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4320886","7.316","0.002","29.508","0.005","12.9095","0.0015","90","","101.304","0.016","90","","2732.8","0.9","293","","293","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C28 H18 F6 N4 O2 S2 -","- C28 H18 F6 N4 O2 S2 -","- C112 H72 F24 N16 O8 S8 -","4","1","","Tristram Chivers; Monica P. Gibson; Masood Parvez; Ignacio Vargas-Baca","Eight- and 16-Membered Cyanuric-Sulfanuric Ring Systems: C2N4S2→C2N3S Ring Contraction","Inorganic Chemistry","2000","39","","1697","1704","10.1021/ic991314u","","","0.71069","MoKα","","0.2664","0.0851","","","0.2493","0.3585","","","","","","0.954","","","","has coordinates,has disorder","179311","2020-10-21","18:00:00",""
"4320887","12.849","0.004","12.863","0.004","12.61","0.007","110.61","0.03","105.77","0.04","62.77","0.02","1719.1","1.3","170","","170","","","","","","","","","6","P -1","-P 1","2","","","","- C37 H38 F6 N4 O2 S2 -","- C37 H22 F6 N4 O2 S2 -","- C74 H44 F12 N8 O4 S4 -","2","1","","Tristram Chivers; Monica P. Gibson; Masood Parvez; Ignacio Vargas-Baca","Eight- and 16-Membered Cyanuric-Sulfanuric Ring Systems: C2N4S2→C2N3S Ring Contraction","Inorganic Chemistry","2000","39","","1697","1704","10.1021/ic991314u","","","0.71069","MoKα","","0.1402","0.0691","","","0.1932","0.2488","","","","","","0.985","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320888","12.647","0.003","19.137","0.003","12.5498","0.0017","105.765","0.011","93.61","0.015","88.877","0.016","2917.3","0.9","170","","170","","","","","","","","","7","P -1","-P 1","2","","","","- C57 H38 Cl2 F12 N8 O4 S4 -","- C57 H38 Cl2 F12 N8 O4 S4 -","- C114 H76 Cl4 F24 N16 O8 S8 -","2","1","","Tristram Chivers; Monica P. Gibson; Masood Parvez; Ignacio Vargas-Baca","Eight- and 16-Membered Cyanuric-Sulfanuric Ring Systems: C2N4S2→C2N3S Ring Contraction","Inorganic Chemistry","2000","39","","1697","1704","10.1021/ic991314u","","","0.7107","MoKα","","0.0672","0.0672","","0.0585","0.0585","","","","2.415","2.415","2.415","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4320889","22.657","0.002","10.57","0.002","10.664","0.002","90","","90","","90","","2553.9","0.7","170","","170","","","","","","","","","5","P b a 2","P 2 -2ab","32","","","","- C14 H12 N2 O S -","- C14 H12 N2 O S -","- C112 H96 N16 O8 S8 -","8","2","","Tristram Chivers; Monica P. Gibson; Masood Parvez; Ignacio Vargas-Baca","Eight- and 16-Membered Cyanuric-Sulfanuric Ring Systems: C2N4S2→C2N3S Ring Contraction","Inorganic Chemistry","2000","39","","1697","1704","10.1021/ic991314u","","","0.71069","MoKα","","0.1588","0.0562","","","0.1558","0.2303","","","","","","1.019","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320890","8.9468","0.0004","10.1481","0.0005","13.554","0.0007","90","","108.249","0.001","90","","1168.71","0.1","295","","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","manganese gallium phosphate","","- Ga2 H6 Mn1.5 O15 P3 -","- Ga2 H6 Mn1.5 O15 P3 -","- Ga8 H24 Mn6 O60 P12 -","4","1","","Kuei-Fang Hsu; Sue-Lein Wang","Novel Gallium Phosphate Framework Encapsulating Trinuclear Mn3(H2O)6O8 Cluster: Hydrothermal Synthesis and Characterization of Mn3(H2O)6Ga4(PO4)6","Inorganic Chemistry","2000","39","","1773","1778","10.1021/ic991340s","","","0.71073","MoKα","","0.0509","0.0364","","","0.0949","0.1028","","","","","","1.044","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4320891","13.885","0.003","16.672","0.003","3.9215","0.0008","90","","90","","90","","907.8","0.3","153","2","153","2","","","","","","","","3","P n n m","-P 2 2n","58","triterbium chromium hexaselenide","","","- Cr Se6 Tb3 -","- Cr Se6 Tb3 -","- Cr4 Se24 Tb12 -","4","0.5","","Olivier Tougait; James A. Ibers","Ternary Rare-Earth Selenides with the U3ScS6 Structure Type: Synthesis, Characterization, and Some Magnetic Properties of Ln3TSe6 (Ln = Sm, Gd; T = In, Cr) and Tb3CrSe6","Inorganic Chemistry","2000","39","","1790","1794","10.1021/ic9914802","","","0.71073","MoKα","","0.0397","0.0326","","","0.0714","0.0737","","","","","","1.099","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320892","14.177","0.003","17.352","0.004","4.0625","0.0008","90","","90","","90","","999.4","0.4","153","2","153","2","","","","","","","","3","P n n m","-P 2 2n","58","trisamarium indium hexaselenide","","","- In Se6 Sm3 -","- In Se6 Sm3 -","- In4 Se24 Sm12 -","4","0.5","","Olivier Tougait; James A. Ibers","Ternary Rare-Earth Selenides with the U3ScS6 Structure Type: Synthesis, Characterization, and Some Magnetic Properties of Ln3TSe6 (Ln = Sm, Gd; T = In, Cr) and Tb3CrSe6","Inorganic Chemistry","2000","39","","1790","1794","10.1021/ic9914802","","","0.71073","MoKα","","0.0299","0.0247","","","0.0604","0.0618","","","","","","1.024","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320893","14.071","0.003","17.286","0.004","4.0202","0.0008","90","","90","","90","","977.8","0.4","153","2","153","2","","","","","","","","3","P n n m","-P 2 2n","58","trigadolinium indium hexaselenide","","","- Gd3 In Se6 -","- Gd3 In Se6 -","- Gd12 In4 Se24 -","4","0.5","","Olivier Tougait; James A. Ibers","Ternary Rare-Earth Selenides with the U3ScS6 Structure Type: Synthesis, Characterization, and Some Magnetic Properties of Ln3TSe6 (Ln = Sm, Gd; T = In, Cr) and Tb3CrSe6","Inorganic Chemistry","2000","39","","1790","1794","10.1021/ic9914802","","","0.71073","MoKα","","0.0273","0.0224","","","0.052","0.0533","","","","","","1.068","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320894","14.032","0.003","16.782","0.003","3.9841","0.0008","90","","90","","90","","938.2","0.3","153","2","153","2","","","","","","","","3","P n n m","-P 2 2n","58","trisamarium chromium hexaselenide","","","- Cr Se6 Sm3 -","- Cr Se6 Sm3 -","- Cr4 Se24 Sm12 -","4","0.5","","Olivier Tougait; James A. Ibers","Ternary Rare-Earth Selenides with the U3ScS6 Structure Type: Synthesis, Characterization, and Some Magnetic Properties of Ln3TSe6 (Ln = Sm, Gd; T = In, Cr) and Tb3CrSe6","Inorganic Chemistry","2000","39","","1790","1794","10.1021/ic9914802","","","0.71073","MoKα","","0.0342","0.0285","","","0.0648","0.0662","","","","","","1.034","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320895","13.938","0.003","16.78","0.003","3.9559","0.0008","90","","90","","90","","925.2","0.3","153","2","153","2","","","","","","","","3","P n n m","-P 2 2n","58","trigadolinium chromium hexaselenide","","","- Cr Gd3 Se6 -","- Cr Gd3 Se6 -","- Cr4 Gd12 Se24 -","4","0.5","","Olivier Tougait; James A. Ibers","Ternary Rare-Earth Selenides with the U3ScS6 Structure Type: Synthesis, Characterization, and Some Magnetic Properties of Ln3TSe6 (Ln = Sm, Gd; T = In, Cr) and Tb3CrSe6","Inorganic Chemistry","2000","39","","1790","1794","10.1021/ic9914802","","","0.71073","MoKα","","0.0374","0.0285","","","0.0583","0.0601","","","","","","1.092","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320896","20.2201","0.0002","20.2201","0.0002","11.7272","0.0001","90","","90","","90","","4794.69","0.08","223","2","223","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C7 H7 F6 In O2 -","- C7 H7 F6 In O2 -","- C112 H112 F96 In16 O32 -","16","1","","Chongying Xu; Thomas H. Baum; Ilia Guzei; Arnold L. Rheingold","Synthesis and Characterization of (hfac)In(CH3)2: A Volatile Compound Useful for CVD of Indium and Indium-Containing Materials","Inorganic Chemistry","2000","39","","2008","2010","10.1021/ic990266a","","","0.71073","MoKα","","0.0386","0.0301","","0.0914","0.0762","","","","1.022","1.057","1.057","","","","","has coordinates,has disorder","179311","2020-10-21","18:00:00",""
"4320897","14.379","0.003","14.47","0.003","18.003","0.004","90","","90","","90","","3745.8","1.4","293","2","293","2","","","","","","","","7","P c c n","-P 2ab 2ac","56","","","","- C28 H36 B2 Fe N6 O7 S6 -","- C28 H36 B2 Fe N6 O7 S6 -","- C112 H144 B8 Fe4 N24 O28 S24 -","4","0.5","","Yan Z. Voloshin; Oleg A. Varzatskii; Tatyana E. Kron; Vitaly K. Belsky; Valery E. Zavodnik; Nataly G. Strizhakova; Alexey V. Palchik","Triribbed-Functionalized Clathrochelate Iron(II) Dioximates as a New and Promising Tool To Obtain Polynucleating and Polynuclear Compounds with Improved Properties","Inorganic Chemistry","2000","39","","1907","1918","10.1021/ic990476n","","","0.71073","MoKα","","0.0289","0.0289","","0.0803","0.0803","","","","0.875","0.875","0.875","","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320898","25.075","0.005","8.135","0.002","16.415","0.003","90","","130.53","0.03","90","","2545","1.5","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C14 H18 B2 Cl6 Fe N6 O6 -","- C14 H18 B2 Cl6 Fe N6 O6 -","- C56 H72 B8 Cl24 Fe4 N24 O24 -","4","0.5","","Yan Z. Voloshin; Oleg A. Varzatskii; Tatyana E. Kron; Vitaly K. Belsky; Valery E. Zavodnik; Nataly G. Strizhakova; Alexey V. Palchik","Triribbed-Functionalized Clathrochelate Iron(II) Dioximates as a New and Promising Tool To Obtain Polynucleating and Polynuclear Compounds with Improved Properties","Inorganic Chemistry","2000","39","","1907","1918","10.1021/ic990476n","","","0.71073","MoKα","","0.0379","0.0379","","","0.1007","0.1008","","","","","","1.039","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320899","37.783","0.008","17.227","0.003","24.285","0.005","90","","120.48","0.03","90","","13622","6","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C34 H50 B2 Cl2 Fe N10 O6 -","- C34 H50 B2 Cl2 Fe N10 O6 -","- C408 H600 B24 Cl24 Fe12 N120 O72 -","12","1.5","","Yan Z. Voloshin; Oleg A. Varzatskii; Tatyana E. Kron; Vitaly K. Belsky; Valery E. Zavodnik; Nataly G. Strizhakova; Alexey V. Palchik","Triribbed-Functionalized Clathrochelate Iron(II) Dioximates as a New and Promising Tool To Obtain Polynucleating and Polynuclear Compounds with Improved Properties","Inorganic Chemistry","2000","39","","1907","1918","10.1021/ic990476n","","","0.71073","MoKα","","0.0492","0.0492","","","0.1447","0.1447","","","","","","1.095","","","","has coordinates","179311","2020-10-21","18:00:00",""
"4320900","17.634","0.004","8.197","0.002","18.799","0.004","90","","92.62","0.03","90","","2714.5","1.1","293","2","293","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C14 H16 B2 Cl6 F2 Fe N6 O8 -","- C14 B2 Cl6 F2 Fe N6 O8 -","- C56 B8 Cl24 F8 Fe4 N24 O32 -","4","0.5","","Yan Z. Voloshin; Oleg A. Varzatskii; Tatyana E. Kron; Vitaly K. Belsky; Valery E. Zavodnik; Nataly G. Strizhakova; Alexey V. Palchik","Triribbed-Functionalized Clathrochelate Iron(II) Dioximates as a New and Promising Tool To Obtain Polynucleating and Polynuclear Compounds with Improved Properties","Inorganic Chemistry","2000","39","","1907","1918","10.1021/ic990476n","","","0.71073","MoKα","","0.0639","0.0639","","0.1738","0.1738","","","","1.116","1.116","1.116","","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320901","17.718","0.004","25.075","0.005","13.445","0.003","90","","120.86","0.03","90","","5128","3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C25 H24 B Fe0.5 N3 O6 -","- C25 H24 B Fe0.5 N3 O6 -","- C200 H192 B8 Fe4 N24 O48 -","8","1","","Yan Z. Voloshin; Oleg A. Varzatskii; Tatyana E. Kron; Vitaly K. Belsky; Valery E. Zavodnik; Nataly G. Strizhakova; Alexey V. Palchik","Triribbed-Functionalized Clathrochelate Iron(II) Dioximates as a New and Promising Tool To Obtain Polynucleating and Polynuclear Compounds with Improved Properties","Inorganic Chemistry","2000","39","","1907","1918","10.1021/ic990476n","","","0.71073","MoKα","","0.0458","0.0458","","","0.1227","0.1227","","","","","","1.061","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4320902","19.9003","0.0004","9.5492","0.0002","23.6351","0.0004","90","","109.371","0.001","90","","4237.17","0.14","173","2","173","2","","","","","","","","4","I 1 2/a 1","-I 2ya","15","","[Ba(thd)2(THF)4]","","- C38 H70 Ba O8 -","- C38 H70 Ba O8 -","- C152 H280 Ba4 O32 -","4","0.5","","Witold Paw; Thomas H. Baum; Kin-Chung Lam; Arnold L. Rheingold","Low-Melting, Mononuclear Tetrahydrofuran Complexes of M(2,2,6,6-tetramethylheptane-3,5-dionate)2 (M = Ba, Sr) and Related Analogues","Inorganic Chemistry","2000","39","","2011","2014","10.1021/ic990641z","","","0.71073","MoKα","","0.1001","0.0761","","","0.2062","0.2291","","","","","","1.56","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320903","19.9087","0.0003","9.6863","0.0002","23.0043","0.0005","90","","109.242","0.0009","90","","4188.37","0.14","173","2","173","2","","","","","","","","4","I 1 2/a 1","-I 2ya","15","","[Sr(thd)2(THF)4]","","- C38 H70 O8 Sr -","- C38 H70 O8 Sr -","- C152 H280 O32 Sr4 -","4","0.5","","Witold Paw; Thomas H. Baum; Kin-Chung Lam; Arnold L. Rheingold","Low-Melting, Mononuclear Tetrahydrofuran Complexes of M(2,2,6,6-tetramethylheptane-3,5-dionate)2 (M = Ba, Sr) and Related Analogues","Inorganic Chemistry","2000","39","","2011","2014","10.1021/ic990641z","","","0.71073","MoKα","","0.093","0.0685","","","0.1668","0.1849","","","","","","1.626","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320904","8.297","0.002","11.04","0.002","6.983","0.001","90","","120.31","0.03","90","","552.2","0.3","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C2 Cs N5 -","- C2 Cs N5 -","- C8 Cs4 N20 -","4","0.5","","Hans P. H. Arp; Andreas Decken; Jack Passmore; Dale J. Wood","Preparation, Characterization, X-ray Crystal Structure, and Energetics of Cesium 5-Cyano-1,2,3,4-Tetrazolate: Cs[NCCNNNN]","Inorganic Chemistry","2000","39","","1840","1848","10.1021/ic990828q","","","0.71073","MoKα","","0.0622","0.0475","","0.1201","0.112","","","","1.094","1.076","1.076","","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320905","9.0658","0.0011","25.1387","0.0024","15.1849","0.0015","90","","104.989","0.01","90","","3342.9","0.6","150","1","150","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[Nb(NBu-t)Cl2(py){eta2-N(SiMe3)CH2CH2N(H)CH2CH2(SiMe3)2}]","","- C22 H50 Cl2 N5 Nb Si3 -","- C22 H50 Cl2 N5 Nb Si3 -","- C88 H200 Cl8 N20 Nb4 Si12 -","4","1","","Philip E. Collier; Stephen M. Pugh; Howard S. C. Clark; Jason B. Love; Alexander J. Blake; F. Geoffrey N. Cloke; Philip Mountford","Titanium and Niobium Imido Complexes Derived from Diamidoamine Ligands","Inorganic Chemistry","2000","39","","2001","2005","10.1021/ic991014c","","","0.71073","MoKα","","0.0512","0.0425","","0.0479","0.043","","","","1.272","","","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4320906","9.857","0.004","19.382","0.004","16.339","0.005","90","","102.26","0.04","90","","3050.3","1.7","150","1","150","1","","","","","","","?","5","P 1 21/c 1","-P 2ybc","14","","[Ti(NBu-t){Me3SiN(CH2CH2NSiMe3)2}(py)]","","- C22 H49 N5 Si3 Ti -","- C22 H49 N5 Si3 Ti -","- C88 H196 N20 Si12 Ti4 -","4","1","","Philip E. Collier; Stephen M. Pugh; Howard S. C. Clark; Jason B. Love; Alexander J. Blake; F. Geoffrey N. Cloke; Philip Mountford","Titanium and Niobium Imido Complexes Derived from Diamidoamine Ligands","Inorganic Chemistry","2000","39","","2001","2005","10.1021/ic991014c","","","0.71073","MoKα","","0.0722","0.062","","0.1231","0.111","","","","0.72","","","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4320907","11.098","0.002","11.098","0.002","14.844","0.002","90","","90","","120","","1583.3","0.5","200","","200","","","","","","","","see text","6","P -3 c 1","-P 3 2""c","165","","","","- C30 H48 Cl4 Fe2 N48 O16 -","- C30 H48 Cl4 Fe2.004 N48 O16 -","- C30 H48 Cl4 Fe2.004 N48 O16 -","1","0.0833333","","Petra J. van Koningsbruggen; Yann Garcia; Olivier Kahn; Léopold Fournès; Huub Kooijman; Anthony L. Spek; Jaap G. Haasnoot; Jacques Moscovici; Karine Provost; Alain Michalowicz; Franz Renz; Philipp Gütlich","Synthesis, Crystal Structure, EXAFS, and Magnetic Properties of Catena [μ-Tris(1,2-bis(tetrazol-1-yl)propane-N1,N1')iron(II)] Bis(perchlorate). First Crystal Structure of an Iron(II) Spin-Crossover Chain Compound","Inorganic Chemistry","2000","39","","1891","1900","10.1021/ic991118n","","","0.71073","MoKα","","0.088","0.0519","","","0.108","0.1208","","","","","","1.105","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320908","11.0301","0.0018","11.0301","0.0018","14.5458","0.0018","90","","90","","120","","1532.6","0.4","100","","100","","","","","","","","see text","6","P -3 c 1","-P 3 2""c","165","","","","- C30 H48 Cl4 Fe2 N48 O16 -","- C30 H48 Cl4 Fe2.004 N48 O16 -","- C30 H48 Cl4 Fe2.004 N48 O16 -","1","0.0833333","","Petra J. van Koningsbruggen; Yann Garcia; Olivier Kahn; Léopold Fournès; Huub Kooijman; Anthony L. Spek; Jaap G. Haasnoot; Jacques Moscovici; Karine Provost; Alain Michalowicz; Franz Renz; Philipp Gütlich","Synthesis, Crystal Structure, EXAFS, and Magnetic Properties of Catena [μ-Tris(1,2-bis(tetrazol-1-yl)propane-N1,N1')iron(II)] Bis(perchlorate). First Crystal Structure of an Iron(II) Spin-Crossover Chain Compound","Inorganic Chemistry","2000","39","","1891","1900","10.1021/ic991118n","","","0.71073","MoKα","","0.0815","0.0503","","","0.1145","0.1278","","","","","","1.068","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320909","11.6612","0.0014","8.648","0.001","18.493","0.002","90","","102.037","0.002","90","","1823.9","0.4","566","2","566","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H16 Mn N3 O5 -","- C19 H16 Mn N3 O5 -","- C76 H64 Mn4 N12 O20 -","4","1","","Zhan Shi; Lirong Zhang; Shan Gao; Guoyu Yang; Jia Hua; Lu Gao; Shouhua Feng","Coordination Polymers: Structural Transformation from Two to Three Dimensions through Ligand Conformation Change","Inorganic Chemistry","2000","39","","1990","1993","10.1021/ic991355q","","","0.71073","MoKα","","0.0701","0.0376","","","0.0661","0.0741","","","","","","0.821","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320910","7.706","0.006","9.509","0.006","10.236","0.011","97.58","0.04","106.08","0.04","108.936","0.017","661.1","1","566","2","566","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H11 Mn N2 O4.5 -","- C14 H10 Mn N2 O4.5 -","- C28 H20 Mn2 N4 O9 -","2","1","","Zhan Shi; Lirong Zhang; Shan Gao; Guoyu Yang; Jia Hua; Lu Gao; Shouhua Feng","Coordination Polymers: Structural Transformation from Two to Three Dimensions through Ligand Conformation Change","Inorganic Chemistry","2000","39","","1990","1993","10.1021/ic991355q","","","0.71073","MoKα","","0.0563","0.0454","","","0.1203","0.125","","","","","","1.066","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4320911","11.77","0.0002","11.8965","0.0004","20.972","0.0007","98.005","0.001","98.635","0.002","113.026","0.002","2607.92","0.14","213","2","213","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H44 Cl18 N8 Zr6 -","- C25 H33 Cl18 N8 Zr6 -","- C50 H66 Cl36 N16 Zr12 -","2","1","","Dong Sun; Timothy Hughbanks","Chloroaluminate Ionic Liquids as Reagents for Isolating Soluble Hexanuclear Zirconium Halide Cluster Compounds","Inorganic Chemistry","2000","39","","1964","1968","10.1021/ic9913785","","","0.71073","MoKα","","0.1638","0.0504","","0.0953","0.0764","","","","0.741","0.984","0.984","","","","","has coordinates,has disorder","179312","2020-10-21","18:00:00",""
"4320912","18.664","0.004","17.468","0.004","23.591","0.005","90","","104.73","0.03","90","","7438","3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C41 H69 Cl18 Mn N12 Zr6 -","- C41 H55 Cl18 Mn N12 Zr6 -","- C164 H220 Cl72 Mn4 N48 Zr24 -","4","1","","Dong Sun; Timothy Hughbanks","Chloroaluminate Ionic Liquids as Reagents for Isolating Soluble Hexanuclear Zirconium Halide Cluster Compounds","Inorganic Chemistry","2000","39","","1964","1968","10.1021/ic9913785","","","0.71073","MoKα","","0.0746","0.036","","0.0988","0.0886","","","","0.92","1.07","1.07","","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320913","11.785","0.002","11.8925","0.0015","21.006","0.002","98.003","0.009","98.8","0.009","112.877","0.009","2615.9","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H44 B Cl18 N8 Zr6 -","- C24 H39 B Cl18 N8 Zr6 -","- C48 H78 B2 Cl36 N16 Zr12 -","2","1","","Dong Sun; Timothy Hughbanks","Chloroaluminate Ionic Liquids as Reagents for Isolating Soluble Hexanuclear Zirconium Halide Cluster Compounds","Inorganic Chemistry","2000","39","","1964","1968","10.1021/ic9913785","","","0.71073","MoKα","","0.0572","0.0357","","0.0899","0.0807","","","","1.076","1.147","1.147","","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320914","9.478","0.003","10.919","0.003","11.914","0.005","90","","90","","90","","1233","0.7","148","2","148","2","","","","","","","","6","P n a 21","P 2c -2n","33","","Bis-O-(N-boranato-N,N-dimethylhydroxylammonium)silane","","- C5 H22 B2 N2 O2 Si -","- C5 H22 B2 N2 O2 Si -","- C20 H88 B8 N8 O8 Si4 -","4","1","","Norbert W. Mitzel; Udo Losehand; Bernhard Bauer","SiONB Unit as Reference for Blocked Si...N Interactions in SiON Compounds","Inorganic Chemistry","2000","39","","1998","2000","10.1021/ic991400u","","","0.71073","MoKα","","0.0436","0.0363","","0.105","0.0982","","","","1.06","1.054","1.054","","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320915","25.855","0.005","9.782","0.002","7.1201","0.0014","90","","96.9","0.03","90","","1787.7","0.6","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C12 H14 Ag Cu N5 O9 -","- C12 H14 Ag Cu N5 O9 -","- C48 H56 Ag4 Cu4 N20 O36 -","4","0.5","","Yu-Bin Dong; Mark D. Smith; Hans-Conrad zur Loye","Metal-Containing Ligands for Mixed-Metal Polymers: Novel Cu(II)-Ag(I) Mixed-Metal Coordination Polymers Generated from [Cu(2-methylpyrazine-5-carboxylate)2(H2O)].3H2O and Silver(I) Salts","Inorganic Chemistry","2000","39","","1943","1949","10.1021/ic991475y","","","0.71073","MoKα","","0.042","0.0373","","","0.105","0.1084","","","","","","1.068","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320916","10.498","0.002","11","0.002","8.1424","0.0016","98.33","0.03","101.83","0.03","66.68","0.03","843","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H18 Cu N4 O8 -","- C12 H18 Cu N4 O8 -","- C24 H36 Cu2 N8 O16 -","2","1","","Yu-Bin Dong; Mark D. Smith; Hans-Conrad zur Loye","Metal-Containing Ligands for Mixed-Metal Polymers: Novel Cu(II)-Ag(I) Mixed-Metal Coordination Polymers Generated from [Cu(2-methylpyrazine-5-carboxylate)2(H2O)].3H2O and Silver(I) Salts","Inorganic Chemistry","2000","39","","1943","1949","10.1021/ic991475y","","","0.71073","MoKα","","0.0388","0.0363","","","0.0968","0.0989","","","","","","1.163","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320917","25.827","0.005","9.643","0.0019","7.4525","0.0015","90","","94.74","0.03","90","","1849.7","0.6","293","2","293","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C12 H14 Ag B Cu F4 N4 O6 -","- C12 H14 Ag B Cu F4.02 N4 O6 -","- C48 H56 Ag4 B4 Cu4 F16.08 N16 O24 -","4","0.5","","Yu-Bin Dong; Mark D. Smith; Hans-Conrad zur Loye","Metal-Containing Ligands for Mixed-Metal Polymers: Novel Cu(II)-Ag(I) Mixed-Metal Coordination Polymers Generated from [Cu(2-methylpyrazine-5-carboxylate)2(H2O)].3H2O and Silver(I) Salts","Inorganic Chemistry","2000","39","","1943","1949","10.1021/ic991475y","","","0.71073","MoKα","","0.0435","0.0398","","","0.1061","0.1091","","","","","","1.077","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320918","9.9389","","16.8687","","11.0549","","90","","90","","90","","1853.42","","298","","25","","","","","","","","","5","C m c 21","C 2c -2","36","","","","- C11 H20 Cd N4 Se3 -","- C15 Cd N4 Se3 -","- C60 Cd4 N16 Se12 -","4","0.5","","Hong Zhang; David E. Zelmon; Gary E. Price; Boon K. Teo","Wide Spectral Range Nonlinear Optical Crystals of One-Dimensional Coordination Solids [Et4N][Cd(SCN)3] and [Et4N][Cd(SeCN)3] and the General Design Criteria for [R4N][Cd(XCN)3] (Where R = Alkyl and X = S, Se, Te) as NLO Crystals","Inorganic Chemistry","2000","39","","1868","1873","10.1021/ic9912833","","","0.7109","MoKalpha","","","0.048","","","0.063","","","","","3.24","3.24","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4320919","10.041","0.002","10.172","0.001","11.202","0.001","92.07","0.01","96.76","0.02","92.99","0.01","1133.6","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C19 H36 Cl Cu N5 O5 -","- C19 H34 Cl Cu N5 O5 -","- C38 H68 Cl2 Cu2 N10 O10 -","2","1","","Paul V. Bernhardt; Philip C. Sharpe","Structurally Reinforced Tetraazamacrocyclic Complexes","Inorganic Chemistry","2000","39","","2020","2025","10.1021/ic9906353","","","0.71073","MoKα","","0.0927","0.0805","","","0.1956","0.2091","","","","","","1.088","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320920","15.159","0.005","10.645","0.001","19.094","0.006","90","","93.78","0.01","90","","3074.4","1.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C27 H39 Cl2 Cu N5 O6 -","- C27 H39 Cl2 Cu N5 O6 -","- C108 H156 Cl8 Cu4 N20 O24 -","4","1","","Paul V. Bernhardt; Philip C. Sharpe","Structurally Reinforced Tetraazamacrocyclic Complexes","Inorganic Chemistry","2000","39","","2020","2025","10.1021/ic9906353","","","0.71073","MoKα","","0.0934","0.0403","","","0.1046","0.1281","","","","","","0.987","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320921","10.649","0.008","7.261","0.002","15.25","0.01","90","","94.77","0.04","90","","1175.1","1.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H32 Cu N7 Na O9 -","- C16 H32 Cu N7 Na O9 -","- C32 H64 Cu2 N14 Na2 O18 -","2","0.5","","Paul V. Bernhardt; Philip C. Sharpe","Structurally Reinforced Tetraazamacrocyclic Complexes","Inorganic Chemistry","2000","39","","2020","2025","10.1021/ic9906353","","","0.71073","MoKα","","0.0833","0.0652","","","0.1675","0.1842","","","","","","1.07","","","","has coordinates,has disorder","179312","2020-10-21","18:00:00",""
"4320922","12.055","0.004","10.652","0.003","12.701","0.003","90.54","0.02","94.39","0.02","91.35","0.03","1625.6","0.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H38 Cl2 Cu N4 O10 -","- C26 H38 Cl2 Cu N4 O9.95 -","- C52 H76 Cl4 Cu2 N8 O19.9 -","2","1","","P. S. Subramanian; E. Suresh; D. Srinivas","Synthesis, X-ray Structure, Single-Crystal EPR and 1H NMR Studies of a Distorted Square Planar Cu(salEen)2(ClO4)2 Complex in a Novel Bilayered Architecture: salEen = N,N-Diethylethylenesalicylidenamine","Inorganic Chemistry","2000","39","","2053","2060","10.1021/ic990874q","","","0.7107","MoKα","","0.1717","0.0889","","","0.22","0.2438","","","","","","1.017","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320923","6.694","0.0003","6.694","0.0003","7.5736","0.0005","90","","90","","90","","339.37","0.03","173","2","173","2","","","","","","","","3","I -4 2 m","I -4 2","121","","","","- Cr K3 O8 -","- Cr K3 O8 -","- Cr2 K6 O16 -","2","0.125","","Richard M. Wood; Khalil A. Abboud; Ruth C. Palenik; Gus J. Palenik","Bond Valence Sums in Coordination Chemistry. Calculation of the Oxidation State of Chromium in Complexes Containing Only Cr-O Bonds and a Redetermination of the Crystal Structure of Potassium Tetra(peroxo)chromate(V)","Inorganic Chemistry","2000","39","","2065","2068","10.1021/ic990982c","","","0.71073","MoKα","","0.0149","0.0149","","0.0408","0.0408","","","","1.032","1.034","1.034","","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320924","10.5316","0.0002","19.9374","0.0001","22.4162","0.0005","90","","96.712","0.001","90","","4674.53","0.14","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C56 H44 Cl O4 P2 Rh -","- C56 H44 Cl O4 P2 Rh -","- C224 H176 Cl4 O16 P8 Rh4 -","4","1","","Swati Dutta; Shie-Ming Peng; Samaresh Bhattacharya","Ligand Control on Molecular Oxygen Activation by Rhodium Quinone Complexes","Inorganic Chemistry","2000","39","","2231","2234","10.1021/ic990999v","","","0.71073","MoKα","","0.1532","0.0767","","0.1576","0.1317","","","","1.024","1.154","1.154","","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320925","16.2358","0.0007","18.3175","0.0007","27.068","0.0008","90","","90","","90","","8050","0.5","295","2","295","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C44 H33 Cl5 N O2 P2 Rh -","- C44 H33 Cl5 N O2 P2 Rh -","- C352 H264 Cl40 N8 O16 P16 Rh8 -","8","1","","Swati Dutta; Shie-Ming Peng; Samaresh Bhattacharya","Ligand Control on Molecular Oxygen Activation by Rhodium Quinone Complexes","Inorganic Chemistry","2000","39","","2231","2234","10.1021/ic990999v","","","0.71073","MoKα","","0.1562","0.1146","","0.1341","0.1246","","","","1.379","1.457","1.457","","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320926","12.355","0.009","12.474","0.004","12.854","0.006","90","","117.68","0.04","90","","1754.3","1.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","[Cu(4-Ethylpyridine)2(N3)(NO3)]2","Di-mu-(1,1)-Azido-di(O,O'-nitrato)tetrakis(4-Ethylpyridine)dicopper(II)","","- C28 H36 Cu2 N12 O6 -","- C28 H36 Cu2 N12 O6 -","- C56 H72 Cu4 N24 O12 -","2","0.5","","Albert Escuer; Mohamed A. S. Goher; Franz A. Mautner; Ramon Vicente","Three New Polynuclear Copper(II) Complexes with the Symmetric [Cu(μ1,1-N3)2Cu]2+ Core and Pyridine Derivatives: Syntheses, Structure, and Magnetic Behavior","Inorganic Chemistry","2000","39","","2107","2112","10.1021/ic991135c","","","0.71069","MoKα","","0.1006","0.0561","","0.1412","0.1235","","","","1.051","1.161","1.161","","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320927","9.695","0.002","10.895","0.002","7.909","0.002","96.81","0.03","96.4","0.03","96.56","0.03","817.4","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","[Cu(3-aminopyridine)2(N3)(NO3)]2.C2H5OH","","","- C22 H30 Cu2 N16 O7 -","- C22 H30 Cu2 N16 O7 -","- C22 H30 Cu2 N16 O7 -","1","0.5","","Albert Escuer; Mohamed A. S. Goher; Franz A. Mautner; Ramon Vicente","Three New Polynuclear Copper(II) Complexes with the Symmetric [Cu(μ1,1-N3)2Cu]2+ Core and Pyridine Derivatives: Syntheses, Structure, and Magnetic Behavior","Inorganic Chemistry","2000","39","","2107","2112","10.1021/ic991135c","","","0.71069","MoKα","","0.0695","0.0499","","0.1399","0.122","","","","1.044","1.088","1.088","","","","","has coordinates,has disorder","179312","2020-10-21","18:00:00",""
"4320928","7.755","0.002","14.68","0.005","15.81","0.005","90","","102.81","0.02","90","","1755.1","0.9","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","[Cu3(N3)6(Methyl-Isonicotinate)2(DMF)2]","","","- C20 H28 Cu3 N22 O6 -","- C20 H28 Cu3 N22 O6 -","- C40 H56 Cu6 N44 O12 -","2","0.5","","Albert Escuer; Mohamed A. S. Goher; Franz A. Mautner; Ramon Vicente","Three New Polynuclear Copper(II) Complexes with the Symmetric [Cu(μ1,1-N3)2Cu]2+ Core and Pyridine Derivatives: Syntheses, Structure, and Magnetic Behavior","Inorganic Chemistry","2000","39","","2107","2112","10.1021/ic991135c","","","0.71069","MoKα","","0.0958","0.0481","","0.1276","0.1073","","","","0.912","0.986","0.986","","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320929","21.9548","0.0004","16.7994","0.0001","23.0086","0.0004","90","","109.654","0.001","90","","7991.8","0.2","200","2","200","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C62 H132 Cu3 F7 O9 P6 S2 -","- C62 H132 Cu3 F7 O9 P6 S2 -","- C248 H528 Cu12 F28 O36 P24 S8 -","4","1","","Bernd F. Straub; Frank Rominger; Peter Hofmann","A Trigonal Planar μ3-Fluorido Coinage Metal Complex from a Dicationic (Diphosphinomethane)copper(I) Dimer: Syntheses, Structures, and Bonding","Inorganic Chemistry","2000","39","","2113","2119","10.1021/ic991173w","","","0.71073","MoKα","","0.1194","0.0723","","","0.1673","0.1842","","","","","","1.176","","","","has coordinates,has disorder","179312","2020-10-21","18:00:00",""
"4320930","12.2534","0.0001","26.2696","0.0002","25.2484","0.0002","90","","90.813","0.001","90","","8126.44","0.11","200","2","200","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C31.5 H66 Cu1.5 F6.5 O1.5 P4 -","- C31.5 H66 Cu1.5 F6.5 O1.5 P4 -","- C252 H528 Cu12 F52 O12 P32 -","8","2","","Bernd F. Straub; Frank Rominger; Peter Hofmann","A Trigonal Planar μ3-Fluorido Coinage Metal Complex from a Dicationic (Diphosphinomethane)copper(I) Dimer: Syntheses, Structures, and Bonding","Inorganic Chemistry","2000","39","","2113","2119","10.1021/ic991173w","","","0.71073","MoKα","","0.1069","0.0725","","","0.1863","0.2087","","","","","","1.106","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4320931","20.2467","0.0001","41.775","0.0004","13.6175","0.0002","90","","90","","90","","11517.8","0.2","200","2","200","2","","","","","","","","7","F d d 2","F 2 -2d","43","","","","- C44 H96 Cu2 F6 O8 P4 S2 -","- C46 H76 Cu2 F6 O6 P4 S2 -","- C368 H608 Cu16 F48 O48 P32 S16 -","8","0.5","","Bernd F. Straub; Frank Rominger; Peter Hofmann","A Trigonal Planar μ3-Fluorido Coinage Metal Complex from a Dicationic (Diphosphinomethane)copper(I) Dimer: Syntheses, Structures, and Bonding","Inorganic Chemistry","2000","39","","2113","2119","10.1021/ic991173w","","","0.71073","MoKα","","0.0316","0.0297","","","0.073","0.074","","","","","","1.048","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320932","20.946","0.002","12.0633","0.0006","21.1728","0.0016","90","","113.554","0.01","90","","4904.2","0.7","223","2","223","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C38.5 H56 Cl2 N10 Ni O17 -","- C38.5 H56 Cl2 N10 Ni O17 -","- C154 H224 Cl8 N40 Ni4 O68 -","4","1","","Giancarlo Francese; Francisco M. Romero; Antonia Neels; Helen Stoeckli-Evans; Silvio Decurtins","Crystal Structures and Magnetic Properties of Metal Complexes Bearing Four Nitronyl Nitroxide Moieties in the Same Coordination Sphere","Inorganic Chemistry","2000","39","","2087","2095","10.1021/ic991236a","","","0.71073","MoKα","","0.1277","0.0535","","","0.1111","0.1283","","","","","","0.792","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4320933","20.9197","0.0019","12.0981","0.0008","21.215","0.0015","90","","113.13","0.009","90","","4937.7","0.7","223","2","223","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C39 H58 Cl2 Co N10 O17.5 -","- C39 H58 Cl2 Co N10 O17.5 -","- C156 H232 Cl8 Co4 N40 O70 -","4","1","","Giancarlo Francese; Francisco M. Romero; Antonia Neels; Helen Stoeckli-Evans; Silvio Decurtins","Crystal Structures and Magnetic Properties of Metal Complexes Bearing Four Nitronyl Nitroxide Moieties in the Same Coordination Sphere","Inorganic Chemistry","2000","39","","2087","2095","10.1021/ic991236a","","","0.71073","MoKα","","0.1199","0.0467","","","0.0891","0.104","","","","","","0.759","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4320934","11.4097","0.001","12.9316","0.0013","21.609","0.002","96.037","0.012","102.245","0.011","114.983","0.01","2755.1","0.6","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","","","- C43 H61.5 Cl2 N12.5 O16 Zn -","- C43 H61.5 Cl2 N12.5 O16 Zn -","- C86 H123 Cl4 N25 O32 Zn2 -","2","1","","Giancarlo Francese; Francisco M. Romero; Antonia Neels; Helen Stoeckli-Evans; Silvio Decurtins","Crystal Structures and Magnetic Properties of Metal Complexes Bearing Four Nitronyl Nitroxide Moieties in the Same Coordination Sphere","Inorganic Chemistry","2000","39","","2087","2095","10.1021/ic991236a","","","0.71073","MoKα","","0.1012","0.067","","","0.177","0.194","","","","","","0.941","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4320935","11.5473","0.0008","19.2121","0.001","25.2361","0.0019","90","","98.772","0.009","90","","5533.1","0.6","223","2","223","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C42 H62 Cl5 Mn N10 O17 -","- C42 H62 Cl5 Mn N10 O17 -","- C168 H248 Cl20 Mn4 N40 O68 -","4","1","","Giancarlo Francese; Francisco M. Romero; Antonia Neels; Helen Stoeckli-Evans; Silvio Decurtins","Crystal Structures and Magnetic Properties of Metal Complexes Bearing Four Nitronyl Nitroxide Moieties in the Same Coordination Sphere","Inorganic Chemistry","2000","39","","2087","2095","10.1021/ic991236a","","","0.71073","MoKα","","0.0755","0.0573","","","0.1721","0.1818","","","","","","1.079","","","","has coordinates,has disorder","179312","2020-10-21","18:00:00",""
"4320936","12.1604","0.0009","12.6961","0.0009","18.1028","0.0012","84.191","0.008","73.392","0.008","66.072","0.008","2447.8","0.4","203","2","203","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H57 Cl2 Cu N11 O16 -","- C40 H57 Cl2 Cu N11 O16 -","- C80 H114 Cl4 Cu2 N22 O32 -","2","1","","Giancarlo Francese; Francisco M. Romero; Antonia Neels; Helen Stoeckli-Evans; Silvio Decurtins","Crystal Structures and Magnetic Properties of Metal Complexes Bearing Four Nitronyl Nitroxide Moieties in the Same Coordination Sphere","Inorganic Chemistry","2000","39","","2087","2095","10.1021/ic991236a","","","0.71073","MoKα","","0.1333","0.0396","","","0.0571","0.0755","","","","","","0.599","","","","has coordinates,has disorder","179312","2020-10-21","18:00:00",""
"4320937","10.6234","0.0002","35.5553","0.0007","13.5231","0.0002","90","","106.732","0.001","90","","4891.66","0.15","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C51 H41 Cl4 N4 O4 Tl -","- C51 H39 Cl4 N4 O4 Tl -","- C204 H156 Cl16 N16 O16 Tl4 -","4","1","","Jo-Yu Tung; Jyh-Horung Chen; Feng-Ling Liao; Sue-Lein Wang; Lian-Pin Hwang","Crystal and Molecular Structure of an Eight-Coodinate N-Methyltetraphenylporphyrin Complex: Diacetato(N-methyl-meso-tetraphenylporphyrinato)thallium(III)","Inorganic Chemistry","2000","39","","2120","2124","10.1021/ic991260o","","","0.71073","MoKα","","0.083","0.0569","","","0.1079","0.1164","","","","","","1.214","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320938","13.33","0.02","5.72","0.02","14.9","0.03","90","","108.83","0.04","90","","1075","5","296.2","","296.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C7 H2 Ag I3 O2 -","- C7 H2 Ag I3 O2 -","- C28 H8 Ag4 I12 O8 -","4","1","","Ichiro Ino; Liang Ping Wu; Megumu Munakata; Masahiko Maekawa; Yusaku Suenaga; Takayoshi Kuroda-Sowa; Yoshinobu Kitamori","Structural Studies of Silver(I) Coordination Polymers with Aryl Iodide Derived Ligands","Inorganic Chemistry","2000","39","","2146","2151","10.1021/ic991261g","","","0.7107","MoKα","","0.0285","0.028","","","0.098","0.0985","","","","","","1.564","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4320939","10.6675","0.0007","10.537","0.001","25.5279","0.0006","90","","93.7476","0.0006","90","","2863.3","0.3","296.2","","296.2","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C24 H20 Ag Cl I3 N O5 -","- C24 H20 Ag Cl I3 N O5 -","- C96 H80 Ag4 Cl4 I12 N4 O20 -","4","1","","Ichiro Ino; Liang Ping Wu; Megumu Munakata; Masahiko Maekawa; Yusaku Suenaga; Takayoshi Kuroda-Sowa; Yoshinobu Kitamori","Structural Studies of Silver(I) Coordination Polymers with Aryl Iodide Derived Ligands","Inorganic Chemistry","2000","39","","2146","2151","10.1021/ic991261g","","","0.7107","MoKα","","0.0518","0.0422","","","0.1259","0.1304","","","","","","1.647","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4320940","10.854","0.004","20.176","0.006","10.9803","0.0008","90","","116.08","0.002","90","","2159.7","1","296.2","","296.2","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C18 H12 Ag Cl I3 N O4 -","- C18 H12 Ag Cl I3 N O4 -","- C72 H48 Ag4 Cl4 I12 N4 O16 -","4","1","","Ichiro Ino; Liang Ping Wu; Megumu Munakata; Masahiko Maekawa; Yusaku Suenaga; Takayoshi Kuroda-Sowa; Yoshinobu Kitamori","Structural Studies of Silver(I) Coordination Polymers with Aryl Iodide Derived Ligands","Inorganic Chemistry","2000","39","","2146","2151","10.1021/ic991261g","","","0.7107","MoKα","","0.0379","0.0338","","","0.1184","0.1225","","","","","","1.77","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4320941","11.611","0.001","22.806","0.003","11.9415","0.0001","90","","110.005","0.0003","90","","2971.3","0.5","296.2","","296.2","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C12 H6 Ag2 F9 I2 N O10 S3 -","- C12 H6 Ag2 F9 I2 N O10 S3 -","- C48 H24 Ag8 F36 I8 N4 O40 S12 -","4","1","","Ichiro Ino; Liang Ping Wu; Megumu Munakata; Masahiko Maekawa; Yusaku Suenaga; Takayoshi Kuroda-Sowa; Yoshinobu Kitamori","Structural Studies of Silver(I) Coordination Polymers with Aryl Iodide Derived Ligands","Inorganic Chemistry","2000","39","","2146","2151","10.1021/ic991261g","","","0.7107","MoKα","","0.0925","0.0752","","","0.2175","0.2347","","","","","","2.811","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4320942","9.667","0.003","18.264","0.008","13.163","0.006","90","","102.41","0.03","90","","2269.7","1.6","293","2","293","2","","","","","","","synthesized by the authors, see text","5","P 1 21/n 1","-P 2yn","14","","Tetrabutylammonium Bis(malonato)dioxo-osmate(VI)","","- C38 H76 N2 O10 Os -","- C38 H76 N2 O10 Os -","- C76 H152 N4 O20 Os2 -","2","0.5","","Sandrine Stanislas; André L. Beauchamp; Christian Reber","The Lowest-Energy Ligand to Metal Charge-Transfer Absorption Band of trans-[OsO2(Malonate)2]2-","Inorganic Chemistry","2000","39","","2152","2155","10.1021/ic9912777","","","1.54056","CuKα","","0.0644","0.0289","","0.0714","","0.0648","","","0.803","","","0.958","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320943","14.821","0.005","10.27","0.004","17.663","0.006","90","","108.87","0.03","90","","2544","1.6","293","2","293","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C17 H38 Cl3 N5 Ni2 O2 -","- C16.5 H27 Cl3 N5 Ni2 O4 -","- C66 H108 Cl12 N20 Ni8 O16 -","4","1","","Paolo Dapporto; Mauro Formica; Vieri Fusi; Mauro Micheloni; Paola Paoli; Roberto Pontellini; Paolo Romani; Patrizia Rossi","Polyamine Macrocycles Incorporating a Phenolic Function: Their Synthesis, Basicity, and Coordination Behavior toward Metal Cations. Crystal Structure of a Binuclear Nickel Complex","Inorganic Chemistry","2000","39","","2156","2163","10.1021/ic991291j","","","0.71069","MoKα","","0.2031","0.0973","","0.2794","0.2136","","","","1.05","1.193","1.193","","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320944","10.3943","0.0009","15.4092","0.0014","18.205","0.003","90","","104.754","0.01","90","","2819.7","0.6","293","2","293","2","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C22 H32 Cr Cu K N4 O12 -","- C22 H32 Cr Cu K N4 O12 -","- C88 H128 Cr4 Cu4 K4 N16 O48 -","4","1","","Hao-Yu Shen; Wei-Ming Bu; Dai-Zheng Liao; Zong-Hui Jiang; Shi-Ping Yan; Geng-Lin Wang","Three-Dimensional Oxalate-Bridged Heterometal Supramolecular Complex with a Large Helical Tunnel of 21.191 x 9.294 Å2","Inorganic Chemistry","2000","39","","2239","2242","10.1021/ic991325n","","","0.71073","MoKα","","0.0644","0.0481","","0.0756","0.0616","","","","1.151","1.177","1.177","","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320945","10.666","0.002","16.27","0.003","12.002","0.003","90","0.02","114.81","0.02","90","0.02","1890.5","0.8","153","5","153","5","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C36 H44 O3 Se4 Sm Zn -","- C36 H44 O3 Se4 Sm Zn -","- C72 H88 O6 Se8 Sm2 Zn2 -","2","1","","Deborah Freedman; Anna Kornienko; Thomas J. Emge; John G. Brennan","Divalent Samarium Compounds with Heavier Chalcogenolate (EPh; E = Se, Te) Ligands","Inorganic Chemistry","2000","39","","2168","2171","10.1021/ic9913278","","","0.71073","MoKα","","0.0579","0.0366","","","0.0812","0.0858","","","","","","1.026","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320946","8.2051","0.0012","16.511","0.003","8.1432","0.0002","90","","111.597","0.0006","90","","1025.7","0.2","180.2","","180.2","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C6 F17 O6 Sb3 W -","- C6 F17 O6 Sb3 W -","- C12 F34 O12 Sb6 W2 -","2","1","","Raimund Bröchler; Iona H. T. Sham; Matthias Bodenbinder; Volker Schmitz; Steven J. Rettig; James Trotter; Helge Willner; Friedhelm Aubke","The Synthesis and the Molecular Structure of Hexakis(carbonyl)hexafluoroantimonato(V)tungsten(II) Undecafluorodiantimonate(V), [W(CO)6(FSbF5)][Sb2F11]","Inorganic Chemistry","2000","39","","2172","2177","10.1021/ic991331j","","","0.7107","MoKα","","0.0428","","","0.0475","","","","","1.124","","","1.12","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4320947","19.132","0.007","11.188","0.004","23.666","0.009","90","","98.77","0.01","90","","5006","3","298","","298","","","","","","","","","7","I 1 2/a 1","-I 2ya","15","","","","- C23 H29 Cl N3 O2.5 P Re -","- C23 H26 Cl N3 O2.5 P Re -","- C184 H208 Cl8 N24 O20 P8 Re8 -","8","1","","Berthold Nock; Theodosia Maina; Francesco Tisato; Minas Papadopoulos; Catherine P. Raptopoulou; Aris Terzis; Efstratios Chiotellis","Synthesis and Characterization of Six-Coordinate ""3 + 2"" Mixed-Ligand Oxorhenium Complexes with theo-Diphenylphosphinophenolato Ligand and Tridentate Coligands of Different N and S Donor Atom Combinations","Inorganic Chemistry","2000","39","","2178","2184","10.1021/ic991341k","","","0.71073","MoKα","","0.034","0.0279","","0.0751","0.071","","","","1.078","1.083","1.083","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4320948","11.806","0.002","10.067","0.002","21.332","0.005","90","","90","","90","","2535.3","0.9","298","","298","","","","","","","","","7","P 21 c n","P -2n 2a","33","","","","- C26 H32 N2 O2 P Re S -","- C26 H32 N2 O2 P Re S -","- C104 H128 N8 O8 P4 Re4 S4 -","4","1","","Berthold Nock; Theodosia Maina; Francesco Tisato; Minas Papadopoulos; Catherine P. Raptopoulou; Aris Terzis; Efstratios Chiotellis","Synthesis and Characterization of Six-Coordinate ""3 + 2"" Mixed-Ligand Oxorhenium Complexes with theo-Diphenylphosphinophenolato Ligand and Tridentate Coligands of Different N and S Donor Atom Combinations","Inorganic Chemistry","2000","39","","2178","2184","10.1021/ic991341k","","","1.5418","CuKα","","0.0313","0.03","","0.0813","0.0795","","","","1.052","1.047","1.047","","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320949","14.328","0.002","18.603","0.002","18.948","0.002","90","","90","","90","","5050.5","1","298","","298","","","","","","","","","7","P c a b","-P 2bc 2ac","61","","","","- C26 H30 N2 O2 P Re S -","- C26 H30 N2 O2 P Re S -","- C208 H240 N16 O16 P8 Re8 S8 -","8","1","","Berthold Nock; Theodosia Maina; Francesco Tisato; Minas Papadopoulos; Catherine P. Raptopoulou; Aris Terzis; Efstratios Chiotellis","Synthesis and Characterization of Six-Coordinate ""3 + 2"" Mixed-Ligand Oxorhenium Complexes with theo-Diphenylphosphinophenolato Ligand and Tridentate Coligands of Different N and S Donor Atom Combinations","Inorganic Chemistry","2000","39","","2178","2184","10.1021/ic991341k","","","1.5418","CuKα","","0.0508","0.0398","","0.1239","0.1125","","","","1.143","1.177","1.177","","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320950","24","0.01","24","0.01","8.693","0.004","90","","90","","90","","5007","4","298","","298","","","","","","","","","7","I 4","I 4","79","","","","- C24.25 H28 N O2.25 P Re S2 -","- C24.25 H27 N O2.25 P Re S2 -","- C194 H216 N8 O18 P8 Re8 S16 -","8","1","","Berthold Nock; Theodosia Maina; Francesco Tisato; Minas Papadopoulos; Catherine P. Raptopoulou; Aris Terzis; Efstratios Chiotellis","Synthesis and Characterization of Six-Coordinate ""3 + 2"" Mixed-Ligand Oxorhenium Complexes with theo-Diphenylphosphinophenolato Ligand and Tridentate Coligands of Different N and S Donor Atom Combinations","Inorganic Chemistry","2000","39","","2178","2184","10.1021/ic991341k","","","0.71073","MoKα","","0.0539","0.0378","","0.0993","0.0899","","","","1.076","1.077","1.077","","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320951","16.1639","0.0003","6.3725","0.0003","11.6908","0.0004","90","0.001","128.727","0.001","90","","939.44","0.06","173","2","173","2","","","","","","","Prof. P. Kaszynski / Vanderbilt Univ.","4","C 1 2/c 1","-C 2yc","15","99066","1,10-Dicarba-closo-decaborane-1,10-dicarbanitrile","","- C2 H4 B4 N -","- C2 H4 B4 N -","- C16 H32 B32 N8 -","8","1","","Serhii Pakhomov; Piotr Kaszynski; Victor G. Young","10-Vertexcloso-Boranes as Potential π Linkers for Electronic Materials","Inorganic Chemistry","2000","39","","2243","2245","10.1021/ic991350t","","","0.71073","MoKα","","0.0466","0.0415","","0.1178","0.1133","","","","1.084","1.115","1.115","","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320952","9.5189","0.0004","10.6148","0.0005","12.0415","0.0005","68.071","0.001","72.51","0.001","72.378","0.001","1051.23","0.08","173","2","173","2","","","","","","","Dr. Serhii Pakhomov, Prof. P. Kaszynski","4","P -1","-P 1","2","99247","1,10-Bis(TMS-acetylene)-1,10-Dicarba-closo-decaborane","","- C14 H26 B8 Si2 -","- C12 H26 B8 Si2 -","- C24 H52 B16 Si4 -","2","1","","Serhii Pakhomov; Piotr Kaszynski; Victor G. Young","10-Vertexcloso-Boranes as Potential π Linkers for Electronic Materials","Inorganic Chemistry","2000","39","","2243","2245","10.1021/ic991350t","","","0.71073","MoKα","","0.0689","0.0479","","0.1343","0.1244","","","","1.056","1.14","1.14","","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320953","12.7319","0.0014","14.6069","0.0019","12.6624","0.0019","90","","95.277","0.012","90","","2344.9","0.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- Cl13.8 Nb6 O4.2 Ti2 Tl0.2 -","- Cl13.862 Nb6 O4.138 Ti2 Tl0.1932 -","- Cl55.448 Nb24 O16.552 Ti8 Tl0.7728 -","4","0.5","","Ekaterina Anokhina; Michael Essig; Cynthia Day; Abdessadek Lachgar","Structural Studies of Indium and Thallium Insertion into the Framework of the Cluster Compound Ti2Nb6Cl14O4","Inorganic Chemistry","2000","39","","2185","2188","10.1021/ic9913536","","","0.71073","MoKα","","0.0589","0.0346","","","0.0584","0.0629","","","","","","0.978","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4320954","12.679","0.002","14.567","0.002","12.632","0.003","90","","95.255","0.019","90","","2323.3","0.7","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- Cl13.81 In0.27 Nb6 O4.19 Ti2 -","- Cl13.814 In0.2718 Nb6 O4.186 Ti2 -","- Cl55.256 In1.0872 Nb24 O16.744 Ti8 -","4","0.5","","Ekaterina Anokhina; Michael Essig; Cynthia Day; Abdessadek Lachgar","Structural Studies of Indium and Thallium Insertion into the Framework of the Cluster Compound Ti2Nb6Cl14O4","Inorganic Chemistry","2000","39","","2185","2188","10.1021/ic9913536","","","0.71073","MoKα","","0.0228","0.0181","","","0.0385","0.0395","","","","","","1.199","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320955","19.0412","0.0003","23.654","0.0004","21.5681","0.0003","90","","95.44","","90","","9670.5","0.3","198","2","198","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C68 H76 Cd6 Cl2 N10 O38 -","- C60 H40 Cd6 Cl2 N10 O31.5 -","- C240 H160 Cd24 Cl8 N40 O126 -","4","1","","Owen R. Evans; Wenbin Lin","Pillared, 3D Metal-Organic Frameworks with Rectangular Channels. Synthesis and Characterization of Coordination Polymers Based on Tricadmium Carboxylates","Inorganic Chemistry","2000","39","","2189","2198","10.1021/ic991360u","","","0.71073","MoKα","","0.1438","0.0877","","","0.2151","0.2549","","","","","","1.071","","","","has coordinates,has disorder","179312","2020-10-21","18:00:00",""
"4320956","12.0495","0.0002","12.2773","0.0002","19.1028","0.0004","91.669","0.001","96.85","0.001","117.945","0.001","2466.97","0.08","198","2","198","2","","","","","","","","6","P -1","-P 1","2","","","","- C37 H35 Cd3 Cl N6 O17 -","- C33.5 H20 Cd3 N5 O11.5 -","- C67 H40 Cd6 N10 O23 -","2","1","","Owen R. Evans; Wenbin Lin","Pillared, 3D Metal-Organic Frameworks with Rectangular Channels. Synthesis and Characterization of Coordination Polymers Based on Tricadmium Carboxylates","Inorganic Chemistry","2000","39","","2189","2198","10.1021/ic991360u","","","0.71073","MoKα","","0.1499","0.1079","","","0.2799","0.3078","","","","","","1.835","","","","has coordinates,has disorder","179312","2020-10-21","18:00:00",""
"4320957","19.0382","0.0003","23.8341","0.0004","21.7556","0.0003","90","","97.58","","90","","9785.5","0.3","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C73 H62 Cd6 Cl N12 O30 -","- C69.5 H44 Cd6 Cl N11 O27 -","- C278 H176 Cd24 Cl4 N44 O108 -","4","1","","Owen R. Evans; Wenbin Lin","Pillared, 3D Metal-Organic Frameworks with Rectangular Channels. Synthesis and Characterization of Coordination Polymers Based on Tricadmium Carboxylates","Inorganic Chemistry","2000","39","","2189","2198","10.1021/ic991360u","","","0.71073","MoKα","","0.1031","0.0505","","","0.1563","0.1787","","","","","","1.06","","","","has coordinates,has disorder","179312","2020-10-21","18:00:00",""
"4320958","14.754","0.002","24.886","0.004","15.182","0.002","90","","103.38","0.01","90","","5423","1.4","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","[{1,1,1-tris(diphenylphosphinomethyl)ethane cobalt}(=B5,h3:1-cyclotriphosphorus) (rhenium pentacarbonyl)]tetrafluoroborate","","- C53 H47 B Co F4 O5 P6 Re -","- C52 H45 B Co F4 O5 P6 Re -","- C208 H180 B4 Co4 F16 O20 P24 Re4 -","4","1","","Massimo Di Vaira; Markus P. Ehses; Piero Stoppioni; Maurizio Peruzzini","Cyclotriphosphorus Complexes: Solid-State Structures and Dynamic Behavior of Monoadducts with Carbonyl Fragments","Inorganic Chemistry","2000","39","","2199","2205","10.1021/ic991380w","","","1.54184","CuKα","","0.0704","0.0529","","0.1284","0.1228","","","","0.9","1.084","1.084","","","","","has coordinates,has disorder","179312","2020-10-21","18:00:00",""
"4320959","14.872","0.003","27.317","0.006","16.992","0.004","90","","111.75","0.05","90","","6412","3","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","[{1,1,1-tris(diphenylphosphinomethyl)ethane cobalt}(=B5,h3:1-cyclotriphosphorus) (tungsten tetracarbonyl triphenylphosphine)]","","- C65 H58 Cl4 O4 P7 Rh W -","- C65 H58 Cl4 O4 P7 Rh W -","- C260 H232 Cl16 O16 P28 Rh4 W4 -","4","1","","Massimo Di Vaira; Markus P. Ehses; Piero Stoppioni","Cyclotriphosphorus Complexes: Solid-State Structures and Dynamic Behavior of Monoadducts with Carbonyl Fragments","Inorganic Chemistry","2000","39","","2199","2205","10.1021/ic991380w","","","1.54184","CuKα","","0.0739","0.0526","","0.1295","0.1228","","","","0.92","1.072","1.072","","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320960","13.4865","0.0019","13.6724","0.0012","13.9087","0.0014","80.288","0.008","82.151","0.009","75.677","0.008","2437.2","0.5","183","2","183","2","","","","","","","","7","P -1","-P 1","2","[(CF3)2Bp]Cu(PPh3)2.0.5(hexane)","","","- C49 H41 B Cu F12 N4 P2 -","- C49 H41 B Cu F12 N4 P2 -","- C98 H82 B2 Cu2 F24 N8 P4 -","2","1","","H. V. Rasika Dias; Hui-Ling Lu","Direct Synthesis of a Bis(pyrazolyl)boratocopper(I) Complex: Synthesis and Characterization of [H2B(3,5-(CF3)2Pz)2]Cu(PPh3)2 Displaying an Unusual Coordination Mode for a Poly(pyrazolyl)borate Ligand","Inorganic Chemistry","2000","39","","2246","2248","10.1021/ic991385t","","","0.71073","MoKα","","0.0423","0.0342","","","0.084","0.0884","","","","","","1.053","","","","has coordinates,has disorder","179312","2020-10-21","18:00:00",""
"4320961","16.622","0.003","9.3324","0.0015","15.57","0.003","90","","91.17","0.003","90","","2414.8","0.7","373","2","373","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","imidazolium nonaborate","[C~3~H~5~N~2~]~3~ [B~9~O~12~(OH)~6~","","- C9 H21 B9 N6 O18 -","- C9 H21 B9 N6 O18 -","- C36 H84 B36 N24 O72 -","4","1","","David M. Schubert; Mandana Z. Visi; Carolyn B. Knobler","Guanidinium and Imidazolium Borates Containing the First Examples of an Isolated Nonaborate Oxoanion: [B~9~O~12~(OH)~6~]^3^","Inorganic Chemistry","2000","39","","2250","2251","10.1021/ic000217u","","","0.71073","MoKα","","0.1129","0.05","","","0.0738","0.0873","","","","","","0.819","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320962","16.452","0.007","9.1","0.004","15.266","0.007","90","","95.073","0.013","90","","2276.6","1.7","","","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C3 H24 B9 N9 O18 -","- C3 H24 B9 N9 O18 -","- C12 H96 B36 N36 O72 -","4","0.5","","David M. Schubert; Mandana Z. Visi; Carolyn B. Knobler","Guanidinium and Imidazolium Borates Containing the First Examples of an Isolated Nonaborate Oxoanion: [B~9~O~12~(OH)~6~]^3^","Inorganic Chemistry","2000","39","","2250","2251","10.1021/ic000217u","","","0.71073","MoKα","","0.194","0.0659","","0.1821","0.1235","","","","0.938","1.013","1.013","","","","","has coordinates,has disorder","179312","2020-10-21","18:00:00",""
"4320963","9.483","0.001","14.762","0.003","8.077","0.005","90","","90","","90","","1130.7","0.7","173","1","173","1","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","[Cd0.21Zn0.79(CH2(COO)2)(SC(NH2)2]n","","- C5 H10 Cd0.21 N4 O4 S2 Zn0.79 -","- C5 H10 N4 O4 S2 Zn -","- C20 H40 N16 O16 S8 Zn4 -","4","1","","Yugen Zhang; Jianmin Li; Jinhua Chen; Qibin Su; Wei Deng; Masayoshi Nishiura; Tsuneo Imamoto; Xintao Wu; Quanming Wang","A Novel α-Helix-Liked Metallohelicate Series and Their Structural Adjustments for the Isomorphous Substitution","Inorganic Chemistry","2000","39","","2330","2336","10.1021/ic990911d","","","0.7107","MoKα","","","0.059","","","","0.081","","","","","","1.87","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4320964","8.1405","0.0001","9.6384","0.0002","14.8755","0.0004","90","","90","","90","","1167.15","0.04","293","1","293","1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","[Cd(CH2(COO)2)(SC(NH2)2]n","","- C5 H10 Cd N4 O4 S2 -","- C5 H10 Cd N4 O4 S2 -","- C20 H40 Cd4 N16 O16 S8 -","4","1","","Yugen Zhang; Jianmin Li; Jinhua Chen; Qibin Su; Wei Deng; Masayoshi Nishiura; Tsuneo Imamoto; Xintao Wu; Quanming Wang","A Novel α-Helix-Liked Metallohelicate Series and Their Structural Adjustments for the Isomorphous Substitution","Inorganic Chemistry","2000","39","","2330","2336","10.1021/ic990911d","","","0.7107","MoKα","","0.0154","0.0146","","0.0336","0.0333","","","","","1.05","1.05","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4320965","7.503","0.002","8.199","0.007","18.36","0.01","90","","90.95","0.03","90","","1129.3","1.2","173","1","173","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[Zn(CH2(COO)2)(SC(NH2)2]n","","- C5 H10 N4 O4 S2 Zn -","- C5 H10 N4 O4 S2 Zn -","- C20 H40 N16 O16 S8 Zn4 -","4","1","","Yugen Zhang; Jianmin Li; Jinhua Chen; Qibin Su; Wei Deng; Masayoshi Nishiura; Tsuneo Imamoto; Xintao Wu; Quanming Wang","A Novel α-Helix-Liked Metallohelicate Series and Their Structural Adjustments for the Isomorphous Substitution","Inorganic Chemistry","2000","39","","2330","2336","10.1021/ic990911d","","","0.7107","MoKα","","","0.051","","","","0.077","","","","","","1.73","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4320966","9.629","0.004","14.851","0.003","8.123","0.004","90","","90","","90","","1161.6","0.8","173","1","173","1","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","[Cd0.77Zn0.23(CH2(COO)2)(SC(NH2)2]n","","- C5 H10 Cd0.77 N4 O4 S2 Zn0.23 -","- C5 H10 Cd N4 O4 S2 -","- C20 H40 Cd4 N16 O16 S8 -","4","1","","Yugen Zhang; Jianmin Li; Jinhua Chen; Qibin Su; Wei Deng; Masayoshi Nishiura; Tsuneo Imamoto; Xintao Wu; Quanming Wang","A Novel α-Helix-Liked Metallohelicate Series and Their Structural Adjustments for the Isomorphous Substitution","Inorganic Chemistry","2000","39","","2330","2336","10.1021/ic990911d","","","0.7107","MoKα","","","0.073","","","","0.1","","","","","","1.91","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4320967","9.481","0.002","14.71","0.008","8.076","0.001","90","","90","","90","","1126.3","0.7","173","1","173","1","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","[Cd0.50Zn0.50(CH2(COO)2)(SC(NH2)2]n","","- C5 H10 Cd0.5 N4 O4 S2 Zn0.5 -","- C5 H10 N4 O4 S2 Zn -","- C20 H40 N16 O16 S8 Zn4 -","4","1","","Yugen Zhang; Jianmin Li; Jinhua Chen; Qibin Su; Wei Deng; Masayoshi Nishiura; Tsuneo Imamoto; Xintao Wu; Quanming Wang","A Novel α-Helix-Liked Metallohelicate Series and Their Structural Adjustments for the Isomorphous Substitution","Inorganic Chemistry","2000","39","","2330","2336","10.1021/ic990911d","","","0.7107","MoKα","","","0.082","","","","0.113","","","","","","2.57","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4320968","32.093","0.0007","16.8621","0.0003","19.0706","0.0004","90","","118.93","0.001","90","","9032.3","0.3","173","2","173","2","","","","","","","J. Thorman / Prof. L. K. Woo - ISU","5","C 1 2/c 1","-C 2yc","15","98129c","","","- C57 H46 N4 O1.5 Zr -","- C57 H46 N4 O1.5 Zr -","- C456 H368 N32 O12 Zr8 -","8","1","","Joseph L. Thorman; Ilia A. Guzei; Victor G. Young,; L. Keith Woo","Addition and Metathesis Reactions of Zirconium and Hafnium Imido Complexes","Inorganic Chemistry","2000","39","","2344","2351","10.1021/ic9910007","","","0.71073","MoKα","","0.084","0.0553","","0.1526","0.1348","","","","1.03","1.097","1.097","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4320969","21.8318","0.0008","20.7139","0.0008","15.7878","0.0008","90","","112.624","0.001","90","","6590.2","0.5","173","2","173","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C76.5 H84 N4 O2 Zr -","- C60 H58 N4 O2 Zr -","- C240 H232 N16 O8 Zr4 -","4","1","","Joseph L. Thorman; Ilia A. Guzei; Victor G. Young,; L. Keith Woo","Addition and Metathesis Reactions of Zirconium and Hafnium Imido Complexes","Inorganic Chemistry","2000","39","","2344","2351","10.1021/ic9910007","","","0.71073","MoKα","","0.0828","0.069","","","0.1908","0.2084","","","","","","1.065","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4320970","31.854","0.0016","16.7937","0.0008","18.877","0.0009","90","","117.254","0.001","90","","8977.1","0.8","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C110 H88 N8 O2 Zr2 -","- C96 H72 N8 O2 Zr2 -","- C384 H288 N32 O8 Zr8 -","4","0.5","","Joseph L. Thorman; Ilia A. Guzei; Victor G. Young,; L. Keith Woo","Addition and Metathesis Reactions of Zirconium and Hafnium Imido Complexes","Inorganic Chemistry","2000","39","","2344","2351","10.1021/ic9910007","","","0.71073","MoKα","","0.0848","0.0461","","","0.1068","0.1133","","","","","","1.007","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320971","15.323","0.0004","15.7572","0.0004","17.5494","0.0005","90","","109.657","0.001","90","","3990.33","0.19","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C37 H53 Ca N7 -","- C37 H53 Ca N7 -","- C148 H212 Ca4 N28 -","4","1","","Dirk Pfeiffer; Mary Jane Heeg; Charles H. Winter","Synthesis and Characterization of Calcium Complexes Containing η2-Pyrazolato Ligands","Inorganic Chemistry","2000","39","","2377","2384","10.1021/ic991049c","","","0.71073","MoKα","","0.1702","0.0712","","0.2317","0.187","","","","0.884","1.105","1.105","","","","","has coordinates,has disorder","179312","2020-10-21","18:00:00",""
"4320972","28.4089","0.001","15.4992","0.0004","19.166","0.0006","90","","127.4","0.001","90","","6704.1","0.4","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C28 H54 Ca N6 -","- C28 H54 Ca N6 -","- C224 H432 Ca8 N48 -","8","1","","Dirk Pfeiffer; Mary Jane Heeg; Charles H. Winter","Synthesis and Characterization of Calcium Complexes Containing η2-Pyrazolato Ligands","Inorganic Chemistry","2000","39","","2377","2384","10.1021/ic991049c","","","0.71073","MoKα","","0.1854","0.0736","","0.208","0.1656","","","","0.975","1.204","1.204","","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320973","10.5291","0.0003","19.005","0.0004","18.0605","0.0004","90","","98.885","0.001","90","","3570.64","0.15","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C31 H61 Ca N7 -","- C31 H61 Ca N7 -","- C124 H244 Ca4 N28 -","4","1","","Dirk Pfeiffer; Mary Jane Heeg; Charles H. Winter","Synthesis and Characterization of Calcium Complexes Containing η2-Pyrazolato Ligands","Inorganic Chemistry","2000","39","","2377","2384","10.1021/ic991049c","","","0.71073","MoKα","","0.1185","0.0584","","0.1762","0.1503","","","","0.931","1.103","1.103","","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320974","10.6413","0.0003","11.095","0.0002","30.3077","0.0008","90","","92.779","0.001","90","","3574.08","0.15","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H56 Ca N4 O4 -","- C30 H56 Ca N4 O4 -","- C120 H224 Ca4 N16 O16 -","4","1","","Dirk Pfeiffer; Mary Jane Heeg; Charles H. Winter","Synthesis and Characterization of Calcium Complexes Containing η2-Pyrazolato Ligands","Inorganic Chemistry","2000","39","","2377","2384","10.1021/ic991049c","","","0.71073","MoKα","","0.1268","0.0602","","0.1739","0.147","","","","0.949","1.121","1.121","","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320975","10.4958","0.0004","17.067","0.0006","13.8618","0.0006","90","","105.324","0.001","90","","2394.81","0.16","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C19 H37 Ca N7 -","- C19 H37 Ca N7 -","- C76 H148 Ca4 N28 -","4","1","","Dirk Pfeiffer; Mary Jane Heeg; Charles H. Winter","Synthesis and Characterization of Calcium Complexes Containing η2-Pyrazolato Ligands","Inorganic Chemistry","2000","39","","2377","2384","10.1021/ic991049c","","","0.71073","MoKα","","0.1727","0.0668","","0.1691","0.1329","","","","1","1.202","1.202","","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320976","15.4848","0.0003","13.8186","0.0002","19.0782","0.0001","90","","90","","90","","4082.32","0.1","","","293","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C12 H42 Er2 N12 O21 Pt3 -","- C12 Er2 N12 O21 Pt3 -","- C48 Er8 N48 O84 Pt12 -","4","0.5","","Andreas Loosli; Markus Wermuth; Hans-Ueli Güdel; Silvia Capelli; Jürg Hauser; Hans-Beat Bürgi","Crystal Structure and Optical Spectroscopy of Er~2~[Pt(CN)~4~]~3~.21H~2~O and Er~2~[Pt(CN)~4~]~2~.SO~4~.11.5H~2~O","Inorganic Chemistry","2000","39","","2289","2293","10.1021/ic991137x","","","0.71073","MoKα","","0.049","0.0274","","","0.0593","0.0677","","","","","","1.165","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320977","7.665","","24.7244","0.0001","16.2871","0.0002","90","","95.255","0.001","90","","3073.64","0.04","183","2","183","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C8.57 H17.14 Cl2.57 N4.28 O7.71 Ru0.86 -","- C8.57143 H17.1429 Cl2.57143 N4.28571 O7.71429 Ru0.857143 -","- C60 H120 Cl18 N30 O54 Ru6 -","7","1.75","","D. R. Lang; J. A. Davis; L. G. F. Lopes; A. A. Ferro; L. C. G. Vasconcellos; D. W. Franco; E. Tfouni; A. Wieraszko; M. J. Clarke","A Controlled NO-Releasing Compound: Synthesis, Molecular Structure, Spectroscopy, Electrochemistry, and Chemical Reactivity of R,R,S,S-trans-[RuCl(NO)(cyclam)]2+ (1,4,8,11-tetraazacyclotetradecane)","Inorganic Chemistry","2000","39","","2294","2300","10.1021/ic9912979","","","0.71073","MoKα","","0.0705","0.0575","","0.1518","0.1468","","","","1.211","1.218","1.218","","","","","has coordinates,has disorder","179312","2020-10-21","18:00:00",""
"4320978","14.468","0.002","10.393","0.001","16.479","0.002","90","","90","","90","","2477.9","0.5","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","ASnBu-dimeric","","","- C8 H18 O2 S2 Sn -","- C8 H18 O2 S2 Sn -","- C64 H144 O16 S16 Sn8 -","8","1","","Raymundo Cea-Olivares; L. Adriana Gómez-Ortiz; Verónica García-Montalvo; Rubén L. Gaviño-Ramírez; Simón Hernández-Ortega","Formation of a Novel Trinuclear Spirostannoxane Tin(IV) Compound. Crystal and Molecular Structure of [Sn(nBu)(Cl){(OCH2CH2S)2Sn(nBu)}2] and the Stannolane [(nBu)Sn(SCH2CH2O)SCH2CH2OH]","Inorganic Chemistry","2000","39","","2284","2288","10.1021/ic991318z","","","0.71073","MoKα","","0.0589","0.0393","","0.0972","0.0907","","","","0.91","","","0.91","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4320979","18.492","0.003","17.329","0.002","10.787","0.001","90","","111.88","","90","","3207.7","0.7","293","2","293","2","","","","","","","","6","C 1 c 1","C -2yc","9","ASnCl","","","- C20 H43 Cl O4 S4 Sn3 -","- C20 H43 Cl O4 S4 Sn3 -","- C80 H172 Cl4 O16 S16 Sn12 -","4","1","","Raymundo Cea-Olivares; L. Adriana Gómez-Ortiz; Verónica García-Montalvo; Rubén L. Gaviño-Ramírez; Simón Hernández-Ortega","Formation of a Novel Trinuclear Spirostannoxane Tin(IV) Compound. Crystal and Molecular Structure of [Sn(nBu)(Cl){(OCH2CH2S)2Sn(nBu)}2] and the Stannolane [(nBu)Sn(SCH2CH2O)SCH2CH2OH]","Inorganic Chemistry","2000","39","","2284","2288","10.1021/ic991318z","","","0.71073","MoKα","","0.0436","0.0374","","0.0939","0.0893","","","","1.061","","","1.061","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320980","8.7086","0.0002","28.8382","0.0007","11.9403","0.0003","90","","100.147","0.001","90","","2951.79","0.12","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H24 Cl2 N6 O8 -","- C30 H24 Cl2 N6 O7.65 -","- C120 H96 Cl8 N24 O30.6 -","4","1","","Wai Him Kwok; Huichang Zhang; Pramatha Payra; Maosheng Duan; Shao-ching Hung; Dean H. Johnston; Judith Gallucci; Ewa Skrzypczak-Jankun; Michael K. Chan","Synthesis and Characterization of the Dimethyl-Substituted Bisbenzimidazole Ligand and Its Manganese Complex","Inorganic Chemistry","2000","39","","2367","2376","10.1021/ic991322a","","","0.71073","MoKα","","0.1686","0.0971","","0.2577","0.2156","","","","1.039","1.19","1.19","","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320981","8.1128","0.0003","13.3182","0.0006","14.3727","0.0006","67.527","0.001","87.063","0.001","83.148","0.001","1424.73","0.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H22 Cl2 Mn N6 -","- C30 H22 Cl Mn N6 -","- C60 H44 Cl2 Mn2 N12 -","2","1","","Wai Him Kwok; Huichang Zhang; Pramatha Payra; Maosheng Duan; Shao-ching Hung; Dean H. Johnston; Judith Gallucci; Ewa Skrzypczak-Jankun; Michael K. Chan","Synthesis and Characterization of the Dimethyl-Substituted Bisbenzimidazole Ligand and Its Manganese Complex","Inorganic Chemistry","2000","39","","2367","2376","10.1021/ic991322a","","","0.71073","MoKα","","0.1283","0.0515","","0.1203","0.1007","","","","0.899","1.097","1.097","","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320982","23.267","0.005","11.5457","0.0018","26.192","0.005","90","","114.836","0.01","90","","6385","2","150","2","150","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C22 H30 F12 N4 O2 P2 Ru S3 -","- C22 H30 F12 N4 O2 P2 Ru S3 -","- C176 H240 F96 N32 O16 P16 Ru8 S24 -","8","1","","Sue Roche; Harry Adams; Sharon E. Spey; James A. Thomas","Controlling Substitution Chemistry in Ruthenium(II) Systems. Synthesis of Heteroleptic Complexes Incorporating the [Ru([9]aneS3)]2+ Metal Center","Inorganic Chemistry","2000","39","","2385","2390","10.1021/ic991336g","","","0.71073","MoKα","","0.0512","0.037","","","0.0933","0.1013","","","","","","1.005","","","","has coordinates,has disorder","179312","2020-10-21","18:00:00",""
"4320983","14.748","0.005","18.037","0.007","10.341","0.004","90","","90","","90","","2750.8","1.8","293","2","293","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C15 H23 F12 N3 P2 Ru S3 -","- C15 H23 F12 N3 P2 Ru S3 -","- C60 H92 F48 N12 P8 Ru4 S12 -","4","1","","Sue Roche; Harry Adams; Sharon E. Spey; James A. Thomas","Controlling Substitution Chemistry in Ruthenium(II) Systems. Synthesis of Heteroleptic Complexes Incorporating the [Ru([9]aneS3)]2+ Metal Center","Inorganic Chemistry","2000","39","","2385","2390","10.1021/ic991336g","","","0.71073","MoKα","","0.0564","0.0448","","0.1292","0.1186","","","","1.031","1.064","1.064","","","","","has coordinates,has disorder","179312","2020-10-21","18:00:00",""
"4320984","11.3958","0.0019","11.428","0.0019","11.93","0.002","100.518","0.003","100.542","0.003","112.493","0.003","1355.6","0.4","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C18 H25 F12 N3 P2 Ru S3 -","- C18 H25 F12 N3 P2 Ru S3 -","- C36 H50 F24 N6 P4 Ru2 S6 -","2","1","","Sue Roche; Harry Adams; Sharon E. Spey; James A. Thomas","Controlling Substitution Chemistry in Ruthenium(II) Systems. Synthesis of Heteroleptic Complexes Incorporating the [Ru([9]aneS3)]2+ Metal Center","Inorganic Chemistry","2000","39","","2385","2390","10.1021/ic991336g","","","0.71073","MoKα","","0.0712","0.0523","","","0.1423","0.1536","","","","","","1.016","","","","has coordinates,has disorder","179312","2020-10-21","18:00:00",""
"4320985","4.762","0.001","16.086","0.003","8.698","0.002","90","","90.65","0.03","90","","666.2","0.2","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","Compound1","","- C2 H16 As3 Fe N2 O13 -","- C2 H16 As3 Fe N2 O13 -","- C4 H32 As6 Fe2 N4 O26 -","2","1","","S. Ekambaram; Slavi C. Sevov","Synthesis and Characterization of Four Ethylenediamine-Templated Iron Arsenates","Inorganic Chemistry","2000","39","","2405","2410","10.1021/ic991367b","","","0.71073","MoKα","","0.0283","0.0244","","","0.0533","0.0548","","","","","","1.046","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320986","5.289","0.001","7.573","0.001","8.888","0.002","67.32","0.03","82.77","0.03","69.76","0.03","308.17","0.13","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","Compound2","","- C2 H15 As2 F2 Fe2 N2 O10 -","- C2 H15 As2 F2 Fe2 N2 O10 -","- C2 H15 As2 F2 Fe2 N2 O10 -","1","0.5","","S. Ekambaram; Slavi C. Sevov","Synthesis and Characterization of Four Ethylenediamine-Templated Iron Arsenates","Inorganic Chemistry","2000","39","","2405","2410","10.1021/ic991367b","","","0.71073","MoKα","","0.0382","0.0371","","","0.0976","0.0987","","","","","","1.107","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320987","18.384","0.003","8.785","0.001","16.052","0.002","90","","111.11","0.01","90","","2418.5","0.6","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Compound3","","- C2 H16 As6 Fe3 N4 O24 -","- C2 H16 As6 Fe3 N4 O24 -","- C8 H64 As24 Fe12 N16 O96 -","4","0.5","","S. Ekambaram; Slavi C. Sevov","Synthesis and Characterization of Four Ethylenediamine-Templated Iron Arsenates","Inorganic Chemistry","2000","39","","2405","2410","10.1021/ic991367b","","","0.71073","MoKα","","0.0536","0.0449","","","0.1211","0.1267","","","","","","1.081","","","","has coordinates,has disorder","179312","2020-10-21","18:00:00",""
"4320988","10.49","0.002","10.09","0.002","20.54","0.004","90","","90","","90","","2174","0.7","293","2","293","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","Compound4","","- C2 H12 As2 F2 Fe2 N2 O9 -","- C2 H12 As2 F2 Fe2 N2 O9 -","- C16 H96 As16 F16 Fe16 N16 O72 -","8","1","","S. Ekambaram; Slavi C. Sevov","Synthesis and Characterization of Four Ethylenediamine-Templated Iron Arsenates","Inorganic Chemistry","2000","39","","2405","2410","10.1021/ic991367b","","","0.71073","MoKα","","0.0573","0.0435","","","0.0785","0.0849","","","","","","1.063","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320989","9.943","0.002","13.408","0.003","28.629","0.006","90","","96.3","0.03","90","","3793.6","1.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","m-2,2'-dithioperoxodiphenyl-1kC,2kC-bis[(2,2'-dithioperoxodiphenyl-k2C)phosp hine oxide]","m-2,2'-dithioperoxodiphenyl-1kC,2kC-bis[(2,2'-dithioperoxodiphenyl-k2C)phosp hine oxide]","","- C41 H29 N O2 P2 S6 -","- C41 H29 N O2 P2 S6 -","- C164 H116 N4 O8 P8 S24 -","4","1","","Kerry A. (Fusie) Clark; T. Adrian George; Tom J. Brett; Charles R. Ross; Richard K. Shoemaker","Synthesis, Characterization, Crystal Structures, and Reactions of Trigonal Bipyramidal Tin(IV) Complexes Containing a Tetradentate Tripodal Tristhiolatophosphine Ligand. Use in the One-Step Synthesis of an Iron(IV) Complex","Inorganic Chemistry","2000","39","","2252","2253","10.1021/ic991371n","","","0.71073","MoKα","","0.1011","0.0644","","","0.1553","0.1699","","","","","","1.254","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4320990","10.111","0.002","14.737","0.003","15.342","0.003","112.86","0.03","107.21","0.03","90.75","0.03","1990.8","1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","Phenyl[tris(2-thio-3-trimethylsilylphenyl-k3S)phosphine-kP]tin","Phenyl[tris(2-thio-3-trimethylsilylphenyl-k3S)phosphine-kP]tin","","- C33 H41 P S3 Si3 Sn -","- C33 H41 P S3 Si3 Sn -","- C66 H82 P2 S6 Si6 Sn2 -","2","1","","Kerry A. (Fusie) Clark; T. Adrian George; Tom J. Brett; Charles R. Ross; Richard K. Shoemaker","Synthesis, Characterization, Crystal Structures, and Reactions of Trigonal Bipyramidal Tin(IV) Complexes Containing a Tetradentate Tripodal Tristhiolatophosphine Ligand. Use in the One-Step Synthesis of an Iron(IV) Complex","Inorganic Chemistry","2000","39","","2252","2253","10.1021/ic991371n","","","0.71073","MoKα","","0.0681","0.0556","","","0.1418","0.1533","","","","","","1.127","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320991","10.641","0.002","15.354","0.003","15.384","0.003","90","","91.85","0.03","90","","2512.2","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Phenyl[tris(2-thio-5-methylphenyl-k3S)phosphine-kP]tin","Phenyl[tris(2-thio-5-methylphenyl-k3S)phosphine-kP]tin","","- C27 H23 P S3 Sn -","- C27 H23 P S3 Sn -","- C108 H92 P4 S12 Sn4 -","4","1","","Kerry A. (Fusie) Clark; T. Adrian George; Tom J. Brett; Charles R. Ross; Richard K. Shoemaker","Synthesis, Characterization, Crystal Structures, and Reactions of Trigonal Bipyramidal Tin(IV) Complexes Containing a Tetradentate Tripodal Tristhiolatophosphine Ligand. Use in the One-Step Synthesis of an Iron(IV) Complex","Inorganic Chemistry","2000","39","","2252","2253","10.1021/ic991371n","","","1.54178","CuKα","","0.0454","0.041","","","0.1114","0.1145","","","","","","1.071","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320992","10.041","0.002","12.99","0.003","17.548","0.004","90","","96.94","0.03","90","","2272.1","0.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Phenyl[tris(2-thio-phenyl-k3S)phosphine-kP]tin","Phenyl[tris(2-thio-phenyl-k3S)phosphine-kP]tin","","- C24 H17 P S3 Sn -","- C24 H17 P S3 Sn -","- C96 H68 P4 S12 Sn4 -","4","1","","Kerry A. (Fusie) Clark; T. Adrian George; Tom J. Brett; Charles R. Ross; Richard K. Shoemaker","Synthesis, Characterization, Crystal Structures, and Reactions of Trigonal Bipyramidal Tin(IV) Complexes Containing a Tetradentate Tripodal Tristhiolatophosphine Ligand. Use in the One-Step Synthesis of an Iron(IV) Complex","Inorganic Chemistry","2000","39","","2252","2253","10.1021/ic991371n","","","1.54178","CuKα","","0.0569","0.0386","","","0.0949","0.1021","","","","","","1.016","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320993","8.685","0.002","16.947","0.002","8.458","0.003","90","","90","","90","","1244.9","0.5","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- Al2 K3 O12 P3 -","- Al2 K3 O12 P3 -","- Al8 K12 O48 P12 -","4","1","","R. Nandini Devi; K. Vidyasagar","Solid-State Synthesis and Characterization of Novel Aluminophosphates, A3Al2P3O12 (A = Na, K, Rb, Tl): Influence of A+ Ions on the Coordination of Aluminum","Inorganic Chemistry","2000","39","","2391","2396","10.1021/ic991395u","","","0.71069","MoKα","","0.0261","0.0233","","0.0597","0.0575","","","","1.098","1.089","1.089","","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320994","17.164","0.002","8.627","0.0006","8.814","0.0014","90","","90","","90","","1305.1","0.3","293","2","293","2","","","","","","","","4","C m c 21","C 2c -2","36","","","","- Al2 O12 P3 Rb3 -","- Al2 O12 P3 Rb3 -","- Al8 O48 P12 Rb12 -","4","0.5","","R. Nandini Devi; K. Vidyasagar","Solid-State Synthesis and Characterization of Novel Aluminophosphates, A3Al2P3O12 (A = Na, K, Rb, Tl): Influence of A+ Ions on the Coordination of Aluminum","Inorganic Chemistry","2000","39","","2391","2396","10.1021/ic991395u","","","0.71073","MoKα","","0.0314","0.029","","0.0733","0.0712","","","","1.122","1.118","1.118","","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320995","6.1478","0.0015","10.396","0.003","17.787","0.005","90","","90","","90","","1136.8","0.5","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- Al2 O12 P3 Tl3 -","- Al2 O12 P3 Tl3 -","- Al8 O48 P12 Tl12 -","4","1","","R. Nandini Devi; K. Vidyasagar","Solid-State Synthesis and Characterization of Novel Aluminophosphates, A3Al2P3O12 (A = Na, K, Rb, Tl): Influence of A+ Ions on the Coordination of Aluminum","Inorganic Chemistry","2000","39","","2391","2396","10.1021/ic991395u","","","0.71073","MoKα","","0.0545","0.0275","","0.0684","0.0609","","","","1.172","1.33","1.33","","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320996","7.5088","0.0015","10.242","0.002","15.402","0.003","86.22","0.03","81.85","0.03","81.73","0.03","1159.1","0.4","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H14 Cl1.25 O S12 -","- C15 H14 Cl1.25 O S12 -","- C30 H28 Cl2.5 O2 S24 -","2","1","","Samina Rashid; Scott S. Turner; Peter Day; Mark E. Light; Michael B. Hursthouse","Molecular Charge-Transfer Salt of BEDT-TTF [Bis(ethylenedithio)tetrathiafulvalene] with the Oxalate-Bridged Dimeric Anion [Fe2(C2O4)5]4-","Inorganic Chemistry","2000","39","","2426","2428","10.1021/ic991409w","","","0.71073","MoKα","","0.0598","0.0573","","","0.2584","0.2598","","","","","","2.261","","","","has coordinates,has disorder","198632","2020-10-21","18:00:00",""
"4320997","16.063","0.002","16.063","0.002","8.649","0.002","90","","90","","90","","2231.6","0.6","293","2","293","2","","","","","","","","5","I -4","I -4","82","","","","- C6 H11 N5 O4 Pd -","- C6 H11 N5 O4 Pd -","- C48 H88 N40 O32 Pd8 -","8","1","","Jorge A. R. Navarro; Eva Freisinger; Bernhard Lippert","Self-Assembly of Palladium(II) and Platinum(II) Complexes of 2-Hydroxypyrimidine to Novel Metallacalix[4]arenes. Receptor Properties through Multiple H-Bonding Interactions","Inorganic Chemistry","2000","39","","2301","2305","10.1021/ic991411n","","","0.71073","MoKα","","0.0248","0.0229","","0.0583","0.0572","","","","1.053","1.064","1.064","","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320998","16.053","0.002","16.053","0.002","8.556","0.002","90","","90","","90","","2204.9","0.6","153","2","153","2","","","","","","","","5","I -4","I -4","82","","","","- C6 H11 N5 O4 Pt -","- C6 H11 N5 O4 Pt -","- C48 H88 N40 O32 Pt8 -","8","1","","Jorge A. R. Navarro; Eva Freisinger; Bernhard Lippert","Self-Assembly of Palladium(II) and Platinum(II) Complexes of 2-Hydroxypyrimidine to Novel Metallacalix[4]arenes. Receptor Properties through Multiple H-Bonding Interactions","Inorganic Chemistry","2000","39","","2301","2305","10.1021/ic991411n","","","0.71069","MoKα","","0.0511","0.0297","","0.1723","0.0482","","","","0.962","1.013","1.013","","","","","has coordinates","179312","2020-10-21","18:00:00",""
"4320999","16.693","0.003","15.203","0.003","23.483","0.005","90","","99.5","0.03","90","","5878","2","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C24 H59 Cl5 Cu0.5 N16 O31.5 Pt4 -","- C24 H44 Cl5 Cu0.5 N16 O31.5 Pt4 -","- C96 H176 Cl20 Cu2 N64 O126 Pt16 -","4","1","","Jorge A. R. Navarro; Eva Freisinger; Bernhard Lippert","Self-Assembly of Palladium(II) and Platinum(II) Complexes of 2-Hydroxypyrimidine to Novel Metallacalix[4]arenes. Receptor Properties through Multiple H-Bonding Interactions","Inorganic Chemistry","2000","39","","2301","2305","10.1021/ic991411n","","","0.71069","MoKα","","0.1021","0.0456","","0.1114","0.0972","","","","0.867","1.077","1.077","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4321000","11.5338","0.0002","11.6035","0.0002","12.0914","0.0001","112.663","0.001","107.952","0.001","96.141","0.001","1372.8","0.04","173","2","173","2","","","","","","","V. MacMurdo / Prof. L. Que","6","P -1","-P 1","2","98051","","","- C50 H62 Cl2 Fe2 N12 O10 -","- C50 H62 Cl2 Fe2 N12 O10 -","- C50 H62 Cl2 Fe2 N12 O10 -","1","0.5","","Vicki L. MacMurdo; Hui Zheng; Lawrence Que","Model for the Cofactor Formation Reaction of E. Coli Ribonucleotide Reductase. From a Diiron(II) Precursor to an FeIIIFeIV Species via a Peroxo Intermediate","Inorganic Chemistry","2000","39","","2254","2255","10.1021/ic991482m","","","0.71073","MoKα","","0.0686","0.0475","","0.1113","0.1027","","","","1.029","1.085","1.085","","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321001","17.314","0.004","6.898","0.0014","14.11","0.003","90","","126.94","0.03","90","","1346.9","0.7","120","2","120","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C10 Mn2 O10 -","- C10 Mn2 O10 -","- C40 Mn8 O40 -","4","0.5","","Riccardo Bianchi; Giuliana Gervasio; Domenica Marabello","Experimental Electron Density Analysis of Mn2(CO)10: Metal-Metal and Metal-Ligand Bond Characterization","Inorganic Chemistry","2000","39","","2360","2366","10.1021/ic991316e","","","0.71073","MoKalpha","","","0.0326","","","0.0216","","","","","1.209","1.209","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321002","15.0903","0.0004","15.0903","0.0004","26.1521","0.0007","90","","90","","90","","5955.3","0.3","203","2","","","","","","","","","","6","P 43 21 2","P 4nw 2abw","96","","","","- C59 H53 Cl4 N P4 Re2 -","- C59 H53 Cl4 N P4 Re2 -","- C236 H212 Cl16 N4 P16 Re8 -","4","0.5","","Yan Ding; Shan-Ming Kuang; Michael J. Siwajek; Phillip E. Fanwick; Richard A. Walton","Reactions of the Dirhenium(II) Complexes Re2X4(μ-dppm)2 (X = Cl, Br; dppm = Ph2PCH2PPh2) with Isocyanides. 21.1A Comparison with the Complexes Re2Cl4(μ-dppE)2 and Re2Cl4(μ-dcpm)2 (dppE = Ph2PC(CH2)PPh2; dcpm = Cy2PCH2PCy2) and the Structural Characterization of Complexes of the Types Re2Cl4(μ-LL)2(CNR), Re2Cl4(μ-LL)2(CNR)2, and [Re2Cl3(μ-LL)2(CNR)3]+ (LL = dppm, dppE, dcpm; R =t-Bu, Xyl)","Inorganic Chemistry","2000","39","","2676","2683","10.1021/ic000064a","","","0.71073","MoKα","","","0.0709","","","","0.202","","","","","","1.161","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321003","14.4494","0.0002","34.0915","0.0005","15.5458","0.0002","90","","92.3135","0.0007","90","","7651.65","0.18","193","","193","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C68 H76 Cl10 N2 P4 Re4 -","- C68 H76 Cl10 N2 P4 Re2 -","- C272 H304 Cl40 N8 P16 Re8 -","4","1","","Yan Ding; Shan-Ming Kuang; Michael J. Siwajek; Phillip E. Fanwick; Richard A. Walton","Reactions of the Dirhenium(II) Complexes Re2X4(μ-dppm)2 (X = Cl, Br; dppm = Ph2PCH2PPh2) with Isocyanides. 21.1A Comparison with the Complexes Re2Cl4(μ-dppE)2 and Re2Cl4(μ-dcpm)2 (dppE = Ph2PC(CH2)PPh2; dcpm = Cy2PCH2PCy2) and the Structural Characterization of Complexes of the Types Re2Cl4(μ-LL)2(CNR), Re2Cl4(μ-LL)2(CNR)2, and [Re2Cl3(μ-LL)2(CNR)3]+ (LL = dppm, dppE, dcpm; R =t-Bu, Xyl)","Inorganic Chemistry","2000","39","","2676","2683","10.1021/ic000064a","","","0.71073","MO-Kα","","","0.049","","","","0.145","","","","","","1.05","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321004","12.679","0.003","14.422","0.003","19.997","0.004","97.13","0.03","108.39","0.03","90.07","0.03","3439.8","1.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C67 H71 Cl4 N3 P4 Re2 -","- C67 H71 Cl4 N3 P4 Re2 -","- C134 H142 Cl8 N6 P8 Re4 -","2","1","","Yan Ding; Shan-Ming Kuang; Michael J. Siwajek; Phillip E. Fanwick; Richard A. Walton","Reactions of the Dirhenium(II) Complexes Re2X4(μ-dppm)2 (X = Cl, Br; dppm = Ph2PCH2PPh2) with Isocyanides. 21.1A Comparison with the Complexes Re2Cl4(μ-dppE)2 and Re2Cl4(μ-dcpm)2 (dppE = Ph2PC(CH2)PPh2; dcpm = Cy2PCH2PCy2) and the Structural Characterization of Complexes of the Types Re2Cl4(μ-LL)2(CNR), Re2Cl4(μ-LL)2(CNR)2, and [Re2Cl3(μ-LL)2(CNR)3]+ (LL = dppm, dppE, dcpm; R =t-Bu, Xyl)","Inorganic Chemistry","2000","39","","2676","2683","10.1021/ic000064a","","","0.71073","MoKα","","0.0746","0.0364","","0.107","0.09","","","","1.026","1.115","1.115","","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321005","23.2164","0.0005","12.4916","0.0003","25.393","0.0005","90","","106.042","0.0011","90","","7077.5","0.3","293","","293","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C62 H102 Cl4 N O P4 Re2 -","- C62 H102 Cl4 N O P4 Re2 -","- C248 H408 Cl16 N4 O4 P16 Re8 -","4","1","","Yan Ding; Shan-Ming Kuang; Michael J. Siwajek; Phillip E. Fanwick; Richard A. Walton","Reactions of the Dirhenium(II) Complexes Re2X4(μ-dppm)2 (X = Cl, Br; dppm = Ph2PCH2PPh2) with Isocyanides. 21.1A Comparison with the Complexes Re2Cl4(μ-dppE)2 and Re2Cl4(μ-dcpm)2 (dppE = Ph2PC(CH2)PPh2; dcpm = Cy2PCH2PCy2) and the Structural Characterization of Complexes of the Types Re2Cl4(μ-LL)2(CNR), Re2Cl4(μ-LL)2(CNR)2, and [Re2Cl3(μ-LL)2(CNR)3]+ (LL = dppm, dppE, dcpm; R =t-Bu, Xyl)","Inorganic Chemistry","2000","39","","2676","2683","10.1021/ic000064a","","","0.71073","MO-Kα","","","0.052","","","","0.117","","","","","","1.007","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321006","13.9247","0.0002","15.032","0.0003","16.9804","0.0003","87.033","0.0012","77.0095","0.001","79.2906","0.001","3402.8","0.1","295","","295","","","","","","","","","6","P -1","-P 1","2","","","","- C61 H112 Cl6 N2 P4 Re2 -","- C61 H112 Cl6 N2 P4 Re2 -","- C122 H224 Cl12 N4 P8 Re4 -","2","1","","Yan Ding; Shan-Ming Kuang; Michael J. Siwajek; Phillip E. Fanwick; Richard A. Walton","Reactions of the Dirhenium(II) Complexes Re2X4(μ-dppm)2 (X = Cl, Br; dppm = Ph2PCH2PPh2) with Isocyanides. 21.1A Comparison with the Complexes Re2Cl4(μ-dppE)2 and Re2Cl4(μ-dcpm)2 (dppE = Ph2PC(CH2)PPh2; dcpm = Cy2PCH2PCy2) and the Structural Characterization of Complexes of the Types Re2Cl4(μ-LL)2(CNR), Re2Cl4(μ-LL)2(CNR)2, and [Re2Cl3(μ-LL)2(CNR)3]+ (LL = dppm, dppE, dcpm; R =t-Bu, Xyl)","Inorganic Chemistry","2000","39","","2676","2683","10.1021/ic000064a","","","0.71073","MO-Kα","","","0.026","","","","0.06","","","","","","1.044","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321007","8.055","0.006","11.23","0.01","41.97","0.01","90","","91.63","0.08","90","","3795","5","296.2","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C40 H32 Na Ni4 O8 S40 -","- C40 Na Ni4 O8 S40 -","- C80 Na2 Ni8 O16 S80 -","2","0.5","","Tomoyuki Akutagawa; Tatsuo Hasegawa; Takayoshi Nakamura; Sadamu Takeda; Tamotsu Inabe; Ken-ichi Sugiura; Yoshiteru Sakata; Allan E. Underhill","M+(12-crown-4) Supramolecular Cations (M+= Na+, K+, Rb+, and NH4+) within Ni(2-thioxo-1,3-dithiole-4,5-dithiolate)2 Molecular Conductor","Inorganic Chemistry","2000","39","","2645","2651","10.1021/ic000104a","","","0.7107","MoKα","","","0.0755","","","0.0827","","","","1.902","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321008","8.068","0.006","11.084","0.004","41.711","0.005","90","","92.53","0.04","90","","3726","3","170.2","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C40 H32 Na Ni4 O8 S40 -","- C40 Na Ni4 O8 S40 -","- C80 Na2 Ni8 O16 S80 -","2","0.5","","Tomoyuki Akutagawa; Tatsuo Hasegawa; Takayoshi Nakamura; Sadamu Takeda; Tamotsu Inabe; Ken-ichi Sugiura; Yoshiteru Sakata; Allan E. Underhill","M+(12-crown-4) Supramolecular Cations (M+= Na+, K+, Rb+, and NH4+) within Ni(2-thioxo-1,3-dithiole-4,5-dithiolate)2 Molecular Conductor","Inorganic Chemistry","2000","39","","2645","2651","10.1021/ic000104a","","","0.7107","MoKα","","","0.08","","","0.0799","","","","2.669","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321009","11.42","0.002","41.398","0.006","8.036","0.003","90","","90","","90","","3799.1","1.7","296.2","","","","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C40 H32 K Ni4 O8 S40 -","- C40 K Ni4 O8 S40 -","- C80 K2 Ni8 O16 S80 -","2","0.5","","Tomoyuki Akutagawa; Tatsuo Hasegawa; Takayoshi Nakamura; Sadamu Takeda; Tamotsu Inabe; Ken-ichi Sugiura; Yoshiteru Sakata; Allan E. Underhill","M+(12-crown-4) Supramolecular Cations (M+= Na+, K+, Rb+, and NH4+) within Ni(2-thioxo-1,3-dithiole-4,5-dithiolate)2 Molecular Conductor","Inorganic Chemistry","2000","39","","2645","2651","10.1021/ic000104a","","","0.7107","MoKα","","","0.0426","","","0.0388","","","","1.924","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321010","11.548","0.004","41.604","0.007","7.939","0.006","90","","90","","90","","3814","3","296.2","","","","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C40 H32 Ni4 O8 Rb S40 -","- C40 Ni4 O8 Rb S40 -","- C80 Ni8 O16 Rb2 S80 -","2","0.5","","Tomoyuki Akutagawa; Tatsuo Hasegawa; Takayoshi Nakamura; Sadamu Takeda; Tamotsu Inabe; Ken-ichi Sugiura; Yoshiteru Sakata; Allan E. Underhill","M+(12-crown-4) Supramolecular Cations (M+= Na+, K+, Rb+, and NH4+) within Ni(2-thioxo-1,3-dithiole-4,5-dithiolate)2 Molecular Conductor","Inorganic Chemistry","2000","39","","2645","2651","10.1021/ic000104a","","","0.7107","MoKα","","","0.0789","","","0.0451","","","","1.703","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321011","8.793","0.007","7.537","0.006","43.701","0.005","90","","94.19","0.03","90","","2888","3","296.2","","","","","","","","","","","6","P 1 2/n 1","-P 2yac","13","","","","- C30 H26 N Ni3 O4 S30 -","- C30 N3 Ni3 O4 S30 -","- C60 N6 Ni6 O8 S60 -","2","0.5","","Tomoyuki Akutagawa; Tatsuo Hasegawa; Takayoshi Nakamura; Sadamu Takeda; Tamotsu Inabe; Ken-ichi Sugiura; Yoshiteru Sakata; Allan E. Underhill","M+(12-crown-4) Supramolecular Cations (M+= Na+, K+, Rb+, and NH4+) within Ni(2-thioxo-1,3-dithiole-4,5-dithiolate)2 Molecular Conductor","Inorganic Chemistry","2000","39","","2645","2651","10.1021/ic000104a","","","0.7107","MoKα","","","0.0516","","","0.0567","","","","1.73","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321012","15.016","0.003","9.848","0.003","20.528","0.004","90","","104.854","0.016","90","","2934.2","1.2","298","","298","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C64 H56 P4 Pd2 S4 -","- C64 H56 P4 Pd2 S4 -","- C128 H112 P8 Pd4 S8 -","2","0.5","","Kuang-Hway Yih; Gene-Hsiang Lee; Yu Wang","Synthesis and Structural Characterization of Configurational Isomers of Tungsten-Palladium Complexes with Bridging Diphenyl(dithioalkoxycarbonyl)phosphine as a Ligand and Phosphine Transfer from Tungsten to Palladium","Inorganic Chemistry","2000","39","","2445","2451","10.1021/ic9904438","","","0.71073","MolybdenumKα","","0.054","0.034","","0.039","0.037","","","","","1.57","1.57","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321013","10.92","0.003","14.707","0.005","16.654","0.005","99.98","0.03","93.75","0.03","99.44","0.03","2586.3","1.4","298","","298","","","","","","","","","7","P -1","-P 1","2","","","","- C55 H43 O5 P3 Pd S2 W -","- C55 H43 O5 P3 Pd S2 W -","- C110 H86 O10 P6 Pd2 S4 W2 -","2","1","","Kuang-Hway Yih; Gene-Hsiang Lee; Yu Wang","Synthesis and Structural Characterization of Configurational Isomers of Tungsten-Palladium Complexes with Bridging Diphenyl(dithioalkoxycarbonyl)phosphine as a Ligand and Phosphine Transfer from Tungsten to Palladium","Inorganic Chemistry","2000","39","","2445","2451","10.1021/ic9904438","","","0.7093","MolybdenumKα","","0.069","0.04","","0.044","0.042","","","","","1.68","1.68","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321014","11.125","0.003","14.089","0.004","17.947","0.007","80.13","0.03","80.39","0.03","89.759","0.023","2731.6","1.6","298","","298","","","","","","","","","8","P -1","-P 1","2","","","","- C56 H42 N O5 P3 Pd S2 W -","- C57 H44 N2 O5 P3 Pd S2 W -","- C114 H88 N4 O10 P6 Pd2 S4 W2 -","2","1","","Kuang-Hway Yih; Gene-Hsiang Lee; Yu Wang","Synthesis and Structural Characterization of Configurational Isomers of Tungsten-Palladium Complexes with Bridging Diphenyl(dithioalkoxycarbonyl)phosphine as a Ligand and Phosphine Transfer from Tungsten to Palladium","Inorganic Chemistry","2000","39","","2445","2451","10.1021/ic9904438","","","0.71073","MolybdenumKα","","0.094","0.047","","0.049","0.044","","","","","1.37","1.37","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321015","11.692","0.003","13.602","0.009","18.471","0.01","81.29","0.05","80.88","0.03","88.821","0.01","2867","3","298","","298","","","","","","","","","9","P -1","-P 1","2","","","","- C59 H47 Cl3 N O5 P3 Pd S2 W -","- C61 H53 Cl3 N O5 P3 Pd S2 W -","- C122 H106 Cl6 N2 O10 P6 Pd2 S4 W2 -","2","1","","Kuang-Hway Yih; Gene-Hsiang Lee; Yu Wang","Synthesis and Structural Characterization of Configurational Isomers of Tungsten-Palladium Complexes with Bridging Diphenyl(dithioalkoxycarbonyl)phosphine as a Ligand and Phosphine Transfer from Tungsten to Palladium","Inorganic Chemistry","2000","39","","2445","2451","10.1021/ic9904438","","","0.71073","MolybdenumKα","","0.065","0.038","","0.044","0.041","","","","","1.55","1.55","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321016","12.5463","0.0003","12.4447","0.0003","28.2073","0.0007","90","","96.4862","0.0009","90","","4375.95","0.18","198","2","198","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C38 H57 Cl6 N2 O2 Rh -","- C38 H57 Cl6 N2 O2 Rh -","- C152 H228 Cl24 N8 O8 Rh4 -","4","1","","Renee A. Stinziano-Eveland; SonBinh T. Nguyen; Louise M. Liable-Sands; Arnold L. Rheingold","Synthesis and Characterization of Rhodium(III) Dichloro Complexes with Unsymmetrically Bound Salen-Type Ligands","Inorganic Chemistry","2000","39","","2452","2455","10.1021/ic990548a","","","0.71073","MoKα","","0.0956","0.0587","","0.1377","0.1213","","","","1.29","1.403","1.403","","","","","has coordinates,has disorder","179313","2020-10-21","18:00:00",""
"4321017","7.3655","0.0015","10.441","0.002","9.398","0.002","90","","93.32","0.03","90","","721.5","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- F8 O2 Sb Tc -","- F8 O2 Sb Tc -","- F32 O8 Sb4 Tc4 -","4","1","","Nicolas LeBlond; David A. Dixon; Gary J. Schrobilgen","Fluoride Ion Donor Properties of TcO2F3 and ReO2F3: X-ray Crystal Structures of MO2F3.SbF5 (M = Tc, Re) and TcO2F3.XeO2F2 and Raman and NMR Spectroscopic Characterization of MO2F3.PnF5 (Pn = As, Sb), [ReO2F2(CH3CN)2][SbF6], and [Re2O4F5][Sb2F11]","Inorganic Chemistry","2000","39","","2473","2487","10.1021/ic9908221","","","0.56086","AgKα","","0.0676","0.045","","0.1112","0.1047","","","","0.911","1.041","1.041","","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321018","5.4794","0.0011","10.039","0.002","12.426","0.003","90","","99.01","0.03","90","","675.1","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- F8 O2 Re Sb -","- F8 O2 Re Sb -","- F32 O8 Re4 Sb4 -","4","1","","Nicolas LeBlond; David A. Dixon; Gary J. Schrobilgen","Fluoride Ion Donor Properties of TcO2F3 and ReO2F3: X-ray Crystal Structures of MO2F3.SbF5 (M = Tc, Re) and TcO2F3.XeO2F2 and Raman and NMR Spectroscopic Characterization of MO2F3.PnF5 (Pn = As, Sb), [ReO2F2(CH3CN)2][SbF6], and [Re2O4F5][Sb2F11]","Inorganic Chemistry","2000","39","","2473","2487","10.1021/ic9908221","","","0.56086","AgKα","","0.0553","0.0443","","","0.113","","","","1.253","1.351","1.351","","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321019","7.895","0.002","16.204","0.003","5.1982","0.001","90","","90","","90","","665","0.2","293","2","293","2","","","","","","","","4","C m c 21","C 2c -2","36","","","","- F5 O4 Tc Xe -","- F5 O4 Tc Xe -","- F20 O16 Tc4 Xe4 -","4","0.5","","Nicolas LeBlond; David A. Dixon; Gary J. Schrobilgen","Fluoride Ion Donor Properties of TcO2F3 and ReO2F3: X-ray Crystal Structures of MO2F3.SbF5 (M = Tc, Re) and TcO2F3.XeO2F2 and Raman and NMR Spectroscopic Characterization of MO2F3.PnF5 (Pn = As, Sb), [ReO2F2(CH3CN)2][SbF6], and [Re2O4F5][Sb2F11]","Inorganic Chemistry","2000","39","","2473","2487","10.1021/ic9908221","","","0.56086","AgKα","","0.0422","0.0351","","0.0822","0.0807","","","","1.013","1.067","1.067","","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321020","12.5802","0.0009","12.5802","0.0009","24.285","0.004","90","","90","","120","","3328.5","0.6","291","2","291","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C24 H85 Cl2 Cu6 N6 O60 Tb -","- C24 H30 Cl2 Cu6 N6 O60 Tb -","- C48 H60 Cl4 Cu12 N12 O120 Tb2 -","2","0.166667","","Qin-De Liu; Song Gao; Jun-Ran Li; Qing-Zhong Zhou; Kai-Bei Yu; Bao-Qing Ma; Shi-Wei Zhang; Xi-Xiang Zhang; Tian-Zhu Jin","Structures and Magnetism of Two Novel Heptanuclear Lanthanide-Centered Trigonal Prismatic Clusters: [LnCu6(μ3-OH)3(HL)2(L)4](ClO4)2.25H2O (Ln = La, Tb; H2L = Iminodiacetic Acid)","Inorganic Chemistry","2000","39","","2488","2492","10.1021/ic990860k","","","0.71073","MoKα","","0.0618","0.0495","","","0.1374","0.1432","","","","","","1.05","","","","has coordinates,has disorder","179313","2020-10-21","18:00:00",""
"4321021","12.6425","0.0014","12.6425","0.0014","24.541","0.005","90","","90","","120","","3396.9","0.9","291","2","291","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C24 H85 Cl2 Cu6 La N6 O60 -","- C24 H30 Cl2 Cu6 La N6 O60 -","- C48 H60 Cl4 Cu12 La2 N12 O120 -","2","0.166667","","Qin-De Liu; Song Gao; Jun-Ran Li; Qing-Zhong Zhou; Kai-Bei Yu; Bao-Qing Ma; Shi-Wei Zhang; Xi-Xiang Zhang; Tian-Zhu Jin","Structures and Magnetism of Two Novel Heptanuclear Lanthanide-Centered Trigonal Prismatic Clusters: [LnCu6(μ3-OH)3(HL)2(L)4](ClO4)2.25H2O (Ln = La, Tb; H2L = Iminodiacetic Acid)","Inorganic Chemistry","2000","39","","2488","2492","10.1021/ic990860k","","","0.71073","MoKα","","0.0613","0.0497","","","0.1374","0.1431","","","","","","1.061","","","","has coordinates,has disorder","179313","2020-10-21","18:00:00",""
"4321022","8.205","0.002","8.945","0.004","16.714","0.006","90","","94.22","0.02","90","","1223.4","0.8","173","2","173","2","","","","","","","grotjahn lab/SDSU","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H30 Cl2 Ir2 O4 -","- C22 H30 Cl2 Ir2 O4 -","- C44 H60 Cl4 Ir4 O8 -","2","0.5","","Douglas B. Grotjahn; H. Christine Lo; Jason Dinoso; Charles D. Adkins; Chunbang Li; Steven P. Nolan; John L. Hubbard","Studies of the Synthesis and Thermochemistry of Coordinatively Unsaturated Chelate Complexes (η5-C5Me5)IrL2 (L2= TsNCH2CH2NTs, TsNCH2CO2, CO2CO2)","Inorganic Chemistry","2000","39","","2493","2499","10.1021/ic990870l","","","0.71073","MoKα","","0.0365","0.0258","","0.0966","0.0811","","","","0.783","0.716","0.716","","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321023","18.2566","0.0002","18.2566","0.0002","15.9244","0.0002","90","0.0008","90","0.0005","120","0.0001","4596.57","0.09","296.2","","213.2","","","","","","","","","5","P 31","P 31","144","","","","- C58 H74.5 N4 Ni O4.25 -","- C58 H74.5 N4 Ni O4.25 -","- C174 H223.5 N12 Ni3 O12.75 -","3","1","","Zengmin Li; Chet Jablonski","Synthesis, Characterization, and Structure of Macrocyclic Mono- and C2-Symmetric, Binuclear Nickel Calixsalen Complexes","Inorganic Chemistry","2000","39","","2456","2461","10.1021/ic990935k","","","0.7107","MoKα","","0.1008","0.054","","0.057","","0.049","","","1.027","","","1.17","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321024","10.366","0.004","12.17","0.003","10.021","0.002","106.29","0.02","91","","68","","1119.6","0.6","299.2","","299.2","","","","","","","","","6","P 1","P 1","1","","","","- C46 H48 Cl4 N4 Ni2 O8 -","- C46 H48 Cl4 N4 Ni2 O8 -","- C46 H48 Cl4 N4 Ni2 O8 -","1","1","","Zengmin Li; Chet Jablonski","Synthesis, Characterization, and Structure of Macrocyclic Mono- and C2-Symmetric, Binuclear Nickel Calixsalen Complexes","Inorganic Chemistry","2000","39","","2456","2461","10.1021/ic990935k","","","0.7107","MoKα","","0.1092","0.052","","0.058","","0.053","","","1.74","","","1.94","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321025","19.531","0.002","22.819","0.003","13.373","0.001","90","","90","","90","","5960.1","1.1","299.2","","299.2","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C60.7 H83.4 Cl1.4 N5 Ni2 O4 -","- C60.7 H83.4 Cl1.4 N5 Ni2 O4 -","- C242.8 H333.6 Cl5.6 N20 Ni8 O16 -","4","1","","Zengmin Li; Chet Jablonski","Synthesis, Characterization, and Structure of Macrocyclic Mono- and C2-Symmetric, Binuclear Nickel Calixsalen Complexes","Inorganic Chemistry","2000","39","","2456","2461","10.1021/ic990935k","","","1.5418","CuKα","","0.108","0.067","","0.067","","0.065","","","3.144","","","3.6","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321026","9.087","0.002","14.019","0.004","11.68","0.002","90","","108.324","0.01","90","","1412.5","0.6","203","2","203","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H18 B Cl O -","- C16 H18 B Cl O -","- C64 H72 B4 Cl4 O4 -","4","1","","Wendy I. Cross; Matthew P. Lightfoot; Francis S. Mair; Robin G. Pritchard","Crystal Structure of the Molecular Addition Compound Diphenylchloroborane.Tetrahydrofuran","Inorganic Chemistry","2000","39","","2690","2692","10.1021/ic991148q","","","0.71073","MoKα","","0.0386","0.0301","","","0.077","0.0821","","","","","","1.053","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321027","9.915","0.001","9.915","0.001","14.715","0.002","90","","90","","90","","1446.6","0.3","298","","293","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","","","- C13 H12 Cu N6 O3 -","- C13 H9 Cu N6 O3 -","- C52 H36 Cu4 N24 O12 -","4","0.5","","Vassilis Tangoulis; Catherine P. Raptopoulou; Vassilis Psycharis; Aris Terzis; Konstantina Skorda; Spyros P. Perlepes; Olivier Cador; Olivier Kahn; Evangelos G. Bakalbassis","Ferromagnetism in an Extended Three-Dimensional, Diamond-like Copper(II) Network: A New Copper(II)/1-Hydroxybenzotriazolato Complex Exhibiting Soft-Magnet Properties and Two Transitions at 6.4 and 4.4 K","Inorganic Chemistry","2000","39","","2522","2529","10.1021/ic991149i","","","0.7107","MoKα","","0.0288","0.0232","","0.0706","0.0634","","","","0.895","0.848","0.848","","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321028","10.661","0.007","16.964","0.005","12.405","0.004","90","","93.22","0.04","90","","2239.9","1.8","170","1","170","1","","","","","","","synthesized by authors","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H37 Li3 N4 O Si -","- C16 H37 Li3 N4 O Si -","- C64 H148 Li12 N16 O4 Si4 -","4","1","","Justin K. Brask; Tristram Chivers; Masood Parvez","Polylithiated Tetraaminosilanes: Synthesis and Characterization of (Et2O.Li)4[Si(Nnaph)4] and X-ray Structure of {THF.Li3[Si(NiPr)3(NHiPr)]}2","Inorganic Chemistry","2000","39","","2505","2508","10.1021/ic991238v","","","0.7107","MoKα","","0.0614","0.0614","","0.0611","0.0611","","","","2.319","2.319","2.319","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321029","10.542","0.001","13.632","0.001","30.362","0.001","90","","94.101","0.002","90","","4352.1","0.5","150","","150","","","","","","","","?","7","P 1 21/c 1","-P 2ybc","14","","","","- C43 H37 Cl6 N O P2 U -","- C43 H37 Cl6 N O P2 U -","- C172 H148 Cl24 N4 O4 P8 U4 -","4","1","","Vaughan Clifford Williams; Matthias Müller; Michael A. Leech; Robert G. Denning; Malcolm L. H. Green","Uranium(VI) Sulfilimine Complexes: A New Class of Nitrogen Analogues of the Uranyl Ion","Inorganic Chemistry","2000","39","","2538","2541","10.1021/ic991294w","","","0.71069","MoKα","","","0.0253","","","0.031","","","","","1.0912","1.0912","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4321030","9.182","0.002","11.283","0.003","11.437","0.003","76.72","0.02","78.84","0.02","81.02","0.02","1123.6","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C23 H40 Cl N P Ti -","- C20 H35 Cl N P Ti -","- C40 H70 Cl2 N2 P2 Ti2 -","2","1","","Raymond C. W. Sung; Silke Courtenay; Bruce R. McGarvey; Douglas W. Stephan","Synthesis, Structure, and Single-Crystal EPR Study of [Cp(t-Bu3PN)Ti(μ-Cl)]2","Inorganic Chemistry","2000","39","","2542","2546","10.1021/ic991305l","","","0.71073","MoKα","","0.0625","0.0438","","0.1403","0.122","","","","0.936","0.957","0.957","","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321031","13.695","0.002","11.202","0.002","14.163","0.003","90","","92.35","0.02","90","","2170.9","0.7","297","","297","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C13 H23 Cu F3 O4 S Se4 -","- C13 H23 Cu F3 O4.001 S Se4 -","- C52 H92 Cu4 F12 O16.004 S4 Se16 -","4","1","","Raymond J. Batchelor; Frederick W. B. Einstein; Ian D. Gay; Jian-Hua Gu; Seema Mehta; B. Mario Pinto; Xue-Min Zhou","Synthesis, Characterization, and Redox Behavior of New Selenium Coronands and of Copper(I) and Copper(II) Complexes of Selenium Coronands","Inorganic Chemistry","2000","39","","2558","2571","10.1021/ic991345p","","","0.7093","MolybdenumKα","","","0.035","","","0.036","","","","","","","","","","","has coordinates","192276","2020-10-21","18:00:00",""
"4321032","9.645","0.003","12.679","0.006","15.332","0.004","90","","90","","90","","1874.9","1.2","190","","190","","","","","","","","","3","P c a 21","P 2c -2ac","29","","","","- C18 H20 Se4 -","- C18 H20 Se4 -","- C72 H80 Se16 -","4","1","","Raymond J. Batchelor; Frederick W. B. Einstein; Ian D. Gay; Jian-Hua Gu; Seema Mehta; B. Mario Pinto; Xue-Min Zhou","Synthesis, Characterization, and Redox Behavior of New Selenium Coronands and of Copper(I) and Copper(II) Complexes of Selenium Coronands","Inorganic Chemistry","2000","39","","2558","2571","10.1021/ic991345p","","","0.7093","MolybdenumKα","","","0.027","","","","","","","","1.25","1.25","","","","","has coordinates","192276","2020-10-21","18:00:00",""
"4321033","14.943","0.004","5.638","0.002","14.229","0.003","90","","90","","90","","1198.8","0.6","190","","190","","","","","","","","","3","P n 21 a","P -2ac -2n","33","","","","- C9 H18 Se3 -","- C9 H18 Se3 -","- C36 H72 Se12 -","4","1","","Raymond J. Batchelor; Frederick W. B. Einstein; Ian D. Gay; Jian-Hua Gu; Seema Mehta; B. Mario Pinto; Xue-Min Zhou","Synthesis, Characterization, and Redox Behavior of New Selenium Coronands and of Copper(I) and Copper(II) Complexes of Selenium Coronands","Inorganic Chemistry","2000","39","","2558","2571","10.1021/ic991345p","","","0.7093","MolybdenumKα","","","0.026","","","0.027","","","","","1.38","1.38","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321034","24.202","0.009","18.005","0.007","16.235","0.005","90","","138.23","0.03","90","","4713","4","200","","200","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C12 H24 S2 Se2 -","- C12 H24 S2 Se2 -","- C144 H288 S24 Se24 -","12","1.5","","Raymond J. Batchelor; Frederick W. B. Einstein; Ian D. Gay; Jian-Hua Gu; Seema Mehta; B. Mario Pinto; Xue-Min Zhou","Synthesis, Characterization, and Redox Behavior of New Selenium Coronands and of Copper(I) and Copper(II) Complexes of Selenium Coronands","Inorganic Chemistry","2000","39","","2558","2571","10.1021/ic991345p","","","0.7093","MolybdenumKα","","","0.052","","","0.062","","","","","","","","","","","has coordinates","192276","2020-10-21","18:00:00",""
"4321035","8.882","0.002","10.874","0.002","13.36","0.002","90","","97.95","0.02","90","","1277.9","0.4","297","","297","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C14 H24 Cu F6 O6 S4 Se2 -","- C14 H24 Cu F6 O6 S4 Se2 -","- C28 H48 Cu2 F12 O12 S8 Se4 -","2","0.5","","Raymond J. Batchelor; Frederick W. B. Einstein; Ian D. Gay; Jian-Hua Gu; Seema Mehta; B. Mario Pinto; Xue-Min Zhou","Synthesis, Characterization, and Redox Behavior of New Selenium Coronands and of Copper(I) and Copper(II) Complexes of Selenium Coronands","Inorganic Chemistry","2000","39","","2558","2571","10.1021/ic991345p","","","0.7093","MolybdenumKα","","","0.028","","","0.032","","","","","1.38","1.38","","","","","has coordinates","192276","2020-10-21","18:00:00",""
"4321036","8.412","0.005","20.924","0.005","15.021","0.005","90","","100.82","0.04","90","","2596.9","1.9","190","","190","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C14 H22 Cu F6 O8 S2 Se4 -","- C14 H22 Cu F6 O8 S2 Se4 -","- C56 H88 Cu4 F24 O32 S8 Se16 -","4","1","","Raymond J. Batchelor; Frederick W. B. Einstein; Ian D. Gay; Jian-Hua Gu; Seema Mehta; B. Mario Pinto; Xue-Min Zhou","Synthesis, Characterization, and Redox Behavior of New Selenium Coronands and of Copper(I) and Copper(II) Complexes of Selenium Coronands","Inorganic Chemistry","2000","39","","2558","2571","10.1021/ic991345p","","","0.7093","MolybdenumKα","","","0.059","","","0.061","","","","","","","","","","","has coordinates","192276","2020-10-21","18:00:00",""
"4321037","6.875","0.002","10.945","0.002","17.496","0.002","90","","96.76","0.02","90","","1307.4","0.5","195","","195","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C14 H24 Cu F6 O8 S2 Se4 -","- C14 H24 Cu F6 O8 S2 Se4 -","- C28 H48 Cu2 F12 O16 S4 Se8 -","2","0.5","","Raymond J. Batchelor; Frederick W. B. Einstein; Ian D. Gay; Jian-Hua Gu; Seema Mehta; B. Mario Pinto; Xue-Min Zhou","Synthesis, Characterization, and Redox Behavior of New Selenium Coronands and of Copper(I) and Copper(II) Complexes of Selenium Coronands","Inorganic Chemistry","2000","39","","2558","2571","10.1021/ic991345p","","","0.7093","MolybdenumKα","","","0.023","","","0.025","","","","","1.17","1.17","","","","","has coordinates","192276","2020-10-21","18:00:00",""
"4321038","10.512","0.003","10.674","0.002","10.682","0.003","101.47","0.02","116.82","0.02","93.59","0.02","1032.3","0.5","205","","205","","","","","","","","","7","P -1","-P 1","2","","","","- C13 H24 Cu F3 O3 S3 Se2 -","- C13 H24 Cu F3 O3 S3 Se2 -","- C26 H48 Cu2 F6 O6 S6 Se4 -","2","1","","Raymond J. Batchelor; Frederick W. B. Einstein; Ian D. Gay; Jian-Hua Gu; Seema Mehta; B. Mario Pinto; Xue-Min Zhou","Synthesis, Characterization, and Redox Behavior of New Selenium Coronands and of Copper(I) and Copper(II) Complexes of Selenium Coronands","Inorganic Chemistry","2000","39","","2558","2571","10.1021/ic991345p","","","0.7093","MolybdenumKα","","","0.029","","","0.037","","","","","1.5","1.5","","","","","has coordinates","192276","2020-10-21","18:00:00",""
"4321039","10.569","0.002","7.331","0.004","12.9072","0.0008","90","","111.324","0.01","90","","931.6","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C4 H12 N8 Ni -","- C4 H12 N8 Ni -","- C16 H48 N32 Ni4 -","4","1","","Montserrat Monfort; Immaculada Resino; Joan Ribas; Xavier Solans; Merce Font-Bardia; Pierre Rabu; Marc Drillon","Synthesis, Structure, and Magnetic Properties of Two New Ferromagnetic/Antiferromagnetic One-Dimensional Nickel(II) Complexes. Magnetostructural Correlations","Inorganic Chemistry","2000","39","","2572","2576","10.1021/ic991366j","","","0.71069","MoKα","","0.0435","0.0335","","0.0971","0.0849","","","","1.05","1.079","1.079","","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321040","12.299","0.005","14.3075","0.0015","12.604","0.003","90","","106.72","0.02","90","","2124.1","1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H20 N16 Ni2 -","- C14 H20 N16 Ni2 -","- C56 H80 N64 Ni8 -","4","1","","Montserrat Monfort; Immaculada Resino; Joan Ribas; Xavier Solans; Merce Font-Bardia; Pierre Rabu; Marc Drillon","Synthesis, Structure, and Magnetic Properties of Two New Ferromagnetic/Antiferromagnetic One-Dimensional Nickel(II) Complexes. Magnetostructural Correlations","Inorganic Chemistry","2000","39","","2572","2576","10.1021/ic991366j","","","0.71069","MoKα","","0.0719","0.0317","","0.15","0.0936","","","","0.638","0.532","0.532","","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321041","10.4935","0.0006","10.4935","0.0006","14.6146","0.001","90","","90","","90","","1609.27","0.17","296","2","296","2","","","","","","","synthesized","5","I 4 2 2","I 4 2","97","","[tetrakis(1,3,4,6,7,8-hexahydro-2H-pyrimido[1,2-a] pyrimidinate)diplatinum(III)]dichloride","","- C28 H48 Cl2 N12 Pt2 -","- C28 H48 Cl2 N12 Pt2 -","- C56 H96 Cl4 N24 Pt4 -","2","0.125","","Rodolphe Clérac; F. Albert Cotton; Lee M. Daniels; James P. Donahue; Carlos A. Murillo; Daren J. Timmons","Completion of the Series of M2(hpp)4Cl2 Compounds from W to Pt: The W, Os, and Pt Compounds","Inorganic Chemistry","2000","39","","2581","2584","10.1021/ic991370v","","","0.71073","MoKα","","0.0625","0.0457","","0.1177","0.1081","","","","1.101","1.163","1.163","","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321042","9.949","0.002","9.949","0.002","15.841","0.002","90","","90","","90","","1568","0.5","213","2","213","2","","","","","","","synthesized","5","I 4/m","-I 4","87","","[tetrakis(1,3,4,6,7,8-hexahydro-2H-pyrimido[1,2-a] pyrimidinate)ditungsten(III)]dichloride","","- C28 H48 Cl2 N12 W2 -","- C28 H48 Cl2 N12 W2 -","- C56 H96 Cl4 N24 W4 -","2","0.125","","Rodolphe Clérac; F. Albert Cotton; Lee M. Daniels; James P. Donahue; Carlos A. Murillo; Daren J. Timmons","Completion of the Series of M2(hpp)4Cl2 Compounds from W to Pt: The W, Os, and Pt Compounds","Inorganic Chemistry","2000","39","","2581","2584","10.1021/ic991370v","","","0.71073","MoKα","","0.0567","0.0529","","0.1139","0.1118","","","","1.277","1.282","1.282","","","","","has coordinates,has disorder","179313","2020-10-21","18:00:00",""
"4321043","13.715","0.003","13.715","0.003","12.174","0.003","90","","90","","90","","2289.9","0.9","213","2","213","2","","","","","","","synthesized","5","I 4/m m m","-I 4 2","139","","[tetrakis(1,3,4,6,7,8-hexahydro-2H-pyrimido[1,2-a] pyrimidinate)diosmium(III)]dichloride","","- C32 H56 Cl10 N12 Os2 -","- C32 H56 Cl10 N12 Os2 -","- C64 H112 Cl20 N24 Os4 -","2","0.0625","","Rodolphe Clérac; F. Albert Cotton; Lee M. Daniels; James P. Donahue; Carlos A. Murillo; Daren J. Timmons","Completion of the Series of M2(hpp)4Cl2 Compounds from W to Pt: The W, Os, and Pt Compounds","Inorganic Chemistry","2000","39","","2581","2584","10.1021/ic991370v","","","0.71073","MoKα","","0.0315","0.0284","","0.06","0.0569","","","","1.311","1.328","1.328","","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321044","13.149","0.004","6.501","0.004","19.421","0.005","90","","93.37","0.03","90","","1657.3","1.2","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H25 B8 Fe N -","- C12 H25 B8 Fe N -","- C48 H100 B32 Fe4 N4 -","4","1","","Bohumír Grüner; Ari Lehtonen; Raikko Kivekäs; Reijo Sillanpää; Josef Holub; Francesc Teixidor; Clara Viñas; Bohumil Štíbr","Unusual 9 →10 Rearrangement of the Substituted Cage Carbon in the Ferratricarbollide Series. Synthesis of the Isomeric Complexes [2-ν^5^-(C~5~H~5~)-10-X-closo-2,1,7,10-FeC~3~B~8~H~10~] (where X = H~2~N, MeHN, Me~2~N and Bu^t^HN)","Inorganic Chemistry","2000","39","","2577","2580","10.1021/ic991375s","","","0.71069","MoKα","","0.0552","0.0471","","","0.1181","0.1229","","","","","","1.042","","","","has coordinates,has disorder","179313","2020-10-21","18:00:00",""
"4321045","21.573","0.004","17.224","0.003","17.577","0.004","90","","97.29","0.03","90","","6478","2","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C68 H75 S9 Ti2 -","- C68 H75 S9 Ti2 -","- C272 H300 S36 Ti8 -","4","1","","Claire J. Carmalt; Christopher W. Dinnage; Ivan P. Parkin; Jonathan W. Steed","Synthesis and Characterization of a Homoleptic Thiolate Complex of Titanium(IV)","Inorganic Chemistry","2000","39","","2693","2695","10.1021/ic991382g","","","0.7107","MoKα","","0.0834","0.0521","","","0.1162","0.1303","","","","","","1.037","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321046","9.2823","0.0008","6.0429","0.0005","11.1612","0.0009","90","","116.498","0.006","90","","560.29","0.09","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Calcium Germanium Nitride","","- Ca4 Ge N4 -","- Ca4 Ge N4 -","- Ca16 Ge4 N16 -","4","1","","S. J. Clarke; F. J. DiSalvo","New Calcium Germanium Nitrides: Ca2GeN2, Ca4GeN4, and Ca5Ge2N6","Inorganic Chemistry","2000","39","","2631","2634","10.1021/ic991427d","","","0.71073","MoKα","","0.0351","0.0302","","0.0748","0.0726","","","","1.091","1.126","1.126","","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321047","11.2004","0.0008","11.2004","0.0008","5.0482","0.0006","90","","90","","90","","633.29","0.1","293","2","293","2","","","","","","","","3","P 42/m b c","-P 4c 2ab","135","","Calcium germanium nitride","","- Ca2 Ge N2 -","- Ca2 Ge N2 -","- Ca16 Ge8 N16 -","8","0.5","","S. J. Clarke; F. J. DiSalvo","New Calcium Germanium Nitrides: Ca2GeN2, Ca4GeN4, and Ca5Ge2N6","Inorganic Chemistry","2000","39","","2631","2634","10.1021/ic991427d","","","0.71073","MoKα","","0.0201","0.0165","","0.0362","0.0353","","","","1.108","1.139","1.139","","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321048","10.367","0.006","11.369","0.006","13.967","0.008","112.56","0.01","93.42","0.02","115.43","0.01","1322.3","1.3","298","","298","","","","","","","","","5","P -1","-P 1","2","","","","- C54 H52 Mn3 N4 O18 -","- C54 H49.42 Mn3 N4 O18 -","- C54 H49.42 Mn3 N4 O18 -","1","0.5","","Vasilis Tangoulis; Dora A. Malamatari; Georgios A. Spyroulias; Catherine P. Raptopoulou; Aris Terzis; Dimitris P. Kessissoglou","An EPR and1H NMR Active Mixed-Valence Manganese (III/II/III) Trinuclear Compound","Inorganic Chemistry","2000","39","","2621","2630","10.1021/ic991430x","","","0.71073","MoKα","","0.0358","0.0302","","0.0879","0.0829","","","","1.072","1.096","1.096","","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321049","10.6845","0.0006","18.5573","0.0011","24.4075","0.0014","90","","91.616","0.002","90","","4837.5","0.5","160","2","160","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C47 H65 B2 N12 O Sm -","- C47 H65 B2 N12 O Sm -","- C188 H260 B8 N48 O4 Sm4 -","4","1","","Anna C. Hillier; Sung-Ying Liu; Andrea Sella; Mark R. J. Elsegood","Lanthanide Chalcogenolate Complexes: Synthesis and Crystal Structures of the Isoleptic Series [Sm(TpMe,Me)2ER] (E = O, S, Se, Te; TpMe,Me=tris-3,5-Dimethylpyrazolylborate)","Inorganic Chemistry","2000","39","","2635","2644","10.1021/ic9914793","","","0.71073","MoKα","","0.0468","0.0323","","","0.0625","0.0686","","","","","","1.134","","","","has coordinates,has disorder","179313","2020-10-21","18:00:00",""
"4321050","15.0154","0.0009","13.1853","0.0008","21.1254","0.0013","90","","108.628","0.002","90","","3963.4","0.4","160","2","160","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C37 H51 B2 N12 S Sm -","- C37 H51 B2 N12 S Sm -","- C148 H204 B8 N48 S4 Sm4 -","4","1","","Anna C. Hillier; Sung-Ying Liu; Andrea Sella; Mark R. J. Elsegood","Lanthanide Chalcogenolate Complexes: Synthesis and Crystal Structures of the Isoleptic Series [Sm(TpMe,Me)2ER] (E = O, S, Se, Te; TpMe,Me=tris-3,5-Dimethylpyrazolylborate)","Inorganic Chemistry","2000","39","","2635","2644","10.1021/ic9914793","","","0.71073","MoKα","","0.0644","0.035","","","0.0687","0.0769","","","","","","0.99","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321051","10.7819","0.0006","19.3011","0.001","23.0235","0.0012","79.443","0.002","77.428","0.002","89.827","0.002","4593.8","0.4","160","2","160","2","","","","","","","","6","P -1","-P 1","2","","","","- C43 H57 B2 N12 Se Sm -","- C43 H53.5 B2 N12 Se Sm -","- C172 H214 B8 N48 Se4 Sm4 -","4","2","","Anna C. Hillier; Sung-Ying Liu; Andrea Sella; Mark R. J. Elsegood","Lanthanide Chalcogenolate Complexes: Synthesis and Crystal Structures of the Isoleptic Series [Sm(TpMe,Me)2ER] (E = O, S, Se, Te; TpMe,Me=tris-3,5-Dimethylpyrazolylborate)","Inorganic Chemistry","2000","39","","2635","2644","10.1021/ic9914793","","","0.71073","MoKα","","0.0432","0.0282","","","0.0626","0.0647","","","","","","0.922","","","","has coordinates,has disorder","179313","2020-10-21","18:00:00",""
"4321052","10.1801","0.0006","10.2622","0.0006","23.4367","0.0014","88.313","0.002","86.268","0.002","62.503","0.002","2167.2","0.2","160","2","160","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H57 B2 N12 Se Sm -","- C40 H57 B2 N12 Se Sm -","- C80 H114 B4 N24 Se2 Sm2 -","2","1","","Anna C. Hillier; Sung-Ying Liu; Andrea Sella; Mark R. J. Elsegood","Lanthanide Chalcogenolate Complexes: Synthesis and Crystal Structures of the Isoleptic Series [Sm(TpMe,Me)2ER] (E = O, S, Se, Te; TpMe,Me=tris-3,5-Dimethylpyrazolylborate)","Inorganic Chemistry","2000","39","","2635","2644","10.1021/ic9914793","","","0.71073","MoKα","","0.043","0.0305","","","0.064","0.0675","","","","","","0.985","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321053","18.744","0.001","10.3892","0.0006","23.8351","0.0013","90","","94.854","0.002","90","","4624.9","0.4","160","2","160","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C43 H57 B2 N12 Sm Te -","- C43 H57 B2 N12 Sm Te -","- C172 H228 B8 N48 Sm4 Te4 -","4","1","","Anna C. Hillier; Sung-Ying Liu; Andrea Sella; Mark R. J. Elsegood","Lanthanide Chalcogenolate Complexes: Synthesis and Crystal Structures of the Isoleptic Series [Sm(TpMe,Me)2ER] (E = O, S, Se, Te; TpMe,Me=tris-3,5-Dimethylpyrazolylborate)","Inorganic Chemistry","2000","39","","2635","2644","10.1021/ic9914793","","","0.71073","MoKα","","0.0823","0.0479","","","0.0825","0.0932","","","","","","1.062","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321054","14.414","","15.912","","15.948","","90","","99.466","","90","","3607.96","","","","","","","","","","","","?","8","P 1 21/n 1","-P 2yn","14","","","","- C36 H30 Cl4 N O P S U -","- C36 H30 Cl4 N O P S U -","- C144 H120 Cl16 N4 O4 P4 S4 U4 -","4","1","","Vaughan Clifford Williams; Matthias Müller; Michael A. Leech; Robert G. Denning; Malcolm L. H. Green","Uranium(VI) Sulfilimine Complexes: A New Class of Nitrogen Analogues of the Uranyl Ion","Inorganic Chemistry","2000","39","","2538","2541","10.1021/ic991294w","","","0.7107","MoKα","","","0.0229","","","0.0329","","","","","0.9197","0.9197","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4321055","10.422","0.002","14.163","0.003","11.364","0.002","90","","94.48","0.01","90","","1672.3","0.6","213","2","213","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","[{tri(o-mercaptophenyl)phosphine}gold(III)] dimer","","- C36 H24 Au2 P2 S6 -","- C36 H24 Au2 P2 S6 -","- C72 H48 Au4 P4 S12 -","2","0.5","","Kirstin Ortner; Louise Hilditch; Yifan Zheng; Jonathan R. Dilworth; Ulrich Abram","Gold Complexes with Potentially Tri- and Tetradentate Phosphinothiolate Ligands","Inorganic Chemistry","2000","39","","2801","2806","10.1021/ic000015y","","","1.54184","CuKα","","0.1337","0.0552","","","0.0866","0.1054","","","","","","0.978","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321056","49.678","0.008","49.678","0.008","49.678","0.008","90","","90","","90","","122601","3","213","2","213","2","","","","","","","","6","F d -3 c :2","-F 4ud 2vw 3","228","","Bis{phenyldi(2-mercaptophenyl)phosphine}gold(I,III)","","- C37 H28 Au2 Cl2 P2 S4 -","- C37 H28 Au2 Cl2 P2 S4 -","- C3552 H2688 Au192 Cl192 P192 S384 -","96","0.5","","Kirstin Ortner; Louise Hilditch; Yifan Zheng; Jonathan R. Dilworth; Ulrich Abram","Gold Complexes with Potentially Tri- and Tetradentate Phosphinothiolate Ligands","Inorganic Chemistry","2000","39","","2801","2806","10.1021/ic000015y","","","0.71073","MoKα","","0.1128","0.0582","","","0.139","0.1585","","","","","","0.913","","","","has coordinates,has disorder","179313","2020-10-21","18:00:00",""
"4321057","11.833","0.001","18.158","0.001","14.909","0.001","90","","102.588","0.003","90","","3126.4","0.4","150","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","{Di(1-mercaptophenyl)phenylphosphine-S,P}{triphenylphosphine)gold(I)","","- C36 H29 Au P2 S2 -","- C36 H29 Au P2 S2 -","- C144 H116 Au4 P8 S8 -","4","1","","Kirstin Ortner; Louise Hilditch; Yifan Zheng; Jonathan R. Dilworth; Ulrich Abram","Gold Complexes with Potentially Tri- and Tetradentate Phosphinothiolate Ligands","Inorganic Chemistry","2000","39","","2801","2806","10.1021/ic000015y","","","0.71073","MoKα","","0.071","0.0627","","","0.1532","0.1576","","","","","","1.124","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321058","27.119","0.004","10.0167","0.0013","16.5471","0.0013","90","","96.649","0.011","90","","4464.7","0.9","213","2","213","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","[WO2(OSiPh3)2(Me4phen)]","","- C52 H46 N2 O4 Si2 W -","- C52 H46 N2 O4 Si2 W -","- C208 H184 N8 O16 Si8 W4 -","4","0.5","","Mingming Miao; Michael W. Willer; R. H. Holm","Oxo/Sulfidotungstate(VI) as Precursors to WVIO2, WVIOS, and WVIS2 Complexes and WIV-Dithiolene Chelate Rings","Inorganic Chemistry","2000","39","","2843","2849","10.1021/ic000047l","","","0.71073","MoKα","","0.0354","0.0309","","","0.0767","0.0799","","","","","","1.053","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321059","16.7097","0.0015","10.3575","0.0006","27.002","0.003","90","","103.518","0.009","90","","4543.8","0.7","213","2","213","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","[WOS(OSiPh3)2(Me4phen)","","- C52 H46 N2 O3 S Si2 W -","- C52 H46 N2 O3 S Si2 W -","- C208 H184 N8 O12 S4 Si8 W4 -","4","0.5","","Mingming Miao; Michael W. Willer; R. H. Holm","Oxo/Sulfidotungstate(VI) as Precursors to WVIO2, WVIOS, and WVIS2 Complexes and WIV-Dithiolene Chelate Rings","Inorganic Chemistry","2000","39","","2843","2849","10.1021/ic000047l","","","0.71073","MoKα","","0.0334","0.0305","","","0.076","0.0772","","","","","","1.08","","","","has coordinates,has disorder","179313","2020-10-21","18:00:00",""
"4321060","16.9351","0.0001","10.4963","0.0001","26.8896","0.0002","90","","104.517","0.001","90","","4627.18","0.07","213","2","213","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","[WS2(OSiPh3)2(Me4phen)]","","- C52 H46 N2 O2 S2 Si2 W -","- C52 H44 N2 O2 S2 Si2 W -","- C208 H176 N8 O8 S8 Si8 W4 -","4","0.5","","Mingming Miao; Michael W. Willer; R. H. Holm","Oxo/Sulfidotungstate(VI) as Precursors to WVIO2, WVIOS, and WVIS2 Complexes and WIV-Dithiolene Chelate Rings","Inorganic Chemistry","2000","39","","2843","2849","10.1021/ic000047l","","","0.71073","MoKα","","0.0373","0.0321","","","0.0789","0.082","","","","","","1.077","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321061","13.3052","0.0015","14.9587","0.0014","17.5488","0.0012","109.33","0.007","103.813","0.01","106.667","0.008","2934.4","0.6","213","2","213","2","","","","","","","","7","P -1","-P 1","2","","[W(S2C2Ph2)(OSiPh3)2(Me4phen)](MeCN)","","- C68 H59 N3 O2 S2 Si2 W -","- C68 H59 N3 O2 S2 Si2 W -","- C136 H118 N6 O4 S4 Si4 W2 -","2","1","","Mingming Miao; Michael W. Willer; R. H. Holm","Oxo/Sulfidotungstate(VI) as Precursors to WVIO2, WVIOS, and WVIS2 Complexes and WIV-Dithiolene Chelate Rings","Inorganic Chemistry","2000","39","","2843","2849","10.1021/ic000047l","","","0.71073","MoKα","","0.039","0.0291","","","0.0613","0.0645","","","","","","0.979","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4321062","19.0685","0.001","19.3165","0.001","17.7183","0.0009","90","","112.442","0.001","90","","6032","0.5","213","2","213","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","[Mo(S2C2Ph2)(OSiPh3)2(Me4phen)](C5H12)","","- C71 H56 Mo N2 O2 S2 Si2 -","- C71 H56 Mo N2 O2 S2 Si2 -","- C284 H224 Mo4 N8 O8 S8 Si8 -","4","0.5","","Mingming Miao; Michael W. Willer; R. H. Holm","Oxo/Sulfidotungstate(VI) as Precursors to WVIO2, WVIOS, and WVIS2 Complexes and WIV-Dithiolene Chelate Rings","Inorganic Chemistry","2000","39","","2843","2849","10.1021/ic000047l","","","0.71073","MoKα","","0.0556","0.0485","","","0.1342","0.1413","","","","","","1.06","","","","has coordinates,has disorder","179313","2020-10-21","18:00:00",""
"4321063","12.038","0.003","10.331","0.003","22.003","0.007","90","","92.88","0.02","90","","2732.9","1.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H26 Ag N9 O3 -","- C24 H26 Ag N9 O3 -","- C96 H104 Ag4 N36 O12 -","4","1","","Sanjib Ganguly; Surajit Chattopadhyay; Chittaranjan Sinha; Animesh Chakravorty","Synthesis and Structure of Dimeric Silver Azooximates. Hydrogen Bonding and Nonbonded Ag...Ag Interaction","Inorganic Chemistry","2000","39","","2954","2956","10.1021/ic000056u","","","0.71073","MoKα","","0.0938","0.05","","0.1147","0.1028","","","","1.016","1.22","1.22","","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321064","8.761","0.004","14.433","0.004","20.57","0.009","80.35","0.04","77.61","0.04","74.79","0.03","2434.3","1.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H21 Ag N6 O2 -","- C26 H20.5 Ag N6 O2 -","- C104 H82 Ag4 N24 O8 -","4","2","","Sanjib Ganguly; Surajit Chattopadhyay; Chittaranjan Sinha; Animesh Chakravorty","Synthesis and Structure of Dimeric Silver Azooximates. Hydrogen Bonding and Nonbonded Ag...Ag Interaction","Inorganic Chemistry","2000","39","","2954","2956","10.1021/ic000056u","","","0.71073","MoKα","","0.128","0.0512","","0.1179","0.0788","","","","1.021","1.134","1.134","","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321065","12.2596","0.0014","13.2555","0.0015","16.2892","0.0018","96.431","0.002","100.944","0.002","110.404","0.002","2389.8","0.5","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- K4 Na6 O104 Si2 W18 Zn4 -","- K4 Na6 O104 Si2 W18 Zn4 -","- K4 Na6 O104 Si2 W18 Zn4 -","1","0.5","","Ulrich Kortz; Samih Isber; Michael H. Dickman; Didier Ravot","Sandwich-Type Silicotungstates: Structure and Magnetic Properties of the Dimeric Polyoxoanions [{SiM2W9O34(H2O)}2]12- (M = Mn2+, Cu2+, Zn2+)","Inorganic Chemistry","2000","39","","2915","2922","10.1021/ic000078g","","","0.71073","MoKα","","0.0593","0.0533","","","0.1354","0.1413","","","","","","1.087","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321066","12.2376","0.0007","13.6764","0.0008","15.6177","0.0009","70.286","0.001","79.915","0.001","70.276","0.001","2310.8","0.2","203","2","203","2","","","","","","","","6","P -1","-P 1","2","","","","- K4 Mn5 Na6 O103 Si2 W18 -","- K4 Mn5 Na6 O103 Si2 W18 -","- K4 Mn5 Na6 O103 Si2 W18 -","1","0.5","","Ulrich Kortz; Samih Isber; Michael H. Dickman; Didier Ravot","Sandwich-Type Silicotungstates: Structure and Magnetic Properties of the Dimeric Polyoxoanions [{SiM2W9O34(H2O)}2]12- (M = Mn2+, Cu2+, Zn2+)","Inorganic Chemistry","2000","39","","2915","2922","10.1021/ic000078g","","","0.71073","MoKα","","0.053","0.0406","","","0.0966","0.1031","","","","","","1.068","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321067","11.4271","0.0012","12.5956","0.0013","15.3223","0.0016","80.456","0.002","76.383","0.002","76.968","0.002","2073.3","0.4","203","2","203","2","","","","","","","","6","P -1","-P 1","2","","","","- Cu4 K3 Na5 O96 Si2 W18 -","- Cu4 K3 Na5 O96 Si2 W18 -","- Cu4 K3 Na5 O96 Si2 W18 -","1","0.5","","Ulrich Kortz; Samih Isber; Michael H. Dickman; Didier Ravot","Sandwich-Type Silicotungstates: Structure and Magnetic Properties of the Dimeric Polyoxoanions [{SiM2W9O34(H2O)}2]12- (M = Mn2+, Cu2+, Zn2+)","Inorganic Chemistry","2000","39","","2915","2922","10.1021/ic000078g","","","0.71073","MoKα","","0.0931","0.0567","","","0.1287","0.151","","","","","","1.045","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321068","10.8299","0.0007","16.8538","0.001","11.5157","0.0007","90","","116.493","0.001","90","","1881.2","0.2","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C13 H24 Cl Cu O4 S4 -","- C13 H24 Cl Cu O4 S4 -","- C52 H96 Cl4 Cu4 O16 S16 -","4","1","","Prabodha Wijetunge; Chandrika P. Kulatilleke; Luke T. Dressel; Mary Jane Heeg; L. A. Ochrymowycz; D. B. Rorabacher","Effect of Conformational Constraints on Gated Electron-Transfer Kinetics. 3. Copper(II/I) Complexes with cis- and trans-Cyclopentanediyl-1,4,8,11-tetrathiacyclotetradecane1","Inorganic Chemistry","2000","39","","2897","2905","10.1021/ic0000909","","","0.71073","MoKα","","0.0816","0.0515","","0.1515","0.1336","","","","0.941","1.013","1.013","","","","","has coordinates,has disorder","179313","2020-10-21","18:00:00",""
"4321069","8.2607","0.0002","11.1482","0.0003","13.0981","0.0003","82.783","0.001","84.104","0.001","78","0.001","1166.87","0.05","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","","","- C13 H26 Cl2 Cu O9 S4 -","- C13 H26 Cl2 Cu O9 S4 -","- C26 H52 Cl4 Cu2 O18 S8 -","2","1","","Prabodha Wijetunge; Chandrika P. Kulatilleke; Luke T. Dressel; Mary Jane Heeg; L. A. Ochrymowycz; D. B. Rorabacher","Effect of Conformational Constraints on Gated Electron-Transfer Kinetics. 3. Copper(II/I) Complexes with cis- and trans-Cyclopentanediyl-1,4,8,11-tetrathiacyclotetradecane1","Inorganic Chemistry","2000","39","","2897","2905","10.1021/ic0000909","","","0.71073","MoKα","","0.0614","0.0417","","0.1095","0.1047","","","","0.923","1.098","1.098","","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321070","16.2369","0.0009","13.6473","0.0008","10.4642","0.0005","90","","90","","90","","2318.8","0.2","295","2","295","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C13 H26 Cl2 Cu O9 S4 -","- C13 H24 Cl2 Cu O9 S4 -","- C52 H96 Cl8 Cu4 O36 S16 -","4","1","","Prabodha Wijetunge; Chandrika P. Kulatilleke; Luke T. Dressel; Mary Jane Heeg; L. A. Ochrymowycz; D. B. Rorabacher","Effect of Conformational Constraints on Gated Electron-Transfer Kinetics. 3. Copper(II/I) Complexes with cis- and trans-Cyclopentanediyl-1,4,8,11-tetrathiacyclotetradecane1","Inorganic Chemistry","2000","39","","2897","2905","10.1021/ic0000909","","","0.71073","MoKα","","0.0627","0.0446","","0.13","0.1192","","","","0.94","1.008","1.008","","","","","has coordinates,has disorder","179313","2020-10-21","18:00:00",""
"4321071","7.3387","0.0009","17.969","0.002","7.4432","0.0009","90","","97.814","0.002","90","","972.4","0.2","295","2","295","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C13 H24 Cl Cu O4 S4 -","- C13 H24 Cl Cu O4 S4 -","- C26 H48 Cl2 Cu2 O8 S8 -","2","1","","Prabodha Wijetunge; Chandrika P. Kulatilleke; Luke T. Dressel; Mary Jane Heeg; L. A. Ochrymowycz; D. B. Rorabacher","Effect of Conformational Constraints on Gated Electron-Transfer Kinetics. 3. Copper(II/I) Complexes with cis- and trans-Cyclopentanediyl-1,4,8,11-tetrathiacyclotetradecane1","Inorganic Chemistry","2000","39","","2897","2905","10.1021/ic0000909","","","0.71073","MoKα","","0.0602","0.0564","","","0.1677","0.17","","","","","","1.086","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321072","19.973","0.004","15.102","0.003","17.257","0.004","90","","113.89","0.03","90","","4759","2","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C46 H46 F12 Mn N6 O4 P2 -","- C46 H46 F12 Mn N6 O4 P2 -","- C184 H184 F48 Mn4 N24 O16 P8 -","4","1","","Bas de Bruin; Eckhard Bill; Eberhard Bothe; Thomas Weyhermüller; Karl Wieghardt","Molecular and Electronic Structures of Bis(pyridine-2,6-diimine)metal Complexes [ML2](PF6)n (n = 0, 1, 2, 3; M = Mn, Fe, Co, Ni, Cu, Zn)","Inorganic Chemistry","2000","39","","2936","2947","10.1021/ic000113j","","","0.71073","MoKα","","0.0647","0.0441","","0.1198","0.1067","","","","1.037","1.08","1.08","","","","","has coordinates,has disorder","179313","2020-10-21","18:00:00",""
"4321073","12.3162","0.0008","23.911","0.002","14.6946","0.0009","90","","93.96","0.02","90","","4317.1","0.5","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C46 H46 F6 Mn N6 O4 P -","- C46 H46 F6 Mn N6 O4 P -","- C184 H184 F24 Mn4 N24 O16 P4 -","4","1","","Bas de Bruin; Eckhard Bill; Eberhard Bothe; Thomas Weyhermüller; Karl Wieghardt","Molecular and Electronic Structures of Bis(pyridine-2,6-diimine)metal Complexes [ML2](PF6)n (n = 0, 1, 2, 3; M = Mn, Fe, Co, Ni, Cu, Zn)","Inorganic Chemistry","2000","39","","2936","2947","10.1021/ic000113j","","","0.71073","MoKα","","0.047","0.0316","","0.0861","0.0802","","","","1.059","1.133","1.133","","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321074","18.455","0.002","16.4501","0.0012","17.224","0.002","90","","114.81","0.02","90","","4746.4","1.1","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C46 H48 F12 Fe N6 O5 P2 -","- C46 H46 F12 Fe N6 O5 P2 -","- C184 H184 F48 Fe4 N24 O20 P8 -","4","1","","Bas de Bruin; Eckhard Bill; Eberhard Bothe; Thomas Weyhermüller; Karl Wieghardt","Molecular and Electronic Structures of Bis(pyridine-2,6-diimine)metal Complexes [ML2](PF6)n (n = 0, 1, 2, 3; M = Mn, Fe, Co, Ni, Cu, Zn)","Inorganic Chemistry","2000","39","","2936","2947","10.1021/ic000113j","","","0.71073","MoKα","","0.065","0.042","","0.129","0.1166","","","","1.121","1.249","1.249","","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321075","13.142","0.003","14.08","0.003","14.752","0.003","111.5","0.03","102.85","0.03","110.04","0.03","2188.7","1.4","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C46 H46 Co F6 N6 O4 P -","- C46 H46 Co F6 N6 O4 P -","- C92 H92 Co2 F12 N12 O8 P2 -","2","1","","Bas de Bruin; Eckhard Bill; Eberhard Bothe; Thomas Weyhermüller; Karl Wieghardt","Molecular and Electronic Structures of Bis(pyridine-2,6-diimine)metal Complexes [ML2](PF6)n (n = 0, 1, 2, 3; M = Mn, Fe, Co, Ni, Cu, Zn)","Inorganic Chemistry","2000","39","","2936","2947","10.1021/ic000113j","","","0.71073","MoKα","","0.117","0.065","","0.1873","0.1533","","","","1.053","1.147","1.147","","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321076","18.104","0.002","16.5602","0.0014","17.248","0.002","90","","113.83","0.02","90","","4730.2","1.1","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C46 H46 Co F12 N6 O4 P2 -","- C46 H46 Co F12 N6 O4 P2 -","- C184 H184 Co4 F48 N24 O16 P8 -","4","1","","Bas de Bruin; Eckhard Bill; Eberhard Bothe; Thomas Weyhermüller; Karl Wieghardt","Molecular and Electronic Structures of Bis(pyridine-2,6-diimine)metal Complexes [ML2](PF6)n (n = 0, 1, 2, 3; M = Mn, Fe, Co, Ni, Cu, Zn)","Inorganic Chemistry","2000","39","","2936","2947","10.1021/ic000113j","","","0.71073","MoKα","","0.0956","0.0477","","0.097","0.083","","","","1.035","1.128","1.128","","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321077","18.047","0.002","16.655","0.002","17.132","0.002","90","","112.7","0.02","90","","4750.5","1.2","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C46 H46 F12 N6 Ni O4 P2 -","- C46 H46 F12 N6 Ni O4 P2 -","- C184 H184 F48 N24 Ni4 O16 P8 -","4","1","","Bas de Bruin; Eckhard Bill; Eberhard Bothe; Thomas Weyhermüller; Karl Wieghardt","Molecular and Electronic Structures of Bis(pyridine-2,6-diimine)metal Complexes [ML2](PF6)n (n = 0, 1, 2, 3; M = Mn, Fe, Co, Ni, Cu, Zn)","Inorganic Chemistry","2000","39","","2936","2947","10.1021/ic000113j","","","0.71073","MoKα","","0.0364","0.0281","","0.0698","0.066","","","","1.037","1.072","1.072","","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321078","17.799","0.0008","16.7966","0.0008","17.1107","0.0008","90","","111.89","0.01","90","","4746.6","0.5","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C46 H46 Cu F12 N6 O4 P2 -","- C46 H46 Cu F12 N6 O4 P2 -","- C184 H184 Cu4 F48 N24 O16 P8 -","4","1","","Bas de Bruin; Eckhard Bill; Eberhard Bothe; Thomas Weyhermüller; Karl Wieghardt","Molecular and Electronic Structures of Bis(pyridine-2,6-diimine)metal Complexes [ML2](PF6)n (n = 0, 1, 2, 3; M = Mn, Fe, Co, Ni, Cu, Zn)","Inorganic Chemistry","2000","39","","2936","2947","10.1021/ic000113j","","","0.71073","MoKα","","0.069","0.0381","","0.0989","0.0924","","","","1.047","1.187","1.187","","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321079","17.807","0.002","16.825","0.002","17.037","0.002","90","","111.38","0.02","90","","4753.1","1.2","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C46 H46 F12 N6 O4 P2 Zn -","- C46 H46 F12 N6 O4 P2 Zn -","- C184 H184 F48 N24 O16 P8 Zn4 -","4","1","","Bas de Bruin; Eckhard Bill; Eberhard Bothe; Thomas Weyhermüller; Karl Wieghardt","Molecular and Electronic Structures of Bis(pyridine-2,6-diimine)metal Complexes [ML2](PF6)n (n = 0, 1, 2, 3; M = Mn, Fe, Co, Ni, Cu, Zn)","Inorganic Chemistry","2000","39","","2936","2947","10.1021/ic000113j","","","0.71073","MoKα","","0.0631","0.0349","","0.0859","0.0808","","","","1.035","1.176","1.176","","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321080","19.688","0.003","19.688","0.003","55.264","0.011","90","","90","","120","","18551","5","90","2","90","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- As2 Cl4 F30 O6 Te6 -","- As2 Cl4 F30 O6 Te6 -","- As48 Cl96 F720 O144 Te144 -","24","1.33333","","Michael Gerken; Peter Kolb; Andreas Wegner; Hélène P. A. Mercier; Horst Borrmann; David A. Dixon; Gary J. Schrobilgen","Tetrachloro- and Tetrabromoarsonium(V) Cations: Raman and 75As, 19F NMR Spectroscopic Characterization and X-ray Crystal Structures of [AsCl4][As(OTeF5)6] and [AsBr4][AsF(OTeF5)5]","Inorganic Chemistry","2000","39","","2813","2824","10.1021/ic000118g","","","0.71073","MoKα","","0.1436","0.1341","","0.4505","0.4246","","","","1.714","1.806","1.806","","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321081","9.8741","0.0014","9.8741","0.0014","55.301","0.011","90","","90","","120","","4669.4","1.3","150","2","150","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- As2 Cl4 F30 O6 Te6 -","- As2 Cl4 F30 O6 Te6 -","- As12 Cl24 F180 O36 Te36 -","6","0.333333","","Michael Gerken; Peter Kolb; Andreas Wegner; Hélène P. A. Mercier; Horst Borrmann; David A. Dixon; Gary J. Schrobilgen","Tetrachloro- and Tetrabromoarsonium(V) Cations: Raman and 75As, 19F NMR Spectroscopic Characterization and X-ray Crystal Structures of [AsCl4][As(OTeF5)6] and [AsBr4][AsF(OTeF5)5]","Inorganic Chemistry","2000","39","","2813","2824","10.1021/ic000118g","","","0.71073","MoKα","","0.0443","0.0438","","0.1447","0.1444","","","","2.184","2.189","2.189","","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321082","9.778","0.004","17.731","0.007","18.87","0.008","103.53","0.04","103.53","0.04","105.1","0.04","2915","2","90","2","90","2","","","","","","","","5","P -1","-P 1","2","","","","- As2 Br4 F26 O5 Te5 -","- As2 Br4 F26 O5 Te5 -","- As8 Br16 F104 O20 Te20 -","4","2","","Michael Gerken; Peter Kolb; Andreas Wegner; Hélène P. A. Mercier; Horst Borrmann; David A. Dixon; Gary J. Schrobilgen","Tetrachloro- and Tetrabromoarsonium(V) Cations: Raman and 75As, 19F NMR Spectroscopic Characterization and X-ray Crystal Structures of [AsCl4][As(OTeF5)6] and [AsBr4][AsF(OTeF5)5]","Inorganic Chemistry","2000","39","","2813","2824","10.1021/ic000118g","","","0.71073","MoKα","","0.0754","0.0368","","0.0582","0.0513","","","","0.92","1.026","1.026","","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321083","8.501","0.002","8.828","0.002","5.599","0.002","90","","101.11","0.02","90","","412.3","0.2","128","1","128","1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","trifluorovinylisocyanide","","- C3 F3 N -","- C3 F3 N -","- C12 F12 N4 -","4","1","","Jürgen Buschmann; Sven Kleinhenz; Dieter Lentz; Peter Luger; Krishnan V. Madappat; Dagmar Preugschat; Joseph S. Thrasher","Crystal and Molecular Structures of Trifluoroacrylonitrile, F2CCF-CN, and Trifluorovinyl Isocyanide, F2CCF-NC, by Low-Temperature X-ray Crystallography and ab Initio Calculations","Inorganic Chemistry","2000","39","","2807","2812","10.1021/ic000264m","","","0.71069","MoKα","","0.084","0.0469","","","0.1469","0.162","","","","","","1.105","","","","has coordinates,has disorder","179313","2020-10-21","18:00:00",""
"4321084","8.595","0.004","8.748","0.001","5.421","0.001","90","","102.83","0.02","90","","397.4","0.2","113","1","113","1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","trifluoroacrylonitrile","","- C3 F3 N -","- C3 F3 N -","- C12 F12 N4 -","4","1","","Jürgen Buschmann; Sven Kleinhenz; Dieter Lentz; Peter Luger; Krishnan V. Madappat; Dagmar Preugschat; Joseph S. Thrasher","Crystal and Molecular Structures of Trifluoroacrylonitrile, F2CCF-CN, and Trifluorovinyl Isocyanide, F2CCF-NC, by Low-Temperature X-ray Crystallography and ab Initio Calculations","Inorganic Chemistry","2000","39","","2807","2812","10.1021/ic000264m","","","0.71069","MoKα","","0.0676","0.0416","","0.184","","0.1418","","","1.06","","","1.246","","","","has coordinates,has disorder","179313","2020-10-21","18:00:00",""
"4321085","16.443","0.003","17.7206","0.0017","16.871","0.003","90","","108.236","0.017","90","","4669","1.4","223","2","223","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C56 H50 O2 P4 Pd -","- C56 H50 O2 P4 Pd -","- C224 H200 O8 P16 Pd4 -","4","0.5","","Larry R. Falvello; Susana Fernández; Rafael Navarro; Esteban P. Urriolabeitia","Reactivity of Pd(0) Complexes with the Phosphino Ylide [Ph2PCH2PPh2C(H)C(O)Me]. Molecular Structure of [Pd(PPh2CHPPh2C(H)C(O)Me)2]","Inorganic Chemistry","2000","39","","2957","2960","10.1021/ic990923z","","","0.71073","MoKα","","0.0456","0.035","","","0.084","0.0884","","","","","","1.03","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321086","13.5501","0.001","9.9045","0.001","32.564","0.002","90","","91.13","0.01","90","","4369.5","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Ag(dmb)2(TCNQ) 2(THF)","","- C44 H48 Ag N8 O2 -","- C44 H48 Ag N8 O2 -","- C176 H192 Ag4 N32 O8 -","4","1","","Daniel Fortin; Marc Drouin; Pierre D. Harvey","Preparation and Characterization of {[M(dmb)2]TCNQ.xTCNQ° }n Polymers (M = Cu,Ag; dmb = 1,8-Diisocyano-p-menthane; x = 0, 0.5, 1.0, 1.5; TCNQ = 7,7,8,8-Tetracyano-p-quinodimethane) and Design of New Semi- and Photoconducting Organometallic Materials","Inorganic Chemistry","2000","39","","2758","2769","10.1021/ic990975o","","","1.5406","Cu","","0.0986","0.0589","","","0.155","0.179","","","","","","1.056","","","","has coordinates,has disorder","179313","2020-10-21","18:00:00",""
"4321087","14.3669","0.0019","9.1659","0.0003","34.012","0.003","90","","92.14","0.008","90","","4475.8","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ag(dmb)2(TCNQ)0.5(TCNQ) 0.5(Toluene)","","- C46.5 H46 Ag N9 -","- C46.5 H46 Ag N9 -","- C186 H184 Ag4 N36 -","4","1","","Daniel Fortin; Marc Drouin; Pierre D. Harvey","Preparation and Characterization of {[M(dmb)2]TCNQ.xTCNQ° }n Polymers (M = Cu,Ag; dmb = 1,8-Diisocyano-p-menthane; x = 0, 0.5, 1.0, 1.5; TCNQ = 7,7,8,8-Tetracyano-p-quinodimethane) and Design of New Semi- and Photoconducting Organometallic Materials","Inorganic Chemistry","2000","39","","2758","2769","10.1021/ic990975o","","","1.5406","","","0.1418","0.0533","","","0.1352","0.1604","","","","","","1.031","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4321088","25.83","0.011","9.68","0.002","42.183","0.019","90","","104.87","0.04","90","","10194","7","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Ag(dmb)2(TCNQ) 1.5(TCNQ)","","- C54 H46 Ag N14 -","- C54 H46 Ag N14 -","- C432 H368 Ag8 N112 -","8","1","","Daniel Fortin; Marc Drouin; Pierre D. Harvey","Preparation and Characterization of {[M(dmb)2]TCNQ.xTCNQ° }n Polymers (M = Cu,Ag; dmb = 1,8-Diisocyano-p-menthane; x = 0, 0.5, 1.0, 1.5; TCNQ = 7,7,8,8-Tetracyano-p-quinodimethane) and Design of New Semi- and Photoconducting Organometallic Materials","Inorganic Chemistry","2000","39","","2758","2769","10.1021/ic990975o","","","1.5406","CuKa","","0.1642","0.0701","","","0.1723","0.2133","","","","","","0.949","","","","has coordinates,has disorder","179313","2020-10-21","18:00:00",""
"4321089","26.273","0.003","9.73","0.003","31.526","0.003","90","","112.12","0.02","90","","7466","3","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","Ag(dmb)2 DCTC","","- C70 H80 Ag2 N14 O2 -","- C70 H80 Ag2 N14 O2 -","- C280 H320 Ag8 N56 O8 -","4","1","","Daniel Fortin; Marc Drouin; Pierre D. Harvey","Preparation and Characterization of {[M(dmb)2]TCNQ.xTCNQ° }n Polymers (M = Cu,Ag; dmb = 1,8-Diisocyano-p-menthane; x = 0, 0.5, 1.0, 1.5; TCNQ = 7,7,8,8-Tetracyano-p-quinodimethane) and Design of New Semi- and Photoconducting Organometallic Materials","Inorganic Chemistry","2000","39","","2758","2769","10.1021/ic990975o","","","1.5406","CuKa","","0.2301","0.1346","","","0.2999","0.3243","","","","","","1.473","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321090","10.0835","0.0014","11.359","0.003","18.751","0.003","92.348","0.015","101.3","0.012","115.149","0.018","1887.7","0.7","293","","293","","","","","","","","","7","P -1","-P 1","2","","","","- C32 H24 Br2 F12 N8 O3 Ru -","- C32 H18 F12 N8 Ru -","- C64 H36 F24 N16 Ru2 -","2","1","","Peter A. Anderson; Robert F. Anderson; Masaoki Furue; Peter C. Junk; F. Richard Keene; Bradley T. Patterson; Brett D. Yeomans","Protonation Studies of Reduced Ruthenium(II) Complexes with Polypyridyl Ligands","Inorganic Chemistry","2000","39","","2721","2728","10.1021/ic991070d","","","0.71073","xray_tube","","0.22","0.073","","0.076","0.072","","","","2.02","2.875","2.875","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4321091","40.352","0.013","40.352","0.013","17.813","0.008","90","","90","","90","","29005","19","190","1","190","1","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C63 H89 Mn3 N16 O17 -","- C57.58 H58.58 Mn3 N16 O14.58 -","- C921.28 H937.28 Mn48 N256 O233.28 -","16","1","","Mooshin Moon; Inhoe Kim; Myoung Soo Lah","Three-Dimensional Framework Constructed Using Nanometer-Sized Metallamacrocycle as a Secondary Building Unit","Inorganic Chemistry","2000","39","","2710","2711","10.1021/ic991079f","","","0.71073","MoKα","","0.0939","0.0822","","","0.2281","0.2421","","","","","","1.044","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321092","11.592","0.001","30.953","0.004","11.799","0.002","90","","94.312","0.007","90","","4221.6","1","298","","","","","","","","","","Local laboratory","7","P 1 21/a 1","-P 2yab","14","","","","- C38 H42 F6 N2 O5 P3 Re -","- C38 H42 F6 N2 O5 P3 Re -","- C152 H168 F24 N8 O20 P12 Re4 -","4","1","","Kazuhide Koike; Junji Tanabe; Shigeki Toyama; Hideaki Tsubaki; Kazuhiko Sakamoto; Jeremy R. Westwell; Frank P. A. Johnson; Hisao Hori; Hideki Saitoh; Osamu Ishitani","New Synthetic Routes to Biscarbonylbipyridinerhenium(I) Complexes cis,trans-[Re(X2bpy)(CO)2(PR3)(Y)]n+ (X2bpy = 4,4'-X2-2,2'-bipyridine) via Photochemical Ligand Substitution Reactions, and Their Photophysical and Electrochemical Properties","Inorganic Chemistry","2000","39","","2777","2783","10.1021/ic991190l","","","0.71073","MoK-alpha","","","0.066","","","0.058","","","","","2.813","2.813","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321093","8.349","0.002","9.068","0.002","6.7","0.001","108.29","0.02","109.18","0.02","100.57","0.02","431","0.2","298.2","","298.2","","","","","","","","","4","P -1","-P 1","2","","","","- C18 H26 N4 O2 -","- C18 H24 N4 O2 -","- C18 H24 N4 O2 -","1","0.5","","Akira Sakane; Harumi Kumada; Satoru Karasawa; Noboru Koga; Hiizu Iwamura","Molecular Structures and Magnetic Properties of the Mixed-Ligand Complexes of Bis(hexafluoroacetylacetonato)manganese(II), -copper(II), and -zinc(II) with 4,4'-Bis(N-tert-butyl-N-oxylamino)-2,2'-bipyridine. Isosceles Triangular Hetero-Three-Spin Systems Consisting of Aminoxyls and Metal Ions","Inorganic Chemistry","2000","39","","2891","2896","10.1021/ic991205f","","","1.5418","CuKα","","0.0464","0.0464","","0.0463","","0.0463","","","1.078","","","1.08","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321094","23.427","0.002","16.983","0.001","21.999","0.002","90","","128.974","0.004","90","","6804.5","1","113.2","","113.2","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H26 Cu F12 N4 O6 -","- C28 H26 Cu F12 N4 O6 -","- C224 H208 Cu8 F96 N32 O48 -","8","1","","Akira Sakane; Harumi Kumada; Satoru Karasawa; Noboru Koga; Hiizu Iwamura","Molecular Structures and Magnetic Properties of the Mixed-Ligand Complexes of Bis(hexafluoroacetylacetonato)manganese(II), -copper(II), and -zinc(II) with 4,4'-Bis(N-tert-butyl-N-oxylamino)-2,2'-bipyridine. Isosceles Triangular Hetero-Three-Spin Systems Consisting of Aminoxyls and Metal Ions","Inorganic Chemistry","2000","39","","2891","2896","10.1021/ic991205f","","","0.7107","MoKα","","0.0604","0.0604","","0.0555","","0.0555","","","1.934","","","1.934","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321095","12.68","0.02","22.052","0.003","13.275","0.006","90","","111.73","0.06","90","","3448","6","296.2","","296.2","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H26 F12 Mn N4 O6 -","- C28 H26 F12 Mn0.5 N4 O6 -","- C112 H104 F48 Mn2 N16 O24 -","4","0.5","","Akira Sakane; Harumi Kumada; Satoru Karasawa; Noboru Koga; Hiizu Iwamura","Molecular Structures and Magnetic Properties of the Mixed-Ligand Complexes of Bis(hexafluoroacetylacetonato)manganese(II), -copper(II), and -zinc(II) with 4,4'-Bis(N-tert-butyl-N-oxylamino)-2,2'-bipyridine. Isosceles Triangular Hetero-Three-Spin Systems Consisting of Aminoxyls and Metal Ions","Inorganic Chemistry","2000","39","","2891","2896","10.1021/ic991205f","","","0.7107","MoKα","","0.0537","0.054","","0.07","","0.07","","","1.4","","","1.4","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321096","7.8721","0.001","9.84","0.001","14.8196","0.001","92.327","0.01","95.052","0.01","95.66","0.01","1136.5","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C52 H44 Cu N16 -","- C52 H44 Cu N16 -","- C52 H44 Cu N16 -","1","0.5","","Loreto Ballester; Ana M. Gil; Angel Gutiérrez; M. Felisa Perpiñán; María Teresa Azcondo; Ana E. Sánchez; Eugenio Coronado; Carlos J. Gómez-García","Delocalized TCNQ Stacks in Nickel and Copper Tetraazamacrocyclic Systems","Inorganic Chemistry","2000","39","","2837","2842","10.1021/ic9912070","","","0.71073","MoKα","","0.4109","0.0852","","0.2877","0.1841","","","","0.974","1.293","1.293","","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321097","8.809","0.002","10.896","0.002","13.727","0.002","103.038","0.012","101.23","0.02","109.37","0.02","1157.7","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C52 H44 N16 Ni -","- C52 H44 N16 Ni -","- C52 H44 N16 Ni -","1","0.5","","Loreto Ballester; Ana M. Gil; Angel Gutiérrez; M. Felisa Perpiñán; María Teresa Azcondo; Ana E. Sánchez; Eugenio Coronado; Carlos J. Gómez-García","Delocalized TCNQ Stacks in Nickel and Copper Tetraazamacrocyclic Systems","Inorganic Chemistry","2000","39","","2837","2842","10.1021/ic9912070","","","0.7107","MoKα","","0.2686","0.052","","0.5241","0.065","","","","1.149","1.438","1.438","","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321098","14.606","0.003","7.704","0.002","21.836","0.004","90","","95.77","0.03","90","","2444.6","0.9","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C7 H10 Cl Cu N3 O7 -","- C7 H10 Cl Cu N3 O7 -","- C56 H80 Cl8 Cu8 N24 O56 -","8","1","","Enrique Colacio; Mustapha Ghazi; Raikko Kivekäs; José María Moreno","Helical-Chain Copper(II) Complexes and a Cyclic Tetranuclear Copper(II) Complex with Single Syn-Anti Carboxylate Bridges and Ferromagnetic Exchange Interactions","Inorganic Chemistry","2000","39","","2882","2890","10.1021/ic991209k","","","0.71073","MoKα","","0.0733","0.0472","","0.1597","0.1217","","","","0.936","0.9","0.9","","","","","has coordinates,has disorder","179313","2020-10-21","18:00:00",""
"4321099","12.954","0.003","7.4866","0.0015","16.085","0.003","90","","101.53","0.03","90","","1528.5","0.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C9 H15 Cl Cu N2 O9 -","- C9 H15 Cl Cu N2 O9 -","- C36 H60 Cl4 Cu4 N8 O36 -","4","1","","Enrique Colacio; Mustapha Ghazi; Raikko Kivekäs; José María Moreno","Helical-Chain Copper(II) Complexes and a Cyclic Tetranuclear Copper(II) Complex with Single Syn-Anti Carboxylate Bridges and Ferromagnetic Exchange Interactions","Inorganic Chemistry","2000","39","","2882","2890","10.1021/ic991209k","","","0.71073","MoKα","","0.1175","0.0641","","0.1588","0.1211","","","","1.123","1.131","1.131","","","","","has coordinates,has disorder","179313","2020-10-21","18:00:00",""
"4321100","13.1234","0.001","7.7098","0.0004","16.126","0.002","90","","100.432","0.008","90","","1604.6","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H17 Cl Cu N2 O9 -","- C9.96 H17.9 Cl Cu N2 O9 -","- C39.84 H71.6 Cl4 Cu4 N8 O36 -","4","1","","Enrique Colacio; Mustapha Ghazi; Raikko Kivekäs; José María Moreno","Helical-Chain Copper(II) Complexes and a Cyclic Tetranuclear Copper(II) Complex with Single Syn-Anti Carboxylate Bridges and Ferromagnetic Exchange Interactions","Inorganic Chemistry","2000","39","","2882","2890","10.1021/ic991209k","","","0.71073","MoKα","","0.062","0.0429","","0.1404","0.1067","","","","1.052","1.034","1.034","","","","","has coordinates,has disorder","179314","2020-10-21","18:00:00",""
"4321101","26.658","0.005","7.966","0.002","26.508","0.005","90","","92.25","0.03","90","","5625","2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C40 H44 Cl4 Cu4 N8 O24 -","- C11.4286 H12.5714 Cl1.14286 Cu1.14286 N2.28571 O6.85714 -","- C160 H176 Cl16 Cu16 N32 O96 -","14","1.75","","Enrique Colacio; Mustapha Ghazi; Raikko Kivekäs; José María Moreno","Helical-Chain Copper(II) Complexes and a Cyclic Tetranuclear Copper(II) Complex with Single Syn-Anti Carboxylate Bridges and Ferromagnetic Exchange Interactions","Inorganic Chemistry","2000","39","","2882","2890","10.1021/ic991209k","","","0.71073","MoKα","","0.2285","0.0976","","0.2748","0.1732","","","","1.104","1.226","1.226","","","","","has coordinates,has disorder","179314","2020-10-21","18:00:00",""
"4321102","19.948","0.003","19.948","0.003","19.405","0.004","90","","90","","120","","6687","2","293","2","293","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C11 H11 Cl Cu N3 O7.5 -","- C11 H10 Cl Cu N3 O7.5 -","- C198 H180 Cl18 Cu18 N54 O135 -","18","1","","Enrique Colacio; Mustapha Ghazi; Raikko Kivekäs; José María Moreno","Helical-Chain Copper(II) Complexes and a Cyclic Tetranuclear Copper(II) Complex with Single Syn-Anti Carboxylate Bridges and Ferromagnetic Exchange Interactions","Inorganic Chemistry","2000","39","","2882","2890","10.1021/ic991209k","","","0.71073","MoKα","","0.1054","0.0675","","0.1937","0.1456","","","","1.095","1.135","1.135","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4321103","8.199","0.005","8.942","0.006","6.866","0.004","103.85","0.05","108.51","0.04","69.32","0.05","442","0.5","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H16 Cl2 Cu2 N6 O4 -","- C14 H16 Cl2 Cu2 N6 O4 -","- C14 H16 Cl2 Cu2 N6 O4 -","1","0.5","","Enrique Colacio; Mustapha Ghazi; Raikko Kivekäs; José María Moreno","Helical-Chain Copper(II) Complexes and a Cyclic Tetranuclear Copper(II) Complex with Single Syn-Anti Carboxylate Bridges and Ferromagnetic Exchange Interactions","Inorganic Chemistry","2000","39","","2882","2890","10.1021/ic991209k","","","0.71073","MoKα","","0.032","0.0306","","","0.0828","0.0838","","","","","","1.065","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321104","23.612","0.003","23.612","0.003","26.859","0.005","90","","90","","120","","12968","3","293","2","293","2","","","","","","","","5","P 63/m m c","-P 6c 2c","194","","","","- H227 Mo57 N21 O283 V12 -","- Mo57 N6 O275 V12 -","- Mo114 N12 O550 V24 -","2","0.0833333","","Wenbin Yang; Xiang Lin; Canzhong Lu; Honghui Zhuang; Jinshun Huang","(NH4)15[H3Mo57V6(NO)6O189(H2O)12(VO)6].~60H2O: New Nanocompound Obtained by Chemical Embellishment of {M57V6}","Inorganic Chemistry","2000","39","","2706","2707","10.1021/ic991249o","","","0.71073","MoKα","","0.0844","0.0546","","","0.1699","0.1877","","","","","","0.938","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321105","12.1197","0.0011","4.5978","0.0004","11.291","0.0009","90","","91.772","0.015","90","","628.88","0.09","293","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- Ba6 Li2.72 Mg5.28 Si12 -","- Ba6 Li2.72 Mg5.28 Si12 -","- Ba6 Li2.72 Mg5.28 Si12 -","1","0.125","","Steffen Wengert; Reinhard Nesper","Topological Relationships and Building Blocks in Zintl Phases of the Composition Ban+l(Mg,Li)2nSi2(n+l)","Inorganic Chemistry","2000","39","","2861","2865","10.1021/ic991299t","","","0.71073","MoKα","","0.0385","0.0371","","","0.0976","0.0997","","","","","","1.103","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321106","7.2592","0.0005","4.6136","0.0003","11.6908","0.0008","90","","90","","90","","391.54","0.05","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- Ba Li0.93 Mg0.08 Si2 -","- Ba Li0.925 Mg0.075 Si2 -","- Ba4 Li3.7 Mg0.3 Si8 -","4","0.5","","Steffen Wengert; Reinhard Nesper","Topological Relationships and Building Blocks in Zintl Phases of the Composition Ban+l(Mg,Li)2nSi2(n+l)","Inorganic Chemistry","2000","39","","2861","2865","10.1021/ic991299t","","","0.71073","MoKα","","0.0262","0.0237","","","0.0496","0.0506","","","","","","1.204","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321107","17.889","0.001","14.13","0.001","15.276","0.001","90","0.01","99.648","0.01","90","0.01","3806.7","0.4","117","","117","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C43 H14 Cl F15 Fe N4 -","- C43 H14 Cl F15 Fe N4 -","- C172 H56 Cl4 F60 Fe4 N16 -","4","1","","Liliya Simkhovich; Nitsa Galili; Irena Saltsman; Israel Goldberg; Zeev Gross","Coordination Chemistry of the Novel 5,10,15-Tris(pentafluorophenyl)corrole: Synthesis, Spectroscopy, and Structural Characterization of Its Cobalt(III), Rhodium(III), and Iron(IV) Complexes","Inorganic Chemistry","2000","39","","2704","2705","10.1021/ic991342c","","","0.7107","MoKα","","0.109","0.0908","","","0.2374","0.2487","","","","","","1.079","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321108","8.413","0.001","15.397","0.001","20.356","0.001","91.8","0.01","101.507","0.01","91.901","0.01","2580.4","0.4","117","","117","","","","","","","","","6","P -1","-P 1","2","","","","- C55 H23 F15 N4 P Rh -","- C55 H23 F15 N4 P Rh -","- C110 H46 F30 N8 P2 Rh2 -","2","1","","Liliya Simkhovich; Nitsa Galili; Irena Saltsman; Israel Goldberg; Zeev Gross","Coordination Chemistry of the Novel 5,10,15-Tris(pentafluorophenyl)corrole: Synthesis, Spectroscopy, and Structural Characterization of Its Cobalt(III), Rhodium(III), and Iron(IV) Complexes","Inorganic Chemistry","2000","39","","2704","2705","10.1021/ic991342c","","","0.7107","MoKα","","0.0667","0.0601","","","0.1776","0.1808","","","","","","1.128","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321109","5.643","0.001","10.295","0.004","12.962","0.004","90","","101.05","0.02","90","","739.1","0.4","130","","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Trifluorophosphonium-hexafluoroantimonate, hydrogenfluoride","Trifluorophosphonium-hexafluoroantimonate, hydrogenfluoride","","- F10 H2 P Sb -","- F10 H2 P Sb -","- F40 H8 P4 Sb4 -","4","1","","Ralf Küster; Thomas Drews; Konrad Seppelt","The Trifluorophosphonium Ion, PF~3~H^+^, Preparation and Structure","Inorganic Chemistry","2000","39","","2784","2786","10.1021/ic991420w","","","0.71069","MoKα","","0.0207","0.0182","","","0.0514","0.0534","","","","","","1.027","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321110","5.6001","0.0001","10.2826","0.0003","12.8116","0.0004","90","","100.291","0.002","90","","725.87","0.03","130","","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Trifluorosulfur(IV)yl-hexafluoroantimonate(V),hydrogenfluoride","Trifluorosulfur(IV)yl-hexafluoroantimonate(V),hydrogenfluoride","","- F10 H S Sb -","- F10 H S Sb -","- F40 H4 S4 Sb4 -","4","1","","Ralf Küster; Thomas Drews; Konrad Seppelt","The Trifluorophosphonium Ion, PF~3~H^+^, Preparation and Structure","Inorganic Chemistry","2000","39","","2784","2786","10.1021/ic991420w","","","0.71073","MoKα","","0.0234","0.019","","","0.046","0.0474","","","","","","1.056","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321111","11.721","0.002","21.801","0.003","12.027","0.005","90","","111.93","0.02","90","","2850.9","1.4","163","2","163","2","","","","","","","synthesis","7","P 1 21 1","P 2yb","4","","","","- C50 H61 Co3 F12 N15 O2 P2 -","- C50 H32 Co3 F12 N15 O2 P2 -","- C100 H64 Co6 F24 N30 O4 P4 -","2","1","","Rodolphe Clérac; F. Albert Cotton; Kim R. Dunbar; Tongbu Lu; Carlos A. Murillo; Xiaoping Wang","New Linear Tricobalt Complex of Di(2-pyridyl)amide (dpa), [Co3(dpa)4(CH3CN)2][PF6]2","Inorganic Chemistry","2000","39","","3065","3070","10.1021/ic000042o","","","0.71073","MoKα","","0.0552","0.0425","","0.117","0.1104","","","","1.077","1.082","1.082","","","","","has coordinates,has disorder","179314","2020-10-21","18:00:00",""
"4321112","12.498","0.002","12.5101","0.0005","19.913","0.001","99.072","0.004","104.152","0.007","101.106","0.007","2893","0.5","213","2","213","2","","","","","","","synthesis","6","P -1","-P 1","2","","","","- C50 H47 Co3 F12 N17 P2 -","- C50 H32 Co3 F12 N17 P2 -","- C100 H64 Co6 F24 N34 P4 -","2","1","","Rodolphe Clérac; F. Albert Cotton; Kim R. Dunbar; Tongbu Lu; Carlos A. Murillo; Xiaoping Wang","New Linear Tricobalt Complex of Di(2-pyridyl)amide (dpa), [Co3(dpa)4(CH3CN)2][PF6]2","Inorganic Chemistry","2000","39","","3065","3070","10.1021/ic000042o","","","0.71073","MoKα","","0.0684","0.0611","","0.1594","0.1522","","","","1.075","1.099","1.099","","","","","has coordinates,has disorder","179314","2020-10-21","18:00:00",""
"4321113","11.7576","0.0007","21.9059","0.0006","12.0621","0.0005","90","","111.883","0.003","90","","2882.9","0.2","213","2","213","2","","","","","","","synthesis","7","P 1 21 1","P 2yb","4","","","","- C50 H61 Co3 F12 N15 O2 P2 -","- C50 H32 Co3 F12 N15 O2 P2 -","- C100 H64 Co6 F24 N30 O4 P4 -","2","1","","Rodolphe Clérac; F. Albert Cotton; Kim R. Dunbar; Tongbu Lu; Carlos A. Murillo; Xiaoping Wang","New Linear Tricobalt Complex of Di(2-pyridyl)amide (dpa), [Co3(dpa)4(CH3CN)2][PF6]2","Inorganic Chemistry","2000","39","","3065","3070","10.1021/ic000042o","","","0.71073","MoKα","","0.0445","0.0428","","0.116","0.1141","","","","1.128","1.129","1.129","","","","","has coordinates,has disorder","179314","2020-10-21","18:00:00",""
"4321114","10.478","0.0001","11.2563","0.0002","11.9827","0.0002","71.574","0.001","85.084","0.001","70.705","0.001","1265.23","0.03","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C46 H42 Hg2 K N O6 S6 -","- C46 H42 Hg2 K N O6 S6 -","- C46 H42 Hg2 K N O6 S6 -","1","0.5","","Theivanayagam C. Deivaraj; Philip A.W. Dean; Jagadese Jayapurandara Vittal","Synthesis, Structure, and multi-NMR studies of (Me~4~N)[A{M(SC{O}Ph)~3~] (A = Na, M = Hg; A = K, M = Cd or Hg)","Inorganic Chemistry","2000","39","","3071","3074","10.1021/ic0000810","","","0.71073","MoKα","","0.0385","0.0323","","0.0945","0.0864","","","","1.037","1.069","1.069","","","","","has coordinates,has disorder","179314","2020-10-21","18:00:00",""
"4321115","10.667","0.0002","11.1522","0.0002","11.9294","0.0002","71.782","0.001","85.208","0.001","69.418","0.001","1261.4","0.04","293","2","293","2","","","","","","","see text","7","P -1","-P 1","2","","","","- C46 H42 Cd2 K N O6 S6 -","- C46 H42 Cd2 K N O6 S6 -","- C46 H42 Cd2 K N O6 S6 -","1","0.5","","Theivanayagam C. Deivaraj; Philip A.W. Dean; Jagadese Jayapurandara Vittal","Synthesis, Structure, and multi-NMR studies of (Me~4~N)[A{M(SC{O}Ph)~3~] (A = Na, M = Hg; A = K, M = Cd or Hg)","Inorganic Chemistry","2000","39","","3071","3074","10.1021/ic0000810","","","0.71073","MoKα","","0.0875","0.0599","","0.1464","0.1304","","","","1.05","1.097","1.097","","","","","has coordinates,has disorder","179314","2020-10-21","18:00:00",""
"4321116","10.84","0.002","10.946","0.004","12.006","0.003","72.18","0.02","86.75","0.02","67.43","0.02","1249.4","0.6","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C46 H42 Hg2 N Na O6 S6 -","- C46 H42 Hg2 N Na O6 S6 -","- C46 H42 Hg2 N Na O6 S6 -","1","0.5","","Theivanayagam C. Deivaraj; Philip A.W. Dean; Jagadese Jayapurandara Vittal","Synthesis, Structure, and multi-NMR studies of (Me~4~N)[A{M(SC{O}Ph)~3~] (A = Na, M = Hg; A = K, M = Cd or Hg)","Inorganic Chemistry","2000","39","","3071","3074","10.1021/ic0000810","","","0.71073","MoKα","","0.0462","0.0346","","0.0933","0.0797","","","","0.994","1.025","1.025","","","","","has coordinates,has disorder","179314","2020-10-21","18:00:00",""
"4321117","22.2928","0.0019","22.2928","0.0019","8.5121","0.001","90","","90","","120","","3663.5","0.6","150","","150","","","","","","","","see text","5","P 65","P 65","170","","","","- C22 H18 Cl2 N6 Ru -","- C22 H18 Cl2 N6 Ru -","- C132 H108 Cl12 N36 Ru6 -","6","1","","Aldrik H. Velders; Huub Kooijman; Anthony L. Spek; Jaap G. Haasnoot; Dick de Vos; Jan Reedijk","Strong Differences in the in Vitro Cytotoxicity of Three Isomeric Dichlorobis(2-phenylazopyridine)ruthenium(II) Complexes","Inorganic Chemistry","2000","39","","2966","2967","10.1021/ic000167t","","","0.71073","MoKα","","0.0653","0.0557","","","0.1026","0.1055","","","","","","1.19","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321118","6.8228","0.0009","8.2658","0.0011","6.5236","0.0007","90","","90","","90","","367.9","0.08","293","2","293","2","","","","","","","","3","P n a 21","P 2c -2n","33","","","","- Al Li Se2 -","- Al Li Se2 -","- Al4 Li4 Se8 -","4","1","","Joonyeong Kim; Timothy Hughbanks","Synthesis and Structures of New Ternary Aluminum Chalcogenides: LiAlSe2, α-LiAlTe2, and β-LiAlTe2","Inorganic Chemistry","2000","39","","3092","3097","10.1021/ic000210c","","","0.71073","MoKα","","0.0477","0.0307","","0.069","0.0642","","","","1.101","1.17","1.17","","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321119","6.3517","0.0004","6.3517","0.0004","11.6904","0.0009","90","","90","","90","","471.64","0.06","293","2","293","2","","","","","","","","3","I -4 2 d","I -4 2bw","122","","","","- Al Li Te2 -","- Al Li Te2 -","- Al4 Li4 Te8 -","4","0.25","","Joonyeong Kim; Timothy Hughbanks","Synthesis and Structures of New Ternary Aluminum Chalcogenides: LiAlSe2, α-LiAlTe2, and β-LiAlTe2","Inorganic Chemistry","2000","39","","3092","3097","10.1021/ic000210c","","","0.71073","MoKα","","0.021","0.0193","","0.0433","0.0424","","","","1.194","1.228","1.228","","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321120","4.481","0.0006","4.481","0.0006","7.096","0.001","90","","90","","120","","123.39","0.03","293","2","293","2","","","","","","","","3","P 3 m 1","P 3 -2""","156","","","","- Al Li Te2 -","- Al Li Te2 -","- Al Li Te2 -","1","0.166667","","Joonyeong Kim; Timothy Hughbanks","Synthesis and Structures of New Ternary Aluminum Chalcogenides: LiAlSe2, α-LiAlTe2, and β-LiAlTe2","Inorganic Chemistry","2000","39","","3092","3097","10.1021/ic000210c","","","0.71073","MoKα","","0.0262","0.0199","","0.0433","0.0378","","","","1.173","1.175","1.175","","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321121","18.6374","0.0005","21.8098","0.0005","20.1559","0.0006","90","","104.992","0.0013","90","","7914.1","0.4","193","","193","","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C172 H148 Cl8 N4 O4 P8 Pd2 Re4 S4 -","- C172 H148 Cl8 N4 O4 P8 Pd2 Re4 S4 -","- C344 H296 Cl16 N8 O8 P16 Pd4 Re8 S8 -","2","0.5","","Shan-Ming Kuang; Phillip E. Fanwick; Richard A. Walton","Involvement of Multiply Bonded Dirhenium Complexes in Mixed-Metal Assemblies. Isolation and Characterization of a New Type of Re4Pd2 Cluster","Inorganic Chemistry","2000","39","","2968","2969","10.1021/ic000250g","","","0.71073","MO-Kα","","","0.064","","","","0.116","","","","","","1.092","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321122","10.2378","0.0005","32.182","0.002","10.7492","0.0006","90","","95.832","0.001","90","","3523.2","0.3","223","2","223","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- Cs4 P5 Se17 Th2 -","- Cs4 P5 Se17 Th2 -","- Cs16 P20 Se68 Th8 -","4","1","","Paula M. Briggs Piccoli; Kent D. Abney; Jon R. Schoonover; Peter K. Dorhout","Synthesis and Structural Characterization of Quaternary Thorium Selenophosphates: A2ThP3Se9 (A = K, Rb) and Cs4Th2P5Se17","Inorganic Chemistry","2000","39","","2970","2976","10.1021/ic990767w","","","0.71073","MoKα","","0.0321","0.0262","","0.0626","0.0585","","","","1.148","1.136","1.136","","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321123","10.5369","0.0005","16.6914","0.0008","10.2864","0.0005","107.614","0.001","92.059","0.001","90.409","0.001","1722.89","0.14","223","2","223","2","","","","","","","","4","P 1","P 1","1","","","","- P6 Rb4 Se18 Th2 -","- P6 Rb4 Se18 Th2 -","- P12 Rb8 Se36 Th4 -","2","2","","Paula M. Briggs Piccoli; Kent D. Abney; Jon R. Schoonover; Peter K. Dorhout","Synthesis and Structural Characterization of Quaternary Thorium Selenophosphates: A2ThP3Se9 (A = K, Rb) and Cs4Th2P5Se17","Inorganic Chemistry","2000","39","","2970","2976","10.1021/ic990767w","","","0.71073","MoKα","","0.0549","0.0476","","0.1238","0.1146","","","","1.012","1.018","1.018","","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321124","10.4582","0.0005","16.5384","0.0008","10.2245","0.0005","107.637","0.001","91.652","0.001","90.343","0.001","1684.42","0.14","293","2","223","2","","","","","","","","4","P -1","-P 1","2","","","","- K2 P3 Se9 Th -","- K2 P3 Se9 Th -","- K8 P12 Se36 Th4 -","4","2","","Paula M. Briggs Piccoli; Kent D. Abney; Jon R. Schoonover; Peter K. Dorhout","Synthesis and Structural Characterization of Quaternary Thorium Selenophosphates: A2ThP3Se9 (A = K, Rb) and Cs4Th2P5Se17","Inorganic Chemistry","2000","39","","2970","2976","10.1021/ic990767w","","","0.71073","MoKα","","0.0645","0.0589","","0.1552","0.1463","","","","0.92","0.941","0.941","","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321125","8.892","0.003","9.369","0.004","16.337","0.008","73.72","0.04","83.01","0.04","64.81","0.03","1182.2","0.9","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C28 H56 N6026 P3 -","- C28 H56 N6 O26 P6 -","- C28 H56 N6 O26 P6 -","1","0.5","","Carmen Anda; Antoni Llobet; Victoria Salvado; Joseph Reibenspies; Ramunas J. Motekaitis; Arthur E. Martell","A Systematic Evaluation of Molecular Recognition Phenomena. 1. Interaction between Phosphates and Nucleotides with Hexaazamacrocyclic Ligands Containing m-Xylylic Spacers","Inorganic Chemistry","2000","39","","2986","2999","10.1021/ic990818p","","","0.71073","MoKa","","0.0645","0.0477","","0.1354","1161","","","","1.03","1.05","1.05","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321126","9.14","0.002","11.058","0.002","14.175","0.002","99.013","0.005","104.728","0.007","102.992","0.007","1314.9","0.4","298","","298","","","","","","","","","6","P -1","-P 1","2","","","","- C41.96 H43.48 Cl4 N8 O9.01 V2 -","- C58 H28 Cl6 N8 O20 V2 -","- C58 H28 Cl6 N8 O20 V2 -","1","0.5","","Antonis T. Vlahos; Evagelos I. Tolis; Catherine P. Raptopoulou; Alexandros Tsohos; Michael P. Sigalas; Aris Terzis; Themistoklis A. Kabanos","Model Investigations of Vanadium-Protein Interactions: Novel Vanadium(III) and Oxovanadium(IV) Compounds with the Diamidate Ligand 1,2-Bis(2-pyridinecarboxamide)benzene (H2bpb)","Inorganic Chemistry","2000","39","","2977","2985","10.1021/ic990837z","","","1.5418","CuKα","","0.1068","0.0638","","0.1976","0.1627","","","","1.066","1.08","1.08","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321127","11.054","0.005","11.407","0.005","16.964","0.007","90","","93.21","0.01","90","","2135.7","1.6","298","","298","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C19.36 H18.7 N4 O4.99 S0.5 V -","- C19.569 H14 N4 O5.098 S0.604 V -","- C78.276 H56 N16 O20.392 S2.416 V4 -","4","1","","Antonis T. Vlahos; Evagelos I. Tolis; Catherine P. Raptopoulou; Alexandros Tsohos; Michael P. Sigalas; Aris Terzis; Themistoklis A. Kabanos","Model Investigations of Vanadium-Protein Interactions: Novel Vanadium(III) and Oxovanadium(IV) Compounds with the Diamidate Ligand 1,2-Bis(2-pyridinecarboxamide)benzene (H2bpb)","Inorganic Chemistry","2000","39","","2977","2985","10.1021/ic990837z","","","0.71073","MoKα","","0.0585","0.0485","","0.1512","0.1398","","","","1.05","1.07","1.07","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321128","9.496","0.007","12.455","0.007","10.043","0.006","90","","97.23","0.04","90","","1178.4","1.3","213","2","213","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C16 H34 N7 P3 -","- C16 H34 N7 P3 -","- C32 H68 N14 P6 -","2","0.5","","Ingo Schranz; Luke P. Grocholl; Lothar Stahl; Richard J. Staples; Alison Johnson","Syntheses and Structures of Heterobicyclic Bis(tert-butylamido)cyclodiphosph(III)azane Compounds Having Phosphorus(III) and Arsenic(III) Centers","Inorganic Chemistry","2000","39","","3037","3041","10.1021/ic991405r","","","0.71073","MoKα","","0.081","0.0499","","","0.1073","0.1216","","","","","","1.039","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321129","9.688","0.003","11.873","0.003","9.975","0.003","90","","97.8","0.03","90","","1136.8","0.6","213","2","213","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C16 H34 As Cl N4 P2 -","- C16 H34 As Cl N4 P2 -","- C32 H68 As2 Cl2 N8 P4 -","2","0.5","","Ingo Schranz; Luke P. Grocholl; Lothar Stahl; Richard J. Staples; Alison Johnson","Syntheses and Structures of Heterobicyclic Bis(tert-butylamido)cyclodiphosph(III)azane Compounds Having Phosphorus(III) and Arsenic(III) Centers","Inorganic Chemistry","2000","39","","3037","3041","10.1021/ic991405r","","","0.71073","MoKα","","0.0404","0.0326","","0.0865","0.0813","","","","1.05","1.06","1.06","","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321130","8.7419","0.0008","12.5122","0.0012","14.5978","0.0014","110.737","0.001","95.742","0.002","103.286","0.002","1424.1","0.2","294","2","294","2","","","","","","","","7","P -1","-P 1","2","","","","- C30 H26 Cl2 Cu N2 Na0 O7 -","- C30 H26 Cl2 Cu N2 O7 -","- C60 H52 Cl4 Cu2 N4 O14 -","2","1","","George Psomas; Catherine P. Raptopoulou; Lykourgos Iordanidis; Catherine Dendrinou-Samara; Vassilis Tangoulis; Dimitris P. Kessissoglou","Structurally Diverse Copper(II)-Carboxylato Complexes: Neutral and Ionic Mononuclear Structures and a Novel Binuclear Structure","Inorganic Chemistry","2000","39","","3042","3048","10.1021/ic991476q","","","0.71069","MoKα","","0.0878","0.0464","","","0.0839","0.0971","","","","","","0.552","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321131","19.743","0.003","12.6777","0.0011","19.896","0.003","90","","91.019","0.015","90","","4979.1","1.2","160","2","160","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C29 H71 O19 P3 S Ti4 -","- C29 H71 O19 P3 S Ti4 -","- C116 H284 O76 P12 S4 Ti16 -","4","1","","Michael Mehring; Gilles Guerrero; Françoise Dahan; P. Hubert Mutin; André Vioux","Syntheses, Characterizations, and Single-Crystal X-ray Structures of Soluble Titanium Alkoxide Phosphonates","Inorganic Chemistry","2000","39","","3325","3332","10.1021/ic000002k","","","0.71073","MoKα","","0.0344","0.0218","","","0.0451","0.0488","","","","","","0.909","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321132","14.1115","0.0017","19.819","0.002","21.784","0.003","92.677","0.016","92.369","0.016","92.074","0.015","6076.2","1.3","160","2","140","2","","","","","","","","5","P -1","-P 1","2","","","","- C40 H92 O20 P4 Ti4 -","- C40 H92 O20 P4 Ti4 -","- C160 H368 O80 P16 Ti16 -","4","2","","Michael Mehring; Gilles Guerrero; Françoise Dahan; P. Hubert Mutin; André Vioux","Syntheses, Characterizations, and Single-Crystal X-ray Structures of Soluble Titanium Alkoxide Phosphonates","Inorganic Chemistry","2000","39","","3325","3332","10.1021/ic000002k","","","0.71073","MoKα","","0.0569","0.0304","","","0.0548","0.0601","","","","","","0.817","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321133","10.2523","0.0009","12.2626","0.0011","12.3615","0.0011","69.041","0.002","65.653","0.002","87.789","0.002","1311.3","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Vanadium phosphate","Diammoniumbis(triaquovanadyl)aquovanadylbis(vanadyldiphosphate) trihydrate'","","- H28 N2 O31 P4 V5 -","- N O5.6 P0.8 V -","- N10 O56 P8 V10 -","10","5","","Junghwan Do; Ranko P. Bontchev; Allan J. Jacobson","A Hydrothermal Investigation of the 1/2V~2~O~5~-H~2~C~2~O~4~ / H~3~PO~4~ / NH~4~OH System: Synthesis and Structures of (NH~4~)VOPO~4~1.5H~2~O, (NH~4~) (NH~4~)~0.5~VOPO~4~1.5H~2~O, (NH~4~)~2~[VO(H~2~O)~3~]~2~[VO(H~2~O)][VO(PO~4~)~2~]~2~3H~2~O, and (NH~4~)~2~[VO(HPO~4~)]~2~(C~2~O~4~)H~2~O","Inorganic Chemistry","2000","39","","3230","3237","10.1021/ic0000303","","","0.71073","MoKα","","0.0991","0.0715","","0.1767","0.1592","","","","1.149","1.277","1.277","","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321134","17.735","0.002","6.418","0.0006","22.839","0.002","90","","102.017","0.002","90","","2542.6","0.4","293","2","293","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","Vanadium oxalatophosphate","Diammoniumbis(vanadylhydrogenphosphate)oxalatehydrate","","- C0.75 H6 N0.75 O6.38 P0.75 V0.75 -","- C0.75 N3 O5.25 P0.75 V0.75 -","- C12 N48 O84 P12 V12 -","16","2","","Junghwan Do; Ranko P. Bontchev; Allan J. Jacobson","A Hydrothermal Investigation of the 1/2V~2~O~5~-H~2~C~2~O~4~ / H~3~PO~4~ / NH~4~OH System: Synthesis and Structures of (NH~4~)VOPO~4~1.5H~2~O, (NH~4~) (NH~4~)~0.5~VOPO~4~1.5H~2~O, (NH~4~)~2~[VO(H~2~O)~3~]~2~[VO(H~2~O)][VO(PO~4~)~2~]~2~3H~2~O, and (NH~4~)~2~[VO(HPO~4~)]~2~(C~2~O~4~)H~2~O","Inorganic Chemistry","2000","39","","3230","3237","10.1021/ic0000303","","","0.71073","MoKα","","0.1209","0.0577","","0.1383","0.1077","","","","1.161","1.478","1.478","","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321135","16.523","0.005","27.418","0.005","18.163","0.003","90","","93.48","0.02","90","","8213","3","213","2","213","2","","","","","","","synthesized","7","P 1 21/n 1","-P 2yn","14","","Tetrakis(2,6-di(phenylimino)piperidinato)dimolybdenum(III,III) bis(tetrafluoroborate)","","- C82 H89 B2 F8 Mo2 N17 O -","- C82 H64 B2 F8 Mo2 N17 O -","- C328 H256 B8 F32 Mo8 N68 O4 -","4","1","","F. Albert Cotton; Carlos A. Murillo; Hong-Cai Zhou","Oxidative Scission of a Mo-Mo Quadruple Bond","Inorganic Chemistry","2000","39","","3261","3264","10.1021/ic000092t","","","0.71073","MoKα","","0.0634","0.0535","","0.1472","0.131","","","","1.077","1.082","1.082","","","","","has coordinates,has disorder","179314","2020-10-21","18:00:00",""
"4321136","17.1891","0.0009","17.8073","0.001","24.21","0.002","90","","106.403","0.004","90","","7108.9","0.8","213","2","213","2","","","","","","","synthesized","7","C 1 2/c 1","-C 2yc","15","none","Tetrakis(2,6-di(phenylimino)piperidinatodimolybdenum(II,III) hexafluorophosphate","","- C70 H68 Cl4 F6 Mo2 N12 P -","- C70.12 Cl4 F6 Mo2 N12 P -","- C280.48 Cl16 F24 Mo8 N48 P4 -","4","0.5","","F. Albert Cotton; Carlos A. Murillo; Hong-Cai Zhou","Oxidative Scission of a Mo-Mo Quadruple Bond","Inorganic Chemistry","2000","39","","3261","3264","10.1021/ic000092t","","","0.71073","MoKα","","0.1046","0.0862","","0.2343","0.2069","","","","1.075","1.067","1.067","","","","","has coordinates,has disorder","179314","2020-10-21","18:00:00",""
"4321137","14.409","0.005","7.511","0.003","20.163","0.007","90","","109.62","0.01","90","","2055.5","1.3","300","2","300","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H18 Cl2 Cu N4 O8 -","- C16 H18 Cl2 Cu N4 O8 -","- C64 H72 Cl8 Cu4 N16 O32 -","4","1","","Jürgen Lange; Horst Elias; Helmut Paulus; Jörg Müller; Ulrich Weser","Copper(II) and Copper(I) Complexes with an Open-Chain N4 Schiff Base Ligand Modeling CuZn Superoxide Dismutase: Structural and Spectroscopic Characterization and Kinetics of Electron Transfer","Inorganic Chemistry","2000","39","","3342","3349","10.1021/ic000097q","","","0.71069","MoKα","","0.0686","0.0572","","0.1802","0.1567","","","","1.035","1.04","1.04","","","","","has coordinates,has disorder","179314","2020-10-21","18:00:00",""
"4321138","10.354","0.002","13.14","0.003","15.668","0.003","96.52","0.01","94.65","0.01","91.91","0.01","2108.9","0.8","299","2","299","2","","","","","","","","6","P -1","-P 1","2","","","","- C35 H43 Cl2 Cu2 N9 O9 -","- C35 H43 Cl2 Cu2 N9 O9 -","- C70 H86 Cl4 Cu4 N18 O18 -","2","1","","Jürgen Lange; Horst Elias; Helmut Paulus; Jörg Müller; Ulrich Weser","Copper(II) and Copper(I) Complexes with an Open-Chain N4 Schiff Base Ligand Modeling CuZn Superoxide Dismutase: Structural and Spectroscopic Characterization and Kinetics of Electron Transfer","Inorganic Chemistry","2000","39","","3342","3349","10.1021/ic000097q","","","0.71069","MoKα","","0.0559","0.0466","","0.1477","0.1319","","","","1.081","1.069","1.069","","","","","has coordinates,has disorder","179314","2020-10-21","18:00:00",""
"4321139","15.946","0.003","15.685","0.003","30.523","0.005","90","","90","","90","","7634","2","100","2","100","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C37.5 H52 Fe N11 O2 -","- C37.5 H52 Fe N11 O2 -","- C300 H416 Fe8 N88 O16 -","8","2","","Sujit K. Dutta; Udo Beckmann; Eckhard Bill; Thomas Weyhermüller; Karl Wieghardt","1,2-Bis(pyridine-2-carboxamido)benzenate(2-), (bpb)2-: A Noninnocent Ligand. Syntheses, Structures, and Mechanisms of Formation of [(n-Bu)4N][FeIV2(μ-N)(bpb)2(X)2] (X = CN-, N3-) and the Electronic Structures of [MIII(bpbox1)(CN)2] (M = Co, Fe)","Inorganic Chemistry","2000","39","","3355","3364","10.1021/ic0001107","","","0.71073","MoKα","","0.0801","0.0526","","0.1295","0.1161","","","","1.012","1.057","1.057","","","","","has coordinates","278158","2022-09-26","15:28:11",""
"4321140","8.942","0.001","14.111","0.002","15.707","0.002","90","","102.53","0.02","90","","1934.7","0.5","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H12 Fe N6 Na O2 -","- C20 H12 Fe N6 Na O2 -","- C80 H48 Fe4 N24 Na4 O8 -","4","1","","Sujit K. Dutta; Udo Beckmann; Eckhard Bill; Thomas Weyhermüller; Karl Wieghardt","1,2-Bis(pyridine-2-carboxamido)benzenate(2-), (bpb)2-: A Noninnocent Ligand. Syntheses, Structures, and Mechanisms of Formation of [(n-Bu)4N][FeIV2(μ-N)(bpb)2(X)2] (X = CN-, N3-) and the Electronic Structures of [MIII(bpbox1)(CN)2] (M = Co, Fe)","Inorganic Chemistry","2000","39","","3355","3364","10.1021/ic0001107","","","0.71073","MoKα","","0.0453","0.032","","0.0881","0.0833","","","","1.059","1.153","1.153","","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321141","8.176","0.001","17.006","0.002","19.286","0.002","90","","97.88","0.02","90","","2656.2","0.5","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C23 H22 Cl2 Co N6 Na O5 -","- C23 H22 Cl2 Co N6 Na O5 -","- C92 H88 Cl8 Co4 N24 Na4 O20 -","4","1","","Sujit K. Dutta; Udo Beckmann; Eckhard Bill; Thomas Weyhermüller; Karl Wieghardt","1,2-Bis(pyridine-2-carboxamido)benzenate(2-), (bpb)2-: A Noninnocent Ligand. Syntheses, Structures, and Mechanisms of Formation of [(n-Bu)4N][FeIV2(μ-N)(bpb)2(X)2] (X = CN-, N3-) and the Electronic Structures of [MIII(bpbox1)(CN)2] (M = Co, Fe)","Inorganic Chemistry","2000","39","","3355","3364","10.1021/ic0001107","","","0.71073","MoKα","","0.1379","0.0742","","0.1966","0.163","","","","1.016","1.127","1.127","","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321142","13.176","0.002","17.145","0.003","23.102","0.004","90","","103.91","0.02","90","","5065.8","1.5","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C54 H60 Fe2 N12 O4 -","- C54 H60 Fe2 N12 O4 -","- C216 H240 Fe8 N48 O16 -","4","1","","Sujit K. Dutta; Udo Beckmann; Eckhard Bill; Thomas Weyhermüller; Karl Wieghardt","1,2-Bis(pyridine-2-carboxamido)benzenate(2-), (bpb)2-: A Noninnocent Ligand. Syntheses, Structures, and Mechanisms of Formation of [(n-Bu)4N][FeIV2(μ-N)(bpb)2(X)2] (X = CN-, N3-) and the Electronic Structures of [MIII(bpbox1)(CN)2] (M = Co, Fe)","Inorganic Chemistry","2000","39","","3355","3364","10.1021/ic0001107","","","0.71073","MoKα","","0.0944","0.0609","","0.1915","0.1706","","","","1.096","1.219","1.219","","","","","has coordinates,has disorder","179314","2020-10-21","18:00:00",""
"4321143","9.4431","0.0007","13.9919","0.0009","20.4449","0.0014","77.19","0.02","85.91","0.02","74.43","0.02","2537.2","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C52 H60 Fe2 N16 O4 -","- C52 H60 Fe2 N16 O4 -","- C104 H120 Fe4 N32 O8 -","2","1","","Sujit K. Dutta; Udo Beckmann; Eckhard Bill; Thomas Weyhermüller; Karl Wieghardt","1,2-Bis(pyridine-2-carboxamido)benzenate(2-), (bpb)2-: A Noninnocent Ligand. Syntheses, Structures, and Mechanisms of Formation of [(n-Bu)4N][FeIV2(μ-N)(bpb)2(X)2] (X = CN-, N3-) and the Electronic Structures of [MIII(bpbox1)(CN)2] (M = Co, Fe)","Inorganic Chemistry","2000","39","","3355","3364","10.1021/ic0001107","","","0.71073","MoKα","","0.0832","0.0442","","0.1049","0.0966","","","","0.968","1.112","1.112","","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321144","17.28","0.005","17.74","0.005","32.37","0.005","90","","90","","90","","9923","4","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","methylcobalamin solvated","","- C63 H127.2 Co N13 O32.1 P -","- C63 H109 Co N13 O32.1 P -","- C252 H436 Co4 N52 O128.4 P4 -","4","1","","Lucio Randaccio; Michela Furlan; Silvano Geremia; Miroslav Šlouf; Ivana Srnova; Daniele Toffoli","Similarities and Differences between Cobalamins and Cobaloximes. Accurate Structural Determination of Methylcobalamin and of LiCl- and KCl-Containing Cyanocobalamins by Synchrotron Radiation","Inorganic Chemistry","2000","39","","3403","3413","10.1021/ic0001199","","","0.8","synchrotron","","0.0898","0.0834","","","0.2312","0.2398","","","","","","1.05","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321145","15.36","0.001","22.493","0.001","23.83","0.001","90","","90","","90","","8233.1","0.7","100","2","100","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","cyanocobalamin bis(lithiumchloride) solvated","","- C63 H108.4 Cl2 Co Li2 N14 O24.2 P -","- C63 H98 Cl2 Co Li2 N14 O24.2 P -","- C252 H392 Cl8 Co4 Li8 N56 O96.8 P4 -","4","1","","Lucio Randaccio; Michela Furlan; Silvano Geremia; Miroslav Šlouf; Ivana Srnova; Daniele Toffoli","Similarities and Differences between Cobalamins and Cobaloximes. Accurate Structural Determination of Methylcobalamin and of LiCl- and KCl-Containing Cyanocobalamins by Synchrotron Radiation","Inorganic Chemistry","2000","39","","3403","3413","10.1021/ic0001199","","","0.8","synchrotron","","0.0438","0.0435","","","0.1244","0.1247","","","","","","1.011","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321146","16.015","0.005","21.146","0.005","23.843","0.005","90","","90","","90","","8075","4","100","2","100","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","cyanocobalamin (potassiumchloride) solvated","","- C63 H109.2 Cl Co K N14 O24.6 P -","- C63 H95.2 Cl Co K N14 O24.6 P -","- C252 H380.8 Cl4 Co4 K4 N56 O98.4 P4 -","4","1","","Lucio Randaccio; Michela Furlan; Silvano Geremia; Miroslav Šlouf; Ivana Srnova; Daniele Toffoli","Similarities and Differences between Cobalamins and Cobaloximes. Accurate Structural Determination of Methylcobalamin and of LiCl- and KCl-Containing Cyanocobalamins by Synchrotron Radiation","Inorganic Chemistry","2000","39","","3403","3413","10.1021/ic0001199","","","0.8","synchrotron","","0.0951","0.0733","","","0.1973","0.2111","","","","","","1.039","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4321147","27.7201","0.001","38.5569","0.0014","65.349","0.002","90","","99.937","0.001","90","","68797","4","163","2","163","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- H668 M Na6 O814 P R6 -","- Mo120 O613 Pr6 -","- Mo480 O2452 Pr24 -","4","1","","Achim Müller; Christian Beugholt; Hartmut Bögge; Marc Schmidtmann","Influencing the Size of Giant Rings by Manipulating Their Curvatures: Na6[Mo120O366(H2O)48H12{Pr(H2O)5}6].(~200H2O) with Open Shell Metal Centers at the Cluster Surface","Inorganic Chemistry","2000","39","","3112","3113","10.1021/ic000168l","","","0.71073","MoKα","","0.194","0.0884","","","0.1963","0.2609","","","","","","1.082","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321148","9.4737","0.0005","22.1444","0.0012","17.2192","0.0013","90","","105.936","0.001","90","","3473.6","0.4","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","Vanadium borophosphate","","","- C5.7 H9.5 B N3.8 O13.75 P2.5 V2 -","- C5.7 H9.5 B N3.8 O13.75 P2.5 V2 -","- C45.6 H76 B8 N30.4 O110 P20 V16 -","8","1","","Ranko P. Bontchev; Junghwan Do; Allan J. Jacobson","Synthesis and Characterization of the Layered Vanadium Borophosphate (Imidazolium)3.8(H3O)1.2[(VO)4(BO)2(PO4)5].0.3H2O","Inorganic Chemistry","2000","39","","3320","3324","10.1021/ic000177u","","","0.71073","MoKα","","0.0608","0.0493","","0.1134","0.1079","","","","1.115","1.149","1.149","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4321149","7.8354","0.0011","4.1721","0.0006","10.2985","0.0014","90","","90","","90","","336.66","0.08","153","2","153","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","lanthanum asernic telluride","","- As La Te -","- As La Te -","- As4 La4 Te4 -","4","0.5","","Fu Qiang Huang; Paul Brazis; Carl R. Kannewurf; James A. Ibers","Syntheses, Structures, and Physical Properties of LnAsTe (Ln = La, Pr, Sm, Gd, Dy, Er)","Inorganic Chemistry","2000","39","","3176","3180","10.1021/ic000187v","","","0.71073","MoKα","","0.027","0.0261","","","0.0858","0.0862","","","","","","1.662","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321150","7.728","0.002","4.12","0.0011","10.137","0.003","90","","90","","90","","322.76","0.15","153","2","153","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","Praseodymium Asernic Telluride","","- As Pr Te -","- As Pr Te -","- As4 Pr4 Te4 -","4","0.5","","Fu Qiang Huang; Paul Brazis; Carl R. Kannewurf; James A. Ibers","Syntheses, Structures, and Physical Properties of LnAsTe (Ln = La, Pr, Sm, Gd, Dy, Er)","Inorganic Chemistry","2000","39","","3176","3180","10.1021/ic000187v","","","0.71073","MoKα","","0.0261","0.0246","","","0.0591","0.0599","","","","","","1.114","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321151","7.618","0.0016","4.0821","0.0009","9.991","0.002","90","","90","","90","","310.69","0.11","293","2","153","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","Samarium Asernic Telluride","","- As Sm Te -","- As Sm Te -","- As4 Sm4 Te4 -","4","0.5","","Fu Qiang Huang; Paul Brazis; Carl R. Kannewurf; James A. Ibers","Syntheses, Structures, and Physical Properties of LnAsTe (Ln = La, Pr, Sm, Gd, Dy, Er)","Inorganic Chemistry","2000","39","","3176","3180","10.1021/ic000187v","","","0.71073","MoKα","","0.0287","0.027","","","0.0664","0.067","","","","","","1.28","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321152","7.5611","0.0015","4.051","0.0008","9.92","0.002","90","","90","","90","","303.85","0.1","153","2","153","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","Gadolinium Asernic Telluride","","- As Gd Te -","- As Gd Te -","- As4 Gd4 Te4 -","4","0.5","","Fu Qiang Huang; Paul Brazis; Carl R. Kannewurf; James A. Ibers","Syntheses, Structures, and Physical Properties of LnAsTe (Ln = La, Pr, Sm, Gd, Dy, Er)","Inorganic Chemistry","2000","39","","3176","3180","10.1021/ic000187v","","","0.71073","MoKα","","0.0357","0.0354","","","0.0815","0.0819","","","","","","1.339","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321153","7.4951","0.0013","4.0246","0.0007","9.8288","0.0017","90","","90","","90","","296.48","0.09","153","2","153","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","Dysprosium Asernic Telluride","","- As Dy Te -","- As Dy Te -","- As4 Dy4 Te4 -","4","0.5","","Fu Qiang Huang; Paul Brazis; Carl R. Kannewurf; James A. Ibers","Syntheses, Structures, and Physical Properties of LnAsTe (Ln = La, Pr, Sm, Gd, Dy, Er)","Inorganic Chemistry","2000","39","","3176","3180","10.1021/ic000187v","","","0.71073","MoKα","","0.0238","0.0237","","","0.062","0.062","","","","","","1.232","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321154","7.4478","0.0001","4.0078","0.0001","9.7552","0.0002","90","","90","","90","","291.186","0.01","153","2","153","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","Erbium Asernic Telluride","","- As Er Te -","- As Er Te -","- As4 Er4 Te4 -","4","0.5","","Fu Qiang Huang; Paul Brazis; Carl R. Kannewurf; James A. Ibers","Syntheses, Structures, and Physical Properties of LnAsTe (Ln = La, Pr, Sm, Gd, Dy, Er)","Inorganic Chemistry","2000","39","","3176","3180","10.1021/ic000187v","","","0.71073","MoKα","","0.0338","0.0279","","","0.0687","0.0706","","","","","","1.063","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321155","14.2926","0.0008","19.9373","0.0013","23.585","0.002","90","","97.242","0.004","90","","6667.1","0.8","213","2","213","2","","","","","","","synthesized","6","P 1 21/c 1","-P 2ybc","14","","Tetrakas(2,6-diphenyliminopiperidinato)chlorotrichromium(II)chloride","","- C69.5 H68 Cl5 Cr3 N12 O0.5 -","- C69.5 H52 Cl4.96 Cr3 N12 O0.5 -","- C278 H208 Cl19.84 Cr12 N48 O2 -","4","1","","Rodolphe Clérac; F. Albert Cotton; Lee M. Daniels; Kim R. Dunbar; Carlos A. Murillo; Hong-Cai Zhou","Linear Trichromium Complexes with the Anion of 2,6-Di(phenylimino)piperidine","Inorganic Chemistry","2000","39","","3414","3417","10.1021/ic0001964","","","0.71073","MoKα","","0.1106","0.0841","","0.2312","0.1955","","","","1.076","1.111","1.111","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4321156","14.1399","0.0006","14.1399","0.0006","20.8219","0.0007","90","","90","","90","","4163.1","0.3","213","2","213","2","","","","","","","synthesis","7","P 4/n :2","-P 4a","85","","Tetrakas(2,6-diphenyliminopiperidinato)acetonitriletrichrmium(II) bis(hexafluorophosphate)","","- C78 H81 Cr3 F12 N17 O P2 -","- C78 H40 Cr3 F12 N17 O P2 -","- C156 H80 Cr6 F24 N34 O2 P4 -","2","0.25","","Rodolphe Clérac; F. Albert Cotton; Lee M. Daniels; Kim R. Dunbar; Carlos A. Murillo; Hong-Cai Zhou","Linear Trichromium Complexes with the Anion of 2,6-Di(phenylimino)piperidine","Inorganic Chemistry","2000","39","","3414","3417","10.1021/ic0001964","","","0.71073","MoKα","","0.0701","0.0651","","0.2084","0.1976","","","","1.08","1.097","1.097","","","","","has coordinates,has disorder","179314","2020-10-21","18:00:00",""
"4321157","14.1545","0.0007","14.1545","0.0007","19.873","0.0012","90","","90","","90","","3981.6","0.4","213","2","213","2","","","","","","","synthesized","6","P 4/n :2","-P 4a","85","","[Cr3(DPhIP)4(CH3CN)(F)](BF4)2,5(CH3CN)","","- C80 H82 B2 Cr3 F9 N18 -","- C78.86 H64 B3 Cr3 F9 N17.708 -","- C157.72 H128 B6 Cr6 F18 N35.416 -","2","0.25","","Rodolphe Clérac; F. Albert Cotton; Lee M. Daniels; Kim R. Dunbar; Carlos A. Murillo; Hong-Cai Zhou","Linear Trichromium Complexes with the Anion of 2,6-Di(phenylimino)piperidine","Inorganic Chemistry","2000","39","","3414","3417","10.1021/ic0001964","","","0.71073","MoKα","","0.0727","0.0638","","0.1769","0.1628","","","","1.108","1.113","1.113","","","","","has coordinates,has disorder","179314","2020-10-21","18:00:00",""
"4321158","11.39","0.002","11.905","0.002","17.09","0.002","108.041","0.002","97.446","0.002","103.226","0.003","2094.1","0.6","165.2","","165.2","","","","","","","","","6","P -1","-P 1","2","","","","- C52 H43 Li N4 O S -","- C52 H43 Li N4 O S -","- C104 H86 Li2 N8 O2 S2 -","2","1","","Andreas Gebauer; Joseph A. R. Schmidt; John Arnold","Synthesis, Characterization, and Properties of a Lithium 21-Thiaporphyrin Complex","Inorganic Chemistry","2000","39","","3424","3427","10.1021/ic000202w","","","0.7107","MoKα","","0.191","0.0562","","","0.0421","","","","","1.036","1.036","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321159","20.5516","0.0004","8.8077","0.0003","19.7461","0.0003","90","","101.174","0.002","90","","3506.53","0.15","178.2","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C46 H33 N3 S -","- C46 H33 N3 S -","- C184 H132 N12 S4 -","4","1","","Andreas Gebauer; Joseph A. R. Schmidt; John Arnold","Synthesis, Characterization, and Properties of a Lithium 21-Thiaporphyrin Complex","Inorganic Chemistry","2000","39","","3424","3427","10.1021/ic000202w","","","0.7107","MoKα","","0.161","0.0731","","","0.0775","","","","","2.075","2.075","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321160","5.2051","0.0008","12.736","0.002","9.773","0.001","90","","95.162","0.006","90","","645.25","0.16","296.2","","296.2","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C10 H12 Ag2 N2 O6 -","- C10 H12 Ag2 N2 O6 -","- C20 H24 Ag4 N4 O12 -","2","1","","Nomiya, Kenji; Takahashi, Satoshi; Noguchi, Ryusuke; Nemoto, Satomi; Takayama, Toshio; Oda, Munehiro","Synthesis and Characterization of Water-Soluble Silver(I) Complexes with l-Histidine (H2his) and (S)-(-)-2-Pyrrolidone-5-carboxylic Acid (H2pyrrld) Showing a Wide Spectrum of Effective Antibacterial and Antifungal Activities. Crystal Structures of Chiral Helical Polymers [Ag(Hhis)]n and {[Ag(Hpyrrld)]2}n in the Solid State","Inorganic Chemistry","2000","39","","3301","3311","10.1021/ic990526o","","","0.7107","MoKα","","0.0262","0.026","","0.03","","0.03","","","1.091","","","1.09","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4321161","18.4624","0.0017","13.7194","0.0017","20.3557","0.0019","90","","90","","90","","5156","0.9","298","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","1a","","","- C24 H26 N2 O6 P2 Pd -","- C24 H26 N2 O6 P2 Pd -","- C192 H208 N16 O48 P16 Pd8 -","8","1","","Kent D. Redwine; William L. Wilson; Donald G. Moses; Vincent J. Catalano; John H. Nelson","Cooperative Diastereoselectivity of Palladium- and Platinum-Promoted Intramolecular [4+2] Diels-Alder Cycloaddition Reactions of 3,4-Dimethyl-1-phenylphosphole","Inorganic Chemistry","2000","39","","3392","3402","10.1021/ic990885j","","","0.71073","MoKα","","0.0528","0.0361","","","0.0836","0.0917","","","","","","1.02","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321162","18.537","0.002","13.727","0.0009","20.392","0.002","90","","90","","90","","5188.9","0.8","298","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","1b","","","- C24 H26 N2 O6 P2 Pt -","- C24 H26 N2 O6 P2 Pt -","- C192 H208 N16 O48 P16 Pt8 -","8","1","","Kent D. Redwine; William L. Wilson; Donald G. Moses; Vincent J. Catalano; John H. Nelson","Cooperative Diastereoselectivity of Palladium- and Platinum-Promoted Intramolecular [4+2] Diels-Alder Cycloaddition Reactions of 3,4-Dimethyl-1-phenylphosphole","Inorganic Chemistry","2000","39","","3392","3402","10.1021/ic990885j","","","0.71073","MoKα","","0.1315","0.0529","","0.1104","0.0857","","","","1.001","1.128","1.128","","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321163","17.973","0.0011","10.6282","0.0007","19.7413","0.0015","90","","97.789","0.005","90","","3736.2","0.4","298","2","298","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","2a","","","- C34 H44 B2 F8 N2 O2 P2 Pd -","- C34 H44 B2 F8 N2 O2 P2 Pd -","- C136 H176 B8 F32 N8 O8 P8 Pd4 -","4","0.5","","Kent D. Redwine; William L. Wilson; Donald G. Moses; Vincent J. Catalano; John H. Nelson","Cooperative Diastereoselectivity of Palladium- and Platinum-Promoted Intramolecular [4+2] Diels-Alder Cycloaddition Reactions of 3,4-Dimethyl-1-phenylphosphole","Inorganic Chemistry","2000","39","","3392","3402","10.1021/ic990885j","","","0.71073","MoKα","","0.0628","0.044","","0.1236","0.1122","","","","1.038","1.075","1.075","","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321164","17.961","0.007","10.583","0.003","19.869","0.004","90","","98.7","0.03","90","","3733","2","298","2","298","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","2b","","","- C34 H44 B2 F8 N2 O2 P2 Pt -","- C34 H44 B2 F8 N2 O2 P2 Pt -","- C136 H176 B8 F32 N8 O8 P8 Pt4 -","4","0.5","","Kent D. Redwine; William L. Wilson; Donald G. Moses; Vincent J. Catalano; John H. Nelson","Cooperative Diastereoselectivity of Palladium- and Platinum-Promoted Intramolecular [4+2] Diels-Alder Cycloaddition Reactions of 3,4-Dimethyl-1-phenylphosphole","Inorganic Chemistry","2000","39","","3392","3402","10.1021/ic990885j","","","0.71073","MoKα","","0.0425","0.0339","","0.0796","0.0762","","","","1.045","1.07","1.07","","","","","has coordinates,has disorder","179314","2020-10-21","18:00:00",""
"4321165","10.1466","0.0014","23.168","0.002","23.346","0.002","90","","91.374","0.009","90","","5486.5","1","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","3b","","","- C55 H58 B2 F8 O P4 Pt -","- C55 H58 B2 F8 O P4 Pt -","- C220 H232 B8 F32 O4 P16 Pt4 -","4","1","","Kent D. Redwine; William L. Wilson; Donald G. Moses; Vincent J. Catalano; John H. Nelson","Cooperative Diastereoselectivity of Palladium- and Platinum-Promoted Intramolecular [4+2] Diels-Alder Cycloaddition Reactions of 3,4-Dimethyl-1-phenylphosphole","Inorganic Chemistry","2000","39","","3392","3402","10.1021/ic990885j","","","0.71073","MoKα","","0.1734","0.0739","","0.1481","0.1136","","","","1.005","1.143","1.143","","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321166","12.0801","0.0009","26.66","0.002","19.2852","0.0012","90","","95.341","0.007","90","","6183.9","0.8","298","2","298","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","4a","","","- C61 H70 B2 F8 O3 P4 Pd -","- C61 H70 B2 F8 O3 P4 Pd -","- C244 H280 B8 F32 O12 P16 Pd4 -","4","0.5","","Kent D. Redwine; William L. Wilson; Donald G. Moses; Vincent J. Catalano; John H. Nelson","Cooperative Diastereoselectivity of Palladium- and Platinum-Promoted Intramolecular [4+2] Diels-Alder Cycloaddition Reactions of 3,4-Dimethyl-1-phenylphosphole","Inorganic Chemistry","2000","39","","3392","3402","10.1021/ic990885j","","","0.71073","MoKα","","0.1179","0.066","","0.1958","0.1579","","","","1.085","1.155","1.155","","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321167","12.066","0.002","26.57","0.003","19.35","0.002","90","","95.197","0.008","90","","6178","1.4","298","2","298","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","4b","","","- C61 H70 B2 F8 O3 P4 Pt -","- C61 H70 B2 F8 O3 P4 Pt -","- C244 H280 B8 F32 O12 P16 Pt4 -","4","0.5","","Kent D. Redwine; William L. Wilson; Donald G. Moses; Vincent J. Catalano; John H. Nelson","Cooperative Diastereoselectivity of Palladium- and Platinum-Promoted Intramolecular [4+2] Diels-Alder Cycloaddition Reactions of 3,4-Dimethyl-1-phenylphosphole","Inorganic Chemistry","2000","39","","3392","3402","10.1021/ic990885j","","","0.71073","MoKα","","0.0837","0.0609","","0.1721","0.1548","","","","1.034","1.073","1.073","","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321168","10.5377","0.0008","12.055","0.002","18.4919","0.0017","103.653","0.011","97.355","0.007","109.097","0.011","2102.5","0.5","298","2","298","2","","","","","","","","8","P -1","-P 1","2","5b","","","- C41 H46 B2 F8 N2 O P2 Pt -","- C41 H46 B2 F8 N2 O P2 Pt -","- C82 H92 B4 F16 N4 O2 P4 Pt2 -","2","1","","Kent D. Redwine; William L. Wilson; Donald G. Moses; Vincent J. Catalano; John H. Nelson","Cooperative Diastereoselectivity of Palladium- and Platinum-Promoted Intramolecular [4+2] Diels-Alder Cycloaddition Reactions of 3,4-Dimethyl-1-phenylphosphole","Inorganic Chemistry","2000","39","","3392","3402","10.1021/ic990885j","","","0.71073","MoKα","","0.0534","0.0397","","","0.0928","0.1026","","","","","","1.107","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321169","10.384","0.002","11.912","0.0011","21.26","0.002","74.937","0.006","83.354","0.009","84.189","0.009","2515.4","0.6","298","2","298","2","","","","","","","","7","P -1","-P 1","2","6a","","","- C44 H53 F12 N2 O2 P4 Pd -","- C44 H53 F12 N2 O2 P4 Pd -","- C88 H106 F24 N4 O4 P8 Pd2 -","2","1","","Kent D. Redwine; William L. Wilson; Donald G. Moses; Vincent J. Catalano; John H. Nelson","Cooperative Diastereoselectivity of Palladium- and Platinum-Promoted Intramolecular [4+2] Diels-Alder Cycloaddition Reactions of 3,4-Dimethyl-1-phenylphosphole","Inorganic Chemistry","2000","39","","3392","3402","10.1021/ic990885j","","","0.71073","MoKα","","0.0832","0.0638","","0.203","0.1852","","","","0.99","1.03","1.03","","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321170","14.198","0.002","22.422","0.002","12.019","0.002","90","","90","","90","","3826.2","0.9","293.2","","293.2","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C37 H40 N12 Ni O7 -","- C37 H40 N12 Ni O7 -","- C148 H160 N48 Ni4 O28 -","4","1","","Ikuko Katsuki; Naohide Matsumoto; Masaaki Kojima","Synthesis, Characterization, and Spontaneous Resolution of Chiral Nickel(II) Complexes with the Tripod Ligand Tris[2-(((2-phenylimidazol-4-yl)methylidene)amino)ethyl]amine","Inorganic Chemistry","2000","39","","3350","3354","10.1021/ic9909025","","","0.7107","MoKα","","0.0452","0.0452","","","0.0455","0.0429","","","","","","0.974","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321171","14.206","0.002","22.735","0.003","12.696","0.003","90","","90","","90","","4100.5","1.3","293.2","","293.2","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C37 H40 Cl2 N10 Ni O9 -","- C37 H40 Cl2 N10 Ni O9 -","- C148 H160 Cl8 N40 Ni4 O36 -","4","1","","Ikuko Katsuki; Naohide Matsumoto; Masaaki Kojima","Synthesis, Characterization, and Spontaneous Resolution of Chiral Nickel(II) Complexes with the Tripod Ligand Tris[2-(((2-phenylimidazol-4-yl)methylidene)amino)ethyl]amine","Inorganic Chemistry","2000","39","","3350","3354","10.1021/ic9909025","","","0.7107","MoKα","","0.0697","0.0697","","","0.0435","0.0435","","","","","","2.46","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321172","14.191","0.005","16.048","0.004","13.692","0.004","115.25","0.02","111.07","0.03","64.75","0.02","2490","1.4","293.2","","293.2","","","","","","","","","5","P -1","-P 1","2","","","","- C50 H58 N10 Ni O10 -","- C50 H46 N10 Ni O10 -","- C100 H92 N20 Ni2 O20 -","2","1","","Ikuko Katsuki; Naohide Matsumoto; Masaaki Kojima","Synthesis, Characterization, and Spontaneous Resolution of Chiral Nickel(II) Complexes with the Tripod Ligand Tris[2-(((2-phenylimidazol-4-yl)methylidene)amino)ethyl]amine","Inorganic Chemistry","2000","39","","3350","3354","10.1021/ic9909025","","","0.7107","MoKα","","0.0874","0.0874","","","0.0862","0.0862","","","","","","2.615","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321173","29.9377","0.0014","29.9377","0.0014","29.9377","0.0014","90","","90","","90","","26832","2","158","","158","","","","","","","","","4","P a -3","-P 2ac 2ab 3","205","","","","- C115 H150 Eu8 O26 -","- C114 H108 Eu8 O26 -","- C912 H864 Eu64 O208 -","8","0.333333","","William J. Evans; Michael A. Greci; Joseph W. Ziller","Reactivity of ""Eu(OiPr)2"" with Phenols: Formation of Linear Eu3, Square Pyramidal Eu5, Cubic Eu8, and Capped Cubic Eu9 Polymetallic Europium Complexes","Inorganic Chemistry","2000","39","","3213","3220","10.1021/ic9909532","","","0.71073","MoKα","","0.2071","0.1086","","","0.2515","0.3037","","","","","","1.038","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321174","19.268","0.003","27.986","0.004","18.794","0.003","90","","90.545","0.013","90","","10134","3","153","","153","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C90 H129 Eu5 N9 O11 -","- C90 H129 Eu5 N9 O11 -","- C360 H516 Eu20 N36 O44 -","4","0.5","","William J. Evans; Michael A. Greci; Joseph W. Ziller","Reactivity of ""Eu(OiPr)2"" with Phenols: Formation of Linear Eu3, Square Pyramidal Eu5, Cubic Eu8, and Capped Cubic Eu9 Polymetallic Europium Complexes","Inorganic Chemistry","2000","39","","3213","3220","10.1021/ic9909532","","","0.71073","MoKα","","0.1085","0.0672","","","0.1728","0.2048","","","","","","0.973","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321175","12.0468","0.0006","11.9257","0.0006","24.2959","0.0013","90","","100.119","0.001","90","","3436.2","0.3","158","2","158","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C72 H102 Eu3 O12 -","- C72 H102 Eu3 O12 -","- C144 H204 Eu6 O24 -","2","0.5","","William J. Evans; Michael A. Greci; Joseph W. Ziller","Reactivity of ""Eu(OiPr)2"" with Phenols: Formation of Linear Eu3, Square Pyramidal Eu5, Cubic Eu8, and Capped Cubic Eu9 Polymetallic Europium Complexes","Inorganic Chemistry","2000","39","","3213","3220","10.1021/ic9909532","","","0.71073","MoKα","","0.1428","0.102","","","0.2361","0.2609","","","","","","1.223","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321176","15.4628","0.0007","16.0409","0.0007","26.0241","0.0012","90","","99.863","0.001","90","","6359.5","0.5","158","2","158","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C124 H168 Eu8 O26 -","- C124 H168 Eu8 O26 -","- C248 H336 Eu16 O52 -","2","0.5","","William J. Evans; Michael A. Greci; Joseph W. Ziller","Reactivity of ""Eu(OiPr)2"" with Phenols: Formation of Linear Eu3, Square Pyramidal Eu5, Cubic Eu8, and Capped Cubic Eu9 Polymetallic Europium Complexes","Inorganic Chemistry","2000","39","","3213","3220","10.1021/ic9909532","","","0.71073","MoKα","","0.0771","0.0527","","","0.0934","0.1023","","","","","","1.151","","","","has coordinates,has disorder","179314","2020-10-21","18:00:00",""
"4321177","14.9535","0.0007","28.3557","0.0013","30.0169","0.0014","89.046","0.001","86.618","0.001","80.75","0.001","12540","1","158","2","158","2","","","","","","","","4","P -1","-P 1","2","","","","- C240.5 H338 Eu18 O51 -","- C240.5 H319.5 Eu18 O51 -","- C481 H639 Eu36 O102 -","2","1","","William J. Evans; Michael A. Greci; Joseph W. Ziller","Reactivity of ""Eu(OiPr)2"" with Phenols: Formation of Linear Eu3, Square Pyramidal Eu5, Cubic Eu8, and Capped Cubic Eu9 Polymetallic Europium Complexes","Inorganic Chemistry","2000","39","","3213","3220","10.1021/ic9909532","","","0.71073","MoKα","","0.154","0.0941","","","0.137","0.1572","","","","","","1.184","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4321178","23.008","0.005","23.367","0.005","12.863","0.003","90","","90","","90","","6916","3","293","2","293","2","","","","","","","","7","P b a a","-P 2a 2b","54","","","","- C64 H80 B N4 O8 P4 Re -","- C64.364 H78.22 B0.911 Cl0.089 N3.822 O8 P4 Re -","- C257.456 H312.88 B3.644 Cl0.356 N15.288 O32 P16 Re4 -","4","0.5","","Gabriele Albertin; Stefano Antoniutti; Alessia Bacchi; Emilio Bordignon; Francesca Miani; Giancarlo Pelizzi","Diazo Complexes of Rhenium: Preparations and Crystal Structures of the Bis(dinitrogen), [Re(N2)2{PPh(OEt)2}4][BPh4] and Methyldiazenido [ReCl(CH3N2)(CH3NHNH2){PPh(OEt)2}3][BPh4] Derivatives","Inorganic Chemistry","2000","39","","3283","3293","10.1021/ic990970r","","","0.71069","MoKα","","0.1629","0.0463","","","0.1047","0.1367","","","","","","0.92","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4321179","15.396","0.005","16.986","0.005","11.56","0.005","93.959","0.005","93.988","0.005","93.087","0.005","3003.4","1.8","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C56 H74 B Cl N4 O6 P3 Re -","- C56 H74 B Cl N4 O6 P3 Re -","- C112 H148 B2 Cl2 N8 O12 P6 Re2 -","2","1","","Gabriele Albertin; Stefano Antoniutti; Alessia Bacchi; Emilio Bordignon; Francesca Miani; Giancarlo Pelizzi","Diazo Complexes of Rhenium: Preparations and Crystal Structures of the Bis(dinitrogen), [Re(N2)2{PPh(OEt)2}4][BPh4] and Methyldiazenido [ReCl(CH3N2)(CH3NHNH2){PPh(OEt)2}3][BPh4] Derivatives","Inorganic Chemistry","2000","39","","3283","3293","10.1021/ic990970r","","","0.71069","MoKα","","0.0623","0.034","","","0.0661","0.0725","","","","","","0.889","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4321180","19.613","0.005","20.101","0.005","19.918","0.005","90","","115.12","0.02","90","","7110","3","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C70 H85 B Cl N2 O8 P4 Re -","- C71 H85 B Cl N2 O8 P4 Re -","- C284 H340 B4 Cl4 N8 O32 P16 Re4 -","4","1","","Gabriele Albertin; Stefano Antoniutti; Alessia Bacchi; Emilio Bordignon; Francesca Miani; Giancarlo Pelizzi","Diazo Complexes of Rhenium: Preparations and Crystal Structures of the Bis(dinitrogen), [Re(N2)2{PPh(OEt)2}4][BPh4] and Methyldiazenido [ReCl(CH3N2)(CH3NHNH2){PPh(OEt)2}3][BPh4] Derivatives","Inorganic Chemistry","2000","39","","3283","3293","10.1021/ic990970r","","","0.71069","MoKα","","0.1902","0.0414","","","0.0768","0.1205","","","","","","1.03","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321181","8.7137","0.0008","13.5493","0.0014","11.8847","0.0012","90","","106.179","0.002","90","","1347.6","0.2","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H32 Cl4 Cu2 N8 -","- C20 H32 Cl4 Cu2 N8 -","- C40 H64 Cl8 Cu4 N16 -","2","0.5","","V. Chandrasekhar; S. Kingsley; A. Vij; K. C. Lam; A. L. Rheingold","Formation of a Tetranuclear Copper (II) Cluster Assembled by Metal-Assisted Hydrolysis and Desulfurization of Bis(3,5-dimethylpyrazolyl)methylphosphine Sulfide, MeP(S)(3,5-Me2Pz)2#","Inorganic Chemistry","2000","39","","3238","3242","10.1021/ic991255k","","","0.71073","MoKα","","0.0543","0.0455","","","0.1235","0.1286","","","","","","1.057","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321182","15.2552","0.0001","8.7364","0.0002","21.449","0.0003","90","","93.349","0.001","90","","2853.74","0.08","213","2","213","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C11 H17 N4 P S -","- C11 H17 N4 P S -","- C88 H136 N32 P8 S8 -","8","1","","V. Chandrasekhar; S. Kingsley; A. Vij; K. C. Lam; A. L. Rheingold","Formation of a Tetranuclear Copper (II) Cluster Assembled by Metal-Assisted Hydrolysis and Desulfurization of Bis(3,5-dimethylpyrazolyl)methylphosphine Sulfide, MeP(S)(3,5-Me2Pz)2#","Inorganic Chemistry","2000","39","","3238","3242","10.1021/ic991255k","","","0.71073","MoKα","","0.0442","0.0379","","","0.0884","0.0919","","","","","","1.105","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4321183","12.5964","0.0004","15.773","0.004","13.9781","0.0004","90","","116.628","0.001","90","","2482.6","0.6","213","2","213","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C32 H48 Cl4 Cu4 N12 O6 P2 -","- C32 H48 Cl4 Cu4 N12 O6 P2 -","- C64 H96 Cl8 Cu8 N24 O12 P4 -","2","0.5","","V. Chandrasekhar; S. Kingsley; A. Vij; K. C. Lam; A. L. Rheingold","Formation of a Tetranuclear Copper (II) Cluster Assembled by Metal-Assisted Hydrolysis and Desulfurization of Bis(3,5-dimethylpyrazolyl)methylphosphine Sulfide, MeP(S)(3,5-Me2Pz)2#","Inorganic Chemistry","2000","39","","3238","3242","10.1021/ic991255k","","","0.71073","MoKα","","0.1199","0.0721","","0.2439","0.182","","","","1.087","","","","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321184","10.658","0.01","32.862","0.006","13.787","0.005","90","0.005","96.47","0.005","90","0.005","4798","5","208","2","208","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C50 H51 B9 Cl N P2 -","- C50 H51 B9 Cl N P2 -","- C200 H204 B36 Cl4 N4 P8 -","4","2","","Katja Siegburg; Wilhelm Preetz","Synthesis of Monohalogeno Derivatives of closo-[B~9~H~9~]^2-^. Crystal Structures of (Ph~4~P)~2~[1-XB~9~H~8~]*CH~3~CN (X = Cl, Br, I)","Inorganic Chemistry","2000","39","","3280","3282","10.1021/ic9913334","","","0.71069","MoKα","","0.0482","0.0388","","","0.1137","0.1361","","","","","","1.052","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321185","10.673","0.002","32.875","0.003","13.802","0.004","90","","96.47","0.014","90","","4811.9","1.7","208","2","208","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C100 H102 B18 Br2 N2 P4 -","- C100 H102 B18 Br2 N2 P4 -","- C200 H204 B36 Br4 N4 P8 -","2","1","","Katja Siegburg; Wilhelm Preetz","Synthesis of Monohalogeno Derivatives of closo-[B~9~H~9~]^2-^. Crystal Structures of (Ph~4~P)~2~[1-XB~9~H~8~]*CH~3~CN (X = Cl, Br, I)","Inorganic Chemistry","2000","39","","3280","3282","10.1021/ic9913334","","","0.71069","MoKα","","0.0496","0.0364","","","0.0983","0.1123","","","","","","1.062","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321186","10.551","0.005","13.582","0.005","33.441","0.005","90","0.005","94","0.005","90","0.005","4781","3","193","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C50 H51 B9 I N P2 -","- C50 H51 B9 I N P2 -","- C200 H204 B36 I4 N4 P8 -","4","1","","Katja Siegburg; Wilhelm Preetz","Synthesis of Monohalogeno Derivatives of closo-[B~9~H~9~]^2-^. Crystal Structures of (Ph~4~P)~2~[1-XB~9~H~8~]*CH~3~CN (X = Cl, Br, I)","Inorganic Chemistry","2000","39","","3280","3282","10.1021/ic9913334","","","0.71069","MoKα","","0.1422","0.0947","","","0.2468","0.2816","","","","","","1.075","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321187","16.2654","0.0007","19.833","0.0009","21.6504","0.001","90","","91.773","0.001","90","","6980.9","0.5","158","","158","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C66 H107 B O11 Yb Zr2 -","- C66 H107 B O11 Yb Zr2 -","- C264 H428 B4 O44 Yb4 Zr8 -","4","1","","William J. Evans; Matthew A. Johnston; Joseph W. Ziller","Synthesis of Arene-Soluble Dizirconium Nonaisopropoxide Lanthanide Cations Involving Divalent Ytterbium","Inorganic Chemistry","2000","39","","3421","3423","10.1021/ic991437e","","","0.71073","MoKα","","0.0337","0.0254","","","0.0559","0.0588","","","","","","1.033","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321188","12.2071","0.0007","13.8855","0.0008","16.9832","0.001","69.584","0.001","71.204","0.001","84.64","0.001","2553.4","0.3","96","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C45 H35 N9 O21 V8 -","- C45 H33 N9 O21 V8 -","- C90 H66 N18 O42 V16 -","2","1","","Pamela J. Hagrman; Jon Zubieta","Structural Influences of Organonitrogen Ligands on Vanadium Oxide Solids. Hydrothermal Syntheses and Structures of the Terpyridine Vanadates [V2O4(Terpy)2]3[V10O28], [VO2(Terpy)][V4O10], and [V9O22(Terpy)3]","Inorganic Chemistry","2000","39","","3252","3260","10.1021/ic991473d","","","0.71073","MoKα","","0.0569","0.0405","","","0.1014","0.1095","","","","","","1.037","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321189","14.4505","0.0001","15.098","0.002","15.9571","0.0011","106.189","0.003","103.551","0.005","101.31","0.005","3120.3","0.5","213","2","213","2","","","","","","","","8","P -1","-P 1","2","","","","- C61 H56 Ag Au6 B Cl2 F4 N12 -","- C61 H56 Ag Au6 B Cl2 F4 N12 -","- C122 H112 Ag2 Au12 B2 Cl4 F8 N24 -","2","1","","Alfredo Burini; Rita Bravi; John P. Fackler,; Rossana Galassi; Tiffany A. Grant; Mohammad A. Omary; Bianca R. Pietroni; Richard J. Staples","Luminescent Chains Formed from Neutral, Triangular Gold Complexes Sandwiching TlI and AgI. Structures of {Ag([Au(μ-C2,N3-bzim)]3)2}BF4.CH2Cl2, {Tl([Au(μ-C2,N3-bzim)]3)2}PF6.0.5THF (bzim = 1-Benzylimidazolate), and {Tl([Au(μ-C(OEt)NC6H4CH3)]3)2}PF6.THF, with MAu6 (M = Ag+, Tl+) Cluster Cores","Inorganic Chemistry","2000","39","","3158","3165","10.1021/ic991492n","","","0.71073","MoKα","","0.0894","0.0572","","","0.1004","0.1201","","","","","","1.196","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321190","15.2093","0.0001","15.3931","0.0004","16.1599","0.0004","106.018","0.001","101.585","0.002","102.068","0.002","3418.93","0.14","213","2","213","2","","","","","","","","8","P -1","-P 1","2","","","","- C62 H58 Au6 F6 N12 O0.5 P Tl -","- C62 H58 Au6 F6 N12 O0.5 P Tl -","- C124 H116 Au12 F12 N24 O P2 Tl2 -","2","1","","Alfredo Burini; Rita Bravi; John P. Fackler,; Rossana Galassi; Tiffany A. Grant; Mohammad A. Omary; Bianca R. Pietroni; Richard J. Staples","Luminescent Chains Formed from Neutral, Triangular Gold Complexes Sandwiching TlI and AgI. Structures of {Ag([Au(μ-C2,N3-bzim)]3)2}BF4.CH2Cl2, {Tl([Au(μ-C2,N3-bzim)]3)2}PF6.0.5THF (bzim = 1-Benzylimidazolate), and {Tl([Au(μ-C(OEt)NC6H4CH3)]3)2}PF6.THF, with MAu6 (M = Ag+, Tl+) Cluster Cores","Inorganic Chemistry","2000","39","","3158","3165","10.1021/ic991492n","","","0.71073","MoKα","","0.0654","0.0444","","","0.0976","0.101","","","","","","1.127","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321191","16.4136","0.0003","27.6277","0.0004","16.7182","0.0001","90","","105.644","0.001","90","","7300.36","0.18","213","2","213","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C64 H80 Ag Au6 F6 N6 O7 P -","- C64 H80 Ag Au6 F6 N6 O7 P -","- C256 H320 Ag4 Au24 F24 N24 O28 P4 -","4","1","","Alfredo Burini; Rita Bravi; John P. Fackler,; Rossana Galassi; Tiffany A. Grant; Mohammad A. Omary; Bianca R. Pietroni; Richard J. Staples","Luminescent Chains Formed from Neutral, Triangular Gold Complexes Sandwiching TlI and AgI. Structures of {Ag([Au(μ-C2,N3-bzim)]3)2}BF4.CH2Cl2, {Tl([Au(μ-C2,N3-bzim)]3)2}PF6.0.5THF (bzim = 1-Benzylimidazolate), and {Tl([Au(μ-C(OEt)NC6H4CH3)]3)2}PF6.THF, with MAu6 (M = Ag+, Tl+) Cluster Cores","Inorganic Chemistry","2000","39","","3158","3165","10.1021/ic991492n","","","0.71073","MoKα","","0.1329","0.0862","","","0.2207","0.2245","","","","","","4.063","","","","has coordinates,has disorder","179314","2020-10-21","18:00:00",""
"4321192","5.739","0.001","7.671","0.002","9.04","0.001","90","","104.73","0.01","90","","384.9","0.13","296.2","","296.2","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C6 H8 Ag N3 O2 -","- C6 H8 Ag N3 O2 -","- C12 H16 Ag2 N6 O4 -","2","1","","Nomiya, Kenji; Takahashi, Satoshi; Noguchi, Ryusuke; Nemoto, Satomi; Takayama, Toshio; Oda, Munehiro","Synthesis and Characterization of Water-Soluble Silver(I) Complexes with l-Histidine (H2his) and (S)-(-)-2-Pyrrolidone-5-carboxylic Acid (H2pyrrld) Showing a Wide Spectrum of Effective Antibacterial and Antifungal Activities. Crystal Structures of Chiral Helical Polymers [Ag(Hhis)]n and {[Ag(Hpyrrld)]2}n in the Solid State","Inorganic Chemistry","2000","39","","3301","3311","10.1021/ic990526o","","","0.7107","MoKα","","0.0241","0.024","","0.028","","0.028","","","1.289","","","1.29","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4321193","11.836","0.008","12.495","0.009","12.67","0.002","69.09","0.06","78.78","0.06","77.02","0.05","1692.1","1.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C43 H27 N4 O3 Rh -","- C43 H27 N4 O3 Rh -","- C86 H54 N8 O6 Rh2 -","2","1","","Bashyam Sridevi; Seenichamy Jeyaprakash Narayanan; Rohini Rao; Tavarekere K. Chandrashekar; Ulrich Englich; Karin Ruhlandt-Senge","meso-Aryl Smaragdyrins: Novel Anion and Metal Receptors","Inorganic Chemistry","2000","39","","3669","3677","10.1021/ic000031v","","","0.71073","MoKα","","0.0471","0.0303","","","0.0902","0.1047","","","","","","0.832","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321194","11.8783","0.0002","17.3787","0.0004","16.0151","0.0003","90","","109.546","0.001","90","","3115.47","0.11","93","2","93","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C41 H29 Cl N4 O -","- C41 H29 Cl N4 O -","- C164 H116 Cl4 N16 O4 -","4","1","","Bashyam Sridevi; Seenichamy Jeyaprakash Narayanan; Rohini Rao; Tavarekere K. Chandrashekar; Ulrich Englich; Karin Ruhlandt-Senge","meso-Aryl Smaragdyrins: Novel Anion and Metal Receptors","Inorganic Chemistry","2000","39","","3669","3677","10.1021/ic000031v","","","0.71073","MoKα","","0.085","0.0497","","","0.1071","0.1211","","","","","","1.015","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4321195","12.128","0.0002","15.7693","0.0002","16.0488","0.0002","91.9086","0.0009","102.412","0.0007","96.2327","0.0005","2974.8","0.07","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C126 H88 B2 F40 P4 Rh2 S4 -","- C116 H64 B2 F40 P4 Rh2 S4 -","- C116 H64 B2 F40 P4 Rh2 S4 -","1","0.5","","Felicia M. Dixon; Adam H. Eisenberg; Joshua R. Farrell; Chad A. Mirkin; Louise M. Liable-Sands; Arnold L. Rheingold","Neutral Macrocycles via Halide-Induced Ring Opening of Binuclear Condensed Intermediates","Inorganic Chemistry","2000","39","","3432","3433","10.1021/ic000062q","","","0.71073","MoKα","","0.0915","0.0696","","","0.1915","0.2152","","","","","","1.431","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321196","21.1237","0.0003","9.6962","0.0002","35.2862","0.0004","90","","98.513","0.0004","90","","7147.7","0.2","293","2","293","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C72 H68 Cl6 O6 P4 Rh2 -","- C70 H64 Cl2 O6 P4 Rh2 -","- C280 H256 Cl8 O24 P16 Rh8 -","4","0.5","","Felicia M. Dixon; Adam H. Eisenberg; Joshua R. Farrell; Chad A. Mirkin; Louise M. Liable-Sands; Arnold L. Rheingold","Neutral Macrocycles via Halide-Induced Ring Opening of Binuclear Condensed Intermediates","Inorganic Chemistry","2000","39","","3432","3433","10.1021/ic000062q","","","0.71073","MoKα","","0.0931","0.0767","","","0.1807","0.1911","","","","","","1.499","","","","has coordinates","179314","2020-10-21","18:00:00",""
"4321197","11.389","0.0008","15.1604","0.0011","20.34","0.002","90","","94.6132","0.0013","90","","3500.6","0.5","153.2","","153.2","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C72 H64 I2 O4 P4 Rh2 S4 -","- C72 H64 I2 O4 P4 Rh2 S4 -","- C144 H128 I4 O8 P8 Rh4 S8 -","2","0.5","","Felicia M. Dixon; Adam H. Eisenberg; Joshua R. Farrell; Chad A. Mirkin; Louise M. Liable-Sands; Arnold L. Rheingold","Neutral Macrocycles via Halide-Induced Ring Opening of Binuclear Condensed Intermediates","Inorganic Chemistry","2000","39","","3432","3433","10.1021/ic000062q","","","0.7107","MoKα","","0.0895","","","0.074","","","","","0.749","","","1.22","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321198","22.4668","0.0004","16.384","0.0004","26.6089","0.0005","90","","94.02","0.001","90","","9770.5","0.3","298","","","","","","","","","","Local laboratory","6","P 1 21/c 1","-P 2ybc","14","","","","- C92 H128 Cl2 Cu N8 O17 -","- C92.3 H111.5 Cl2 Cu N8 O17 -","- C369.2 H446 Cl8 Cu4 N32 O68 -","4","1","","Loïc Le Clainche; Michel Giorgi; Olivia Reinaud","Novel Biomimetic Calix[6]arene-Based Copper(II) Complexes","Inorganic Chemistry","2000","39","","3436","3437","10.1021/ic000072r","","","0.71073","xray","","","0.075","","","0.118","","","","","3.927","3.927","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321199","14.2523","0.0003","16.0496","0.0004","17.5801","0.0003","112.415","0.0013","105.748","0.0013","99.6078","0.0011","3408.75","0.14","296","","296","","","","","","","","","6","P -1","-P 1","2","","","","- C68 H52 B Cu F24 N4 -","- C68 H52 B Cu F24 N4 -","- C136 H104 B2 Cu2 F48 N8 -","2","1","","Corey T. Cunningham; Jeffrey J. Moore; Kurstan L. H. Cunningham; Phillip E. Fanwick; David R. McMillin","Structural and Photophysical Studies of Cu(NN)2+Systems in the Solid State. Emission at Last from Complexes with Simple 1,10-Phenanthroline Ligands","Inorganic Chemistry","2000","39","","3638","3644","10.1021/ic000082s","","","0.71073","MO-Kα","","","0.093","","","","0.253","","","","","","1.031","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321200","17.4883","0.0004","9.8686","0.0001","26.3747","0.0006","90","","97.7021","0.0008","90","","4510.81","0.15","296","","296","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C56 H52 B Cu N4 -","- C56 H52 B Cu N4 -","- C224 H208 B4 Cu4 N16 -","4","1","","Corey T. Cunningham; Jeffrey J. Moore; Kurstan L. H. Cunningham; Phillip E. Fanwick; David R. McMillin","Structural and Photophysical Studies of Cu(NN)2+Systems in the Solid State. Emission at Last from Complexes with Simple 1,10-Phenanthroline Ligands","Inorganic Chemistry","2000","39","","3638","3644","10.1021/ic000082s","","","0.71073","MO-Kα","","","0.065","","","","0.157","","","","","","1.031","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321201","16.0722","0.0013","8.11","0.0007","16.8937","0.001","90","","93.947","0.005","90","","2196.8","0.3","295","","295","","","","","","","","","6","P 1 2/n 1","-P 2yac","13","","","","- C52 H40 Cu F6 N4 P -","- C52 H40 Cu F6 N4 P -","- C104 H80 Cu2 F12 N8 P2 -","2","0.5","","Corey T. Cunningham; Jeffrey J. Moore; Kurstan L. H. Cunningham; Phillip E. Fanwick; David R. McMillin","Structural and Photophysical Studies of Cu(NN)2+Systems in the Solid State. Emission at Last from Complexes with Simple 1,10-Phenanthroline Ligands","Inorganic Chemistry","2000","39","","3638","3644","10.1021/ic000082s","","","0.71073","MO-Kα","","","0.06","","","","0.139","","","","","","1.067","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321202","12.8486","0.0004","13.7341","0.0004","15.1678","0.0003","99.5819","0.0014","96.7263","0.0013","97.3311","0.0012","2591.32","0.12","296","","296","","","","","","","","","7","P -1","-P 1","2","","","","- C60 H56 Cu F6 N4 O P -","- C60 H56 Cu F6 N4 O P -","- C120 H112 Cu2 F12 N8 O2 P2 -","2","1","","Corey T. Cunningham; Jeffrey J. Moore; Kurstan L. H. Cunningham; Phillip E. Fanwick; David R. McMillin","Structural and Photophysical Studies of Cu(NN)2+Systems in the Solid State. Emission at Last from Complexes with Simple 1,10-Phenanthroline Ligands","Inorganic Chemistry","2000","39","","3638","3644","10.1021/ic000082s","","","0.71073","MO-Kα","","","0.074","","","","0.19","","","","","","1.033","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321203","10.432","0.003","12.291","0.004","18.733","0.004","90","","93.403","0.013","90","","2397.7","1.2","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C H2 B9 Br9 Cs O0.5 -","- C H B9 Br9 Cs O0.5 -","- C4 H4 B36 Br36 Cs4 O2 -","4","1","","Chi-Wing Tsang; Qingchuan Yang; Eric Tung-Po Sze; Thomas C. W. Mak; Dominic T. W. Chan; Zuowei Xie","Synthesis and Structural Characterization of Highly Chlorinated, Brominated, Iodinated, and Methylated Carborane Anions, 1-H-CB9X9-, 1-NH2-CB9X9- (X = Cl, Br, I), and 1-H-CB9(CH3)9-","Inorganic Chemistry","2000","39","","3582","3589","10.1021/ic000137q","","","0.71073","MoKα","","0.1092","0.0841","","","0.1897","0.2071","","","","","","1.099","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321204","12.716","0.003","12.726","0.003","14.638","0.003","90","","90","","90","","2368.8","0.9","296","2","296","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C7 H7 Ag B9 Br9 -","- C7 H7 Ag B9 Br9 -","- C28 H28 Ag4 B36 Br36 -","4","1","","Chi-Wing Tsang; Qingchuan Yang; Eric Tung-Po Sze; Thomas C. W. Mak; Dominic T. W. Chan; Zuowei Xie","Synthesis and Structural Characterization of Highly Chlorinated, Brominated, Iodinated, and Methylated Carborane Anions, 1-H-CB9X9-, 1-NH2-CB9X9- (X = Cl, Br, I), and 1-H-CB9(CH3)9-","Inorganic Chemistry","2000","39","","3582","3589","10.1021/ic000137q","","","0.71073","MoKα","","0.0708","0.0578","","","0.1204","0.1264","","","","","","1.11","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321205","18.848","0.002","16.323","0.002","17.947","0.0016","90","","96.647","0.007","90","","5484.4","1","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C18 H22 Ag3 B18 Br18 N O4 -","- C18 H22 Ag3 B18 Br18 N O4 -","- C72 H88 Ag12 B72 Br72 N4 O16 -","4","1","","Chi-Wing Tsang; Qingchuan Yang; Eric Tung-Po Sze; Thomas C. W. Mak; Dominic T. W. Chan; Zuowei Xie","Synthesis and Structural Characterization of Highly Chlorinated, Brominated, Iodinated, and Methylated Carborane Anions, 1-H-CB9X9-, 1-NH2-CB9X9- (X = Cl, Br, I), and 1-H-CB9(CH3)9-","Inorganic Chemistry","2000","39","","3582","3589","10.1021/ic000137q","","","0.71073","MoKα","","0.1215","0.0851","","","0.133","0.1459","","","","","","1.175","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321206","9.2258","0.0018","13.043","0.003","13.816","0.003","79.17","0.03","72.62","0.03","77.04","0.03","1533.1","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H23 B9 Cl9 N -","- C18 H23 B9 Cl9 N -","- C36 H46 B18 Cl18 N2 -","2","1","","Chi-Wing Tsang; Qingchuan Yang; Eric Tung-Po Sze; Thomas C. W. Mak; Dominic T. W. Chan; Zuowei Xie","Synthesis and Structural Characterization of Highly Chlorinated, Brominated, Iodinated, and Methylated Carborane Anions, 1-H-CB9X9-, 1-NH2-CB9X9- (X = Cl, Br, I), and 1-H-CB9(CH3)9-","Inorganic Chemistry","2000","39","","3582","3589","10.1021/ic000137q","","","0.71073","MoKα","","0.1145","0.0421","","","0.0893","0.1049","","","","","","1.001","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321207","10.7581","0.0014","11.2636","0.0012","12.3578","0.0013","85.986","0.008","71.872","0.008","69.619","0.008","1332.8","0.3","213","2","213","2","","","","","","","synthesis","7","P -1","-P 1","2","","Tetrakis(7-azaindolato)dichlorodichromium(II)","","- C46 H62 Cl2 Cr2 Li2 N14 O6 -","- C46 H62 Cl2 Cr2 Li2 N14 O6 -","- C46 H62 Cl2 Cr2 Li2 N14 O6 -","1","0.5","","F. Albert Cotton; Carlos A. Murillo; Hong-Cai Zhou","A Dichromium(II,II) Compound with a Strong Antiferromagnetic Coupling but Little or No Cr-Cr Bonding","Inorganic Chemistry","2000","39","","3728","3730","10.1021/ic0002115","","","0.71073","MoKα","","0.0672","0.0622","","0.1694","0.1619","","","","1.062","1.076","1.076","","","","","has coordinates,has disorder","179315","2020-10-21","18:00:00",""
"4321208","11.6482","0.0006","13.5772","0.0006","13.5306","0.0007","90","","92.859","0.005","90","","2137.2","0.18","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C36 H48 Cu3 N6 O12 S2 -","- C36 H48 Cu3 N6 O12 S2 -","- C72 H96 Cu6 N12 O24 S4 -","2","0.5","","L. Gutierrez; G. Alzuet; J. A. Real; J. Cano; J. Borrás; A. Castiñeiras","Countercomplementarity and Strong Ferromagnetic Coupling in a Linear Mixed μ-Acetato,μ-Hydroxo Trinuclear Copper(II) Complex. Synthesis, Structure, Magnetic Properties, EPR, and Theoretical Studies","Inorganic Chemistry","2000","39","","3608","3614","10.1021/ic000218m","","","1.54184","CuKα","","0.055","0.0418","","","0.1156","0.1241","","","","","","1.04","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321209","10.543","0.002","11.726","0.003","14.58","0.004","90","","105.04","0.02","90","","1740.7","0.7","203","2","203","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","compound 5","","- C16 H27 Al N2 Te -","- C16 H27 Al N2 Te -","- C64 H108 Al4 N8 Te4 -","4","1","","Chunming Cui; Herbert W. Roesky; Mathias Noltemeyer; Hans-Georg Schmidt","Syntheses and Structures of the Arylaluminum Chalcogenides (ArAlE)2 (Ar = 2-(NEt2CH2)-6-MeC6H3, E = Se; Ar = 2,6-(NEt2CH2)2C6H3, E = Se, Te)","Inorganic Chemistry","2000","39","","3678","3681","10.1021/ic000255d","","","0.71073","MoKα","","0.0289","0.0282","","0.0768","0.0759","","","","1.111","1.119","1.119","","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321210","12.498","0.003","11.556","0.002","14.256","0.003","90","","114.03","0.03","90","","1880.5","0.8","133","2","133","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","compound 3","","- C19 H26 Al N Se -","- C19 H26 Al N Se -","- C76 H104 Al4 N4 Se4 -","4","1","","Chunming Cui; Herbert W. Roesky; Mathias Noltemeyer; Hans-Georg Schmidt","Syntheses and Structures of the Arylaluminum Chalcogenides (ArAlE)2 (Ar = 2-(NEt2CH2)-6-MeC6H3, E = Se; Ar = 2,6-(NEt2CH2)2C6H3, E = Se, Te)","Inorganic Chemistry","2000","39","","3678","3681","10.1021/ic000255d","","","0.71073","MoKα","","0.0627","0.0435","","0.1147","0.1016","","","","1.117","1.133","1.133","","","","","has coordinates","190011","2020-10-21","18:00:00",""
"4321211","10.944","0.004","14.268","0.005","16.091","0.006","90.476","0.006","101.819","0.007","93.738","0.007","2453.5","1.5","158","2","158","2","","","","","","","","5","P 1","P 1","1","","","","- C74 H68 Cu7 N10 O30 -","- C74 H68 Cu7 N10 O30 -","- C74 H68 Cu7 N10 O30 -","1","1","","Jeffrey J. Bodwin; Vincent L. Pecoraro","Preparation of a Chiral, 2-Dimensional Network Containing Metallacrown and Copper Benzoate Building Blocks","Inorganic Chemistry","2000","39","","3434","3435","10.1021/ic000562j","","","0.71073","MoKα","","0.1131","0.0822","","","0.2251","0.2412","","","","","","1.045","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321212","11.3307","0.0006","12.5479","0.0007","15.5153","0.0008","94.513","0.001","105.867","0.001","94.332","0.001","2104.4","0.2","137","2","137","2","","","","","","","synthetic","6","P -1","-P 1","2","Ferric Trencamsam","Ferric[(2-hydroxybenzoyl-2-aminoethyl)- bis(2,3-dihydroxybenzoyl-2-aminoethyl)amine]","","- C54 H50 Fe2 N8 Na4 O16 -","- C76 H70 Fe2 N16 Na4 O24 -","- C76 H70 Fe2 N16 Na4 O24 -","1","0.5","","Seth M. Cohen; Kenneth N. Raymond","Catecholate/Salicylate Heteropodands: Demonstration of a Catecholate to Salicylate Coordination Change1","Inorganic Chemistry","2000","39","","3624","3631","10.1021/ic990608c","","","0.71073","MoKα","","0.0954","0.0778","","0.1873","0.1707","","","","1.175","1.179","1.179","","","","","has coordinates,has disorder","179315","2020-10-21","18:00:00",""
"4321213","11.5475","0.0004","12.1681","0.0004","12.5094","0.0004","109.142","0.001","104.327","0.001","103.636","0.001","1509.38","0.09","170","2","170","2","","","","","","","","7","P -1","-P 1","2","Triprotonated Aluminum Trencamsam","Aluminum(III)[(2-hydroxy-benzoyl-2-aminoethyl)- bis(2,3-dihydroxybenzoyl-2-aminoethyl)amine]","","- C27 H30 Al Br Cl N4 O8 -","- C27 H32 Al Br0.533 Cl0.467 N4 O12.5 -","- C54 H64 Al2 Br1.066 Cl0.934 N8 O25 -","2","1","","Seth M. Cohen; Kenneth N. Raymond","Catecholate/Salicylate Heteropodands: Demonstration of a Catecholate to Salicylate Coordination Change1","Inorganic Chemistry","2000","39","","3624","3631","10.1021/ic990608c","","","0.71073","MoKα","","0.0552","0.045","","0.1208","0.1079","","","","1.167","1.122","1.122","","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321214","34.244","0.002","11.6206","0.0006","21.989","0.0012","90","","101.478","0.001","90","","8575.2","0.8","136","2","136","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Aluminum Trencam(3M)sam","Aluminum(III)[(2-hydroxy-3-methoxybenzoyl-2-aminoethyl)- bis(2,3-dihydroxybenzoyl-2-aminoethyl)amine]","","- C28 H27 Al K2 N4 O9 -","- C36.39 H42.24 Al K2 N6.53 O13.89 -","- C291.12 H337.92 Al8 K16 N52.24 O111.12 -","8","1","","Seth M. Cohen; Kenneth N. Raymond","Catecholate/Salicylate Heteropodands: Demonstration of a Catecholate to Salicylate Coordination Change1","Inorganic Chemistry","2000","39","","3624","3631","10.1021/ic990608c","","","0.71073","MoKα","","0.0921","0.0679","","0.182","0.16","","","","1.077","1.123","1.123","","","","","has coordinates,has disorder","179315","2020-10-21","18:00:00",""
"4321215","9.3851","0.0006","8.2782","0.0005","7.1178","0.0005","90","","94.591","0.001","90","","551.22","0.06","297","2","297","2","","","","","","","synthesis","5","P 1 21/c 1","-P 2ybc","14","","silver(I) cyanide/thiourea complex 1/1","","- C2 H4 Ag N3 S -","- C2 H4 Ag N3 S -","- C8 H16 Ag4 N12 S4 -","4","1","","Fred B. Stocker; Doyle Britton; Victor G. Young","Crystal Structures of a Family of Silver Cyanide Complexes of Thiourea and Substituted Thioureas","Inorganic Chemistry","2000","39","","3479","3484","10.1021/ic990859l","","","0.71073","MoKα","","0.065","0.056","","0.153","0.145","","","","1.056","1.094","1.094","","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321216","7.9485","0.0014","9.431","0.002","12.771","0.002","85.695","0.003","81.21","0.004","77.987","0.002","924.5","0.3","173","2","173","2","","","","","","","synthesis","5","P -1","-P 1","2","","silver(I) cyanide/thiourea complex 1/2","","- C3 H8 Ag N5 S2 -","- C3 H8 Ag N5 S2 -","- C12 H32 Ag4 N20 S8 -","4","2","","Fred B. Stocker; Doyle Britton; Victor G. Young","Crystal Structures of a Family of Silver Cyanide Complexes of Thiourea and Substituted Thioureas","Inorganic Chemistry","2000","39","","3479","3484","10.1021/ic990859l","","","0.71073","MoKα","","0.071","0.058","","0.163","0.156","","","","1.084","1.163","1.163","","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321217","4.113","0.002","9.472","0.004","9.679","0.004","113.918","0.005","98.188","0.006","97.725","0.006","333.4","0.3","173","2","173","2","","","","","","","synthesis","5","P -1","-P 1","2","","silver(I) cyanide/methylthiourea 1/1 complex","","- C3 H6 Ag N3 S -","- C3 H6 Ag N3 S -","- C6 H12 Ag2 N6 S2 -","2","1","","Fred B. Stocker; Doyle Britton; Victor G. Young","Crystal Structures of a Family of Silver Cyanide Complexes of Thiourea and Substituted Thioureas","Inorganic Chemistry","2000","39","","3479","3484","10.1021/ic990859l","","","0.71073","MoKα","","0.023","0.02","","0.05","0.05","","","","1.071","1.097","1.097","","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321218","7.1482","0.0007","14.7764","0.0015","7.3366","0.0007","90","","92.418","0.002","90","","774.24","0.13","298","2","298","2","","","","","","","synthesis","5","P 1 21/m 1","-P 2yb","11","","silver(I) cyanide dimethylthiourea complex 1/1","","- C8 H16 Ag2 N6 S2 -","- C8 H16 Ag2 N6 S2 -","- C16 H32 Ag4 N12 S4 -","2","0.5","","Fred B. Stocker; Doyle Britton; Victor G. Young","Crystal Structures of a Family of Silver Cyanide Complexes of Thiourea and Substituted Thioureas","Inorganic Chemistry","2000","39","","3479","3484","10.1021/ic990859l","","","0.71073","MoKα","","0.054","0.037","","0.076","0.069","","","","1.083","1.106","1.106","","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321219","8.823","0.006","10.209","0.002","10.362","0.002","90","","90","","90","","933.3","0.7","297","2","297","2","","","","","","","synthesis","5","P 21 21 21","P 2ac 2ab","19","","silver(I) cyanide tetramethylthiourea complex 1/1","","- C6 H12 Ag N3 S -","- C6 H12 Ag N3 S -","- C24 H48 Ag4 N12 S4 -","4","1","","Fred B. Stocker; Doyle Britton; Victor G. Young","Crystal Structures of a Family of Silver Cyanide Complexes of Thiourea and Substituted Thioureas","Inorganic Chemistry","2000","39","","3479","3484","10.1021/ic990859l","","","0.71073","MoKα","","0.052","0.038","","0.089","0.081","","","","1.082","1.1","1.1","","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321220","6.8001","0.0002","8.6154","0.0001","13.4747","0.0003","71.72","0.001","79.906","0.001","75.885","0.002","722.76","0.03","293","2","293","2","","","","","","","","5","P -1","-P 1","2","silver cyanide/N,N'-ethylenethiourea complex, 1/1","silver cyanide/2-imidazolidinethione complex, 1/1","","- C8 H12 Ag2 N6 S2 -","- C8 H12 Ag2 N6 S2 -","- C16 H24 Ag4 N12 S4 -","2","1","","Fred B. Stocker; Doyle Britton; Victor G. Young","Crystal Structures of a Family of Silver Cyanide Complexes of Thiourea and Substituted Thioureas","Inorganic Chemistry","2000","39","","3479","3484","10.1021/ic990859l","","","0.71073","MoKα","","0.042","0.038","","0.098","0.094","","","","1.118","1.114","1.114","","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321221","7.494","0.001","11.649","0.002","7.584","0.001","90","","92.03","0.01","90","","661.65","0.17","300","2","300","2","","","","","","","","5","P 1 21 1","P 2yb","4","Compound 2b","","","- C8 H18 N3 S3 V -","- C8 H18 N3 S3 V -","- C16 H36 N6 S6 V2 -","2","1","","Sian C. Davies; David L. Hughes; Zofia Janas; Lucjan B. Jerzykiewicz; Raymond L. Richards; J. Roger Sanders; James E. Silverston; Piotr Sobota","Vanadium Complexes of the N(CH2CH2S)33- and O(CH2CH2S)22- Ligands with Coligands Relevant to Nitrogen Fixation Processes","Inorganic Chemistry","2000","39","","3485","3498","10.1021/ic9909476","","","0.71073","MoKα","","0.0321","0.0311","","0.089","0.0868","","","","1.2","1.183","1.183","","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321222","12.713","0.004","8.57","0.003","15.225","0.003","90","","101.68","0.03","90","","1624.4","0.8","301","2","301","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Compound 2c","","","- C13 H20 N3 S3 V -","- C13 H20 N3 S3 V -","- C52 H80 N12 S12 V4 -","4","1","","Sian C. Davies; David L. Hughes; Zofia Janas; Lucjan B. Jerzykiewicz; Raymond L. Richards; J. Roger Sanders; James E. Silverston; Piotr Sobota","Vanadium Complexes of the N(CH2CH2S)33- and O(CH2CH2S)22- Ligands with Coligands Relevant to Nitrogen Fixation Processes","Inorganic Chemistry","2000","39","","3485","3498","10.1021/ic9909476","","","0.71073","MoKα","","0.0393","0.0338","","0.092","0.0884","","","","1.101","","","","","","","has coordinates,has disorder","179315","2020-10-21","18:00:00",""
"4321223","8.1566","0.0008","13.584","0.002","21.264","0.017","90","","100.32","0.04","90","","2317.9","1.9","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Compound 4","","","- C6 H16 N3 S3 V -","- C5.932 H9.84 N3.012 S3.012 V1.004 -","- C47.456 H78.72 N24.096 S24.096 V8.032 -","8","2","","Sian C. Davies; David L. Hughes; Zofia Janas; Lucjan B. Jerzykiewicz; Raymond L. Richards; J. Roger Sanders; James E. Silverston; Piotr Sobota","Vanadium Complexes of the N(CH2CH2S)33- and O(CH2CH2S)22- Ligands with Coligands Relevant to Nitrogen Fixation Processes","Inorganic Chemistry","2000","39","","3485","3498","10.1021/ic9909476","","","0.71069","MoKα","","0.1248","0.0743","","0.3784","0.2371","","","","1.846","1.846","1.846","","","","","has coordinates,has disorder","179315","2020-10-21","18:00:00",""
"4321224","8.0612","0.0006","16.6065","0.0013","8.5004","0.0012","90","","90","","90","","1137.9","0.2","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Compound 6","","","- C6 H15 N2 S3 V -","- C6 H15 N2 S3 V -","- C24 H60 N8 S12 V4 -","4","1","","Sian C. Davies; David L. Hughes; Zofia Janas; Lucjan B. Jerzykiewicz; Raymond L. Richards; J. Roger Sanders; James E. Silverston; Piotr Sobota","Vanadium Complexes of the N(CH2CH2S)33- and O(CH2CH2S)22- Ligands with Coligands Relevant to Nitrogen Fixation Processes","Inorganic Chemistry","2000","39","","3485","3498","10.1021/ic9909476","","","0.71069","MoKα","","0.085","0.0492","","0.0932","0.0724","","","","1.058","1.095","1.095","","","","","has coordinates,has disorder","179315","2020-10-21","18:00:00",""
"4321225","8.773","0.002","14.345","0.004","15.934","0.003","90","","90","","90","","2005.3","0.8","293","2","293","2","","","","","","","","6","P b c m","-P 2c 2b","57","Compound 7a","","","- C14 H32 Cl N2 S3 V -","- C14.62 H20 Cl N2 S3 V -","- C58.48 H80 Cl4 N8 S12 V4 -","4","0.5","","Sian C. Davies; David L. Hughes; Zofia Janas; Lucjan B. Jerzykiewicz; Raymond L. Richards; J. Roger Sanders; James E. Silverston; Piotr Sobota","Vanadium Complexes of the N(CH2CH2S)33- and O(CH2CH2S)22- Ligands with Coligands Relevant to Nitrogen Fixation Processes","Inorganic Chemistry","2000","39","","3485","3498","10.1021/ic9909476","","","0.71069","MoKα","","0.0534","0.0354","","0.1176","0.1025","","","","1.113","1.152","1.152","","","","","has coordinates,has disorder","179315","2020-10-21","18:00:00",""
"4321226","11.787","0.002","12.09","0.003","17.576","0.004","90","","90","","90","","2504.7","0.9","300","2","300","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","Compound 8a","","","- C8 H15 N2 S3 V -","- C8 H15 N2 S3 V -","- C64 H120 N16 S24 V8 -","8","1","","Sian C. Davies; David L. Hughes; Zofia Janas; Lucjan B. Jerzykiewicz; Raymond L. Richards; J. Roger Sanders; James E. Silverston; Piotr Sobota","Vanadium Complexes of the N(CH2CH2S)33- and O(CH2CH2S)22- Ligands with Coligands Relevant to Nitrogen Fixation Processes","Inorganic Chemistry","2000","39","","3485","3498","10.1021/ic9909476","","","0.71073","MoKα","","0.0372","0.0308","","0.0855","0.0826","","","","1.121","","","","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321227","11.141","0.002","12.035","0.002","12.26","0.003","90","","109.55","0.03","90","","1549.1","0.6","299","2","299","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Compound 9, str. I","","","- C9 H21 N2 S3 Si V -","- C9 H21 N2 S3 Si V -","- C36 H84 N8 S12 Si4 V4 -","4","1","","Sian C. Davies; David L. Hughes; Zofia Janas; Lucjan B. Jerzykiewicz; Raymond L. Richards; J. Roger Sanders; James E. Silverston; Piotr Sobota","Vanadium Complexes of the N(CH2CH2S)33- and O(CH2CH2S)22- Ligands with Coligands Relevant to Nitrogen Fixation Processes","Inorganic Chemistry","2000","39","","3485","3498","10.1021/ic9909476","","","0.71073","MoKα","","0.0547","0.0477","","0.1445","0.1408","","","","1.149","","","","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321228","11.1558","0.0012","12.0401","0.0011","12.272","0.0015","90","","109.545","0.009","90","","1553.4","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Compound 9, str. II","","","- C9 H21 N2 S3 Si V -","- C9 H21 N2 S3 Si V -","- C36 H84 N8 S12 Si4 V4 -","4","1","","Sian C. Davies; David L. Hughes; Zofia Janas; Lucjan B. Jerzykiewicz; Raymond L. Richards; J. Roger Sanders; James E. Silverston; Piotr Sobota","Vanadium Complexes of the N(CH2CH2S)33- and O(CH2CH2S)22- Ligands with Coligands Relevant to Nitrogen Fixation Processes","Inorganic Chemistry","2000","39","","3485","3498","10.1021/ic9909476","","","0.71069","MoKα","","0.1017","0.0399","","0.0837","0.0648","","","","1.039","1.116","1.116","","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321229","7.4103","0.0007","7.6618","0.0009","10.5983","0.0013","86.359","0.009","74.676","0.009","65.116","0.009","525.68","0.11","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Compound 10","","","- C6 H13 N2 S3 V -","- C6 H13 N2 S3 V -","- C12 H26 N4 S6 V2 -","2","1","","Sian C. Davies; David L. Hughes; Zofia Janas; Lucjan B. Jerzykiewicz; Raymond L. Richards; J. Roger Sanders; James E. Silverston; Piotr Sobota","Vanadium Complexes of the N(CH2CH2S)33- and O(CH2CH2S)22- Ligands with Coligands Relevant to Nitrogen Fixation Processes","Inorganic Chemistry","2000","39","","3485","3498","10.1021/ic9909476","","","0.71069","MoKα","","0.0435","0.0308","","0.0825","0.0734","","","","1.046","1.065","1.065","","","","","has coordinates,has disorder","179315","2020-10-21","18:00:00",""
"4321230","13.5753","0.0011","16.3","0.002","7.499","0.0007","90","","102.258","0.007","90","","1621.5","0.3","293","2","293","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","Compound 13d","","","- C12 H16 Cl N2 S3 V -","- C12 H15.568 Cl N2 S3 V -","- C48 H62.272 Cl4 N8 S12 V4 -","4","1","","Sian C. Davies; David L. Hughes; Zofia Janas; Lucjan B. Jerzykiewicz; Raymond L. Richards; J. Roger Sanders; James E. Silverston; Piotr Sobota","Vanadium Complexes of the N(CH2CH2S)33- and O(CH2CH2S)22- Ligands with Coligands Relevant to Nitrogen Fixation Processes","Inorganic Chemistry","2000","39","","3485","3498","10.1021/ic9909476","","","0.71069","MoKα","","0.0348","0.0275","","0.0748","0.0698","","","","1.081","1.11","1.11","","","","","has coordinates,has disorder","179315","2020-10-21","18:00:00",""
"4321231","10.569","0.002","14.996","0.003","11.896","0.003","90","","92.22","0.03","90","","1884","0.7","300","2","300","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Compound 14","","","- C16 H25 O3 S2 V -","- C16 H25 O3 S2 V -","- C64 H100 O12 S8 V4 -","4","1","","Sian C. Davies; David L. Hughes; Zofia Janas; Lucjan B. Jerzykiewicz; Raymond L. Richards; J. Roger Sanders; James E. Silverston; Piotr Sobota","Vanadium Complexes of the N(CH2CH2S)33- and O(CH2CH2S)22- Ligands with Coligands Relevant to Nitrogen Fixation Processes","Inorganic Chemistry","2000","39","","3485","3498","10.1021/ic9909476","","","0.71073","MoKα","","0.0429","0.0343","","0.098","0.0934","","","","1.08","","","","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321232","19.151","0.005","7.606","0.004","31.258","0.009","90","","100.26","0.05","90","","4480","3","299","2","299","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Compound 15","","","- C18 H31 N2 O2 S2 V -","- C18 H31 N2 O2 S2 V -","- C144 H248 N16 O16 S16 V8 -","8","1","","Sian C. Davies; David L. Hughes; Zofia Janas; Lucjan B. Jerzykiewicz; Raymond L. Richards; J. Roger Sanders; James E. Silverston; Piotr Sobota","Vanadium Complexes of the N(CH2CH2S)33- and O(CH2CH2S)22- Ligands with Coligands Relevant to Nitrogen Fixation Processes","Inorganic Chemistry","2000","39","","3485","3498","10.1021/ic9909476","","","0.71073","MoKα","","0.0577","0.0456","","0.1503","0.1419","","","","1.071","","","","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321233","9.646","0.002","10.103","0.002","15.001","0.003","91.06","0.03","102.12","0.03","118.16","0.03","1248.4","0.6","302","2","302","2","","","","","","","","7","P -1","-P 1","2","Compound 16","","","- C19 H34 N O2 S2 Si V -","- C19 H34 N O2 S2 Si V -","- C38 H68 N2 O4 S4 Si2 V2 -","2","1","","Sian C. Davies; David L. Hughes; Zofia Janas; Lucjan B. Jerzykiewicz; Raymond L. Richards; J. Roger Sanders; James E. Silverston; Piotr Sobota","Vanadium Complexes of the N(CH2CH2S)33- and O(CH2CH2S)22- Ligands with Coligands Relevant to Nitrogen Fixation Processes","Inorganic Chemistry","2000","39","","3485","3498","10.1021/ic9909476","","","0.71073","MoKα","","0.0601","0.0516","","0.1719","0.1653","","","","1.12","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321234","15.223","0.005","12.207","0.004","9.091","0.004","90","","93.53","0.04","90","","1686.1","1.1","299","2","299","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","Compound 18","","","- C9 H23 N2 O2 S2 Si V -","- C9 H23 N2 O2 S2 Si V -","- C36 H92 N8 O8 S8 Si4 V4 -","4","1","","Sian C. Davies; David L. Hughes; Zofia Janas; Lucjan B. Jerzykiewicz; Raymond L. Richards; J. Roger Sanders; James E. Silverston; Piotr Sobota","Vanadium Complexes of the N(CH2CH2S)33- and O(CH2CH2S)22- Ligands with Coligands Relevant to Nitrogen Fixation Processes","Inorganic Chemistry","2000","39","","3485","3498","10.1021/ic9909476","","","0.71073","MoKα","","0.0389","0.0298","","0.0875","0.0832","","","","1.1","","","","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321235","24.62","0.01","19.225","0.005","12.602","0.003","90","","102.48","0.03","90","","5824","3","293.2","","","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C26 H32 Cu F6 N3 O P S -","- C26 H32 Cu F6 N3 O P S -","- C208 H256 Cu8 F48 N24 O8 P8 S8 -","8","2","","Shinobu Itoh; Masayasu Taki; Hideyuki Kumei; Shigehisa Takayama; Shigenori Nagatomo; Teizo Kitagawa; Norio Sakurada; Ryuichi Arakawa; Shunichi Fukuzumi","Model Complexes for the Active Form of Galactose Oxidase. Physicochemical Properties of Cu(II)- and Zn(II)-Phenoxyl Radical Complexes","Inorganic Chemistry","2000","39","","3708","3711","10.1021/ic9910211","","","0.7107","MoKα","","","0.0783","","","","0.0799","","","","","","1.404","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321236","12.642","0.009","19.22","0.01","24.47","0.01","90","","102.74","0.05","90","","5799","6","296.2","","","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C52 H64 F12 N6 O2 P2 S2 Zn2 -","- C52 H64 F12 N6 O2 P2 S2 Zn2 -","- C208 H256 F48 N24 O8 P8 S8 Zn8 -","4","1","","Shinobu Itoh; Masayasu Taki; Hideyuki Kumei; Shigehisa Takayama; Shigenori Nagatomo; Teizo Kitagawa; Norio Sakurada; Ryuichi Arakawa; Shunichi Fukuzumi","Model Complexes for the Active Form of Galactose Oxidase. Physicochemical Properties of Cu(II)- and Zn(II)-Phenoxyl Radical Complexes","Inorganic Chemistry","2000","39","","3708","3711","10.1021/ic9910211","","","0.7107","MoKα","","","0.0669","","","","0.073","","","","","","1.487","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321237","12.393","0.003","18.872","0.005","15.602","0.003","90","","111.92","0.01","90","","3385.2","1.4","288.2","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C31 H41 Cu F6 N4 O P -","- C31 H41 Cu F6 N4 O P -","- C124 H164 Cu4 F24 N16 O4 P4 -","4","1","","Shinobu Itoh; Masayasu Taki; Hideyuki Kumei; Shigehisa Takayama; Shigenori Nagatomo; Teizo Kitagawa; Norio Sakurada; Ryuichi Arakawa; Shunichi Fukuzumi","Model Complexes for the Active Form of Galactose Oxidase. Physicochemical Properties of Cu(II)- and Zn(II)-Phenoxyl Radical Complexes","Inorganic Chemistry","2000","39","","3708","3711","10.1021/ic9910211","","","0.7107","MoKα","","","0.0781","","","","0.0786","","","","","","1.956","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321238","14.9923","0.0008","17.4451","0.001","17.188","0.001","90","","114.829","0.001","90","","4079.9","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C47 H41 N11 O4 -","- C47 H41 N11 O4 -","- C188 H164 N44 O16 -","4","1","","Yann Bretonnière; Raphaël Wietzke; Colette Lebrun; Marinella Mazzanti; Jacques Pécaut","Solid-State and Solution Structure of Lanthanide Complexes of a New Nonadentate Tripodal Ligand Containing Phenanthroline Binding Units","Inorganic Chemistry","2000","39","","3499","3505","10.1021/ic991115a","","","0.71073","MoKα","","0.0786","0.0435","","","0.1059","0.1162","","","","","","0.91","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4321239","17.8653","0.0019","17.8653","0.0019","11.5697","0.0017","90","","90","","120","","3198","0.7","143","2","143","2","","","","","","","","7","P -3","-P 3","147","","","","- C55 H50.5 F9 N11.5 Nd O13 S3 -","- C55.02 H36 F9 N11.5 Nd O12.99 S3 -","- C110.04 H72 F18 N23 Nd2 O25.98 S6 -","2","0.333333","","Yann Bretonnière; Raphaël Wietzke; Colette Lebrun; Marinella Mazzanti; Jacques Pécaut","Solid-State and Solution Structure of Lanthanide Complexes of a New Nonadentate Tripodal Ligand Containing Phenanthroline Binding Units","Inorganic Chemistry","2000","39","","3499","3505","10.1021/ic991115a","","","0.71073","MoKα","","0.1619","0.0776","","","0.1942","0.2231","","","","","","1.081","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321240","12.647","0.006","23.554","0.005","24.523","0.006","90","","104.3","0.03","90","","7079","4","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","monomeric La3Mo2","","","- C36 H76 La3 Mo2 N7 O38 -","- C36 La3 Mo2 N7 O38 -","- C144 La12 Mo8 N28 O152 -","4","1","","M. Hashimoto; M. Takata; A. Yagasaki","Reactivity of Organometallic Molybdate toward Lanthanide Cations. Synthesis and Structure of Polynuclear Lanthanide-Molybdate Complexes","Inorganic Chemistry","2000","39","","3712","3714","10.1021/ic991221c","","","0.71069","MoKα","","0.1312","0.0532","","","0.1515","0.183","","","","","","1.001","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321241","12.661","0.003","22.168","0.003","11.691","0.004","94.44","0.02","115.41","0.02","86.45","0.02","2953.5","1.4","296","2","296","2","","","","","","","","6","P -1","-P 1","2","dimeric La6Mo4","","","- C32 H64 La3 Mo2 N7 O35 -","- C32 La3 Mo2 N7 O35 -","- C64 La6 Mo4 N14 O70 -","2","1","","M. Hashimoto; M. Takata; A. Yagasaki","Reactivity of Organometallic Molybdate toward Lanthanide Cations. Synthesis and Structure of Polynuclear Lanthanide-Molybdate Complexes","Inorganic Chemistry","2000","39","","3712","3714","10.1021/ic991221c","","","0.71069","MoKα","","0.1907","0.0584","","","0.1465","0.2","","","","","","0.998","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321242","21.387","0.006","30.37","0.02","12.441","0.006","97.65","0.04","102.75","0.03","102.52","0.04","7554","7","296","2","296","2","","","","","","","","6","P -1","-P 1","2","(Ce6Mo4)(Ce3Mo2)2_ion_pair","","","- C28 H66 Ce3 Mo2 N7 O38 -","- C24 Ce3 Mo2 N6.5 O34.5 -","- C96 Ce12 Mo8 N26 O138 -","4","2","","M. Hashimoto; M. Takata; A. Yagasaki","Reactivity of Organometallic Molybdate toward Lanthanide Cations. Synthesis and Structure of Polynuclear Lanthanide-Molybdate Complexes","Inorganic Chemistry","2000","39","","3712","3714","10.1021/ic991221c","","","0.71069","MoKα","","0.2693","0.0936","","","0.2346","0.305","","","","","","1.023","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321243","13.124","0.003","10.028","0.002","8.2366","0.001","90","","90.765","0.015","90","","1083.9","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H12 Mn N2 O6 -","- C10 H12 Mn N2 O6 -","- C40 H48 Mn4 N8 O24 -","4","0.5","","Siegfried O. H. Gutschke; Daniel J. Price; Annie K. Powell; Paul T. Wood","Solvothermal Construction of a Coordination Polymer around in Situ Generated Pyroglutamic Acid: Preparation, Crystal Structure, and Magnetic Behavior of [Mn(C5H6NO3)2]\ιnfty","Inorganic Chemistry","2000","39","","3705","3707","10.1021/ic9912427","","","0.71073","MoKα","","0.0397","0.0311","","0.0851","","","","","1.07","1.111","1.111","0.0807","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321244","14.1665","0.0007","24.7743","0.0012","16.2716","0.0008","90","","97.994","0.001","90","","5655.3","0.5","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C64 H48 N4 Ti -","- C64 H46 N4 Ti -","- C256 H184 N16 Ti4 -","4","1","","Jinyuan Chen; Ilia A. Guzei; L. Keith Woo","Synthesis and Molecular Structure of (TTP)Ti(1,2-η2-PhC\τbC-C\τbCPh)","Inorganic Chemistry","2000","39","","3715","3717","10.1021/ic9912575","","","0.71073","MoKα","","0.0965","0.0634","","","0.1535","0.1685","","","","","","1.037","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321245","8.22","0.001","11.913","0.002","15.2675","0.0013","67.214","0.009","76.346","0.009","71.053","0.011","1293.2","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","[HB(3,5-(CF3)2Pz)3]AgOC2H4","","","- C17 H8 Ag B F18 N6 O -","- C17 H8 Ag B F18 N6 O -","- C34 H16 Ag2 B2 F36 N12 O2 -","2","1","","H. V. Rasika Dias; Ziyun Wang","Ethylene Oxide and Propylene Sulfide Complexes of Silver(I): Synthesis and Characterization of [HB(3,5-(CF3)2Pz)3]Ag(OC2H4) and [HB(3,5-(CF3)2Pz)3]Ag(SC3H6)","Inorganic Chemistry","2000","39","","3724","3727","10.1021/ic991334w","","","0.71073","MoKα","","0.0356","0.0296","","","0.0694","0.0721","","","","","","1.054","","","","has coordinates,has disorder","179315","2020-10-21","18:00:00",""
"4321246","8.1647","0.0012","12.709","0.002","14.849","0.002","66.305","0.013","76.535","0.01","75.04","0.011","1348.5","0.4","183","2","183","2","","","","","","","","7","P -1","-P 1","2","[HB(3,5-(CF3)2Pz)3]AgSC3H6","","","- C18 H10 Ag B F18 N6 S -","- C18 H10 Ag B F18 N6 S -","- C36 H20 Ag2 B2 F36 N12 S2 -","2","1","","H. V. Rasika Dias; Ziyun Wang","Ethylene Oxide and Propylene Sulfide Complexes of Silver(I): Synthesis and Characterization of [HB(3,5-(CF3)2Pz)3]Ag(OC2H4) and [HB(3,5-(CF3)2Pz)3]Ag(SC3H6)","Inorganic Chemistry","2000","39","","3724","3727","10.1021/ic991334w","","","0.71073","MoKα","","0.0562","0.0488","","","0.1237","0.1289","","","","","","1.087","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321247","17.389","0.006","10.843","0.003","10.463","0.003","90","","125.28","0.02","90","","1610.5","0.9","113","","113","","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C30 H48 Mo2 N2 O6 -","- C30 H48 Mo1.912 N2 O6 -","- C60 H96 Mo3.824 N4 O12 -","2","0.5","","Malcolm H. Chisholm; Ann M. Macintosh; John C. Huffman; Dedong Wu; Ernest R. Davidson; Robin J. H. Clark; Steven Firth","Dimolybdenum Bis((S,S,S)-triisopropanolaminate(3-)): A Blue Compound with an Unusual Mo-Mo Triple Bond","Inorganic Chemistry","2000","39","","3544","3550","10.1021/ic991352d","","","0.71069","MoKα","","","0.0515","","","","0.0487","","","","","","1.545","","","","has coordinates,has disorder","179315","2020-10-21","18:00:00",""
"4321248","9.538","0.003","10.542","0.003","15.728","0.003","104.52","0.03","90.13","0.03","110.76","0.03","1424.3","0.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","(dach)Pt(OPiv)3(OAc)","","","- C23 H44 N2 O8 Pt -","- C23 H44 N2 O8 Pt -","- C46 H88 N4 O16 Pt2 -","2","1","","Rita Song; Kwan Mook Kim; Sung Sil Lee; Youn Soo Sohn","Electrophilic Substitution of (Diamine)tetrahydroxoplatinum(IV) with Carboxylic Anhydrides. Synthesis and Characterization of (Diamine)platinum(IV) Complexes of Mixed Carboxylates","Inorganic Chemistry","2000","39","","3567","3571","10.1021/ic9913886","","","0.71073","MoKα","","0.0431","0.0429","","","0.1203","0.1209","","","","","","1.124","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321249","14.279","0.003","20.516","0.004","16.732","0.006","90","","102.33","0.02","90","","4789","2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","(dach)Pt(OOCCF3)(OOCCH3)3","","","- C15.5 H26 F3 N2 O8.5 Pt -","- C15.5 H26 F3 N2 O8.5 Pt -","- C124 H208 F24 N16 O68 Pt8 -","8","1","","Rita Song; Kwan Mook Kim; Sung Sil Lee; Youn Soo Sohn","Electrophilic Substitution of (Diamine)tetrahydroxoplatinum(IV) with Carboxylic Anhydrides. Synthesis and Characterization of (Diamine)platinum(IV) Complexes of Mixed Carboxylates","Inorganic Chemistry","2000","39","","3567","3571","10.1021/ic9913886","","","0.71073","MoKα","","0.0459","0.045","","","0.1269","0.1278","","","","","","1.047","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321250","7.2032","0.001","20.7396","0.001","11.6983","0.001","90","","106.672","0.01","90","","1674.2","0.3","173","2","173","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C32 H29 Au3 Cl3 P3 -","- C32 H29 Au3 Cl3 P3 -","- C64 H58 Au6 Cl6 P6 -","2","0.5","","Manuel Bardají; Antonio Laguna; Peter G. Jones; Axel K. Fischer","Synthesis and Structural Characterization of Luminescent Trinuclear Gold(I) Complexes with Dithiocarbamates","Inorganic Chemistry","2000","39","","3560","3566","10.1021/ic9914342","","","0.71073","MoKα","","0.0518","0.0381","","","0.0839","0.0885","","","","","","0.982","","","","has coordinates,has disorder","179315","2020-10-21","18:00:00",""
"4321251","15.423","0.005","14.034","0.005","10.97","0.005","90","0.005","90","0.005","90","0.005","2374.4","1.6","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C24 H18 N6 O6 Ru -","- C22 H18 N8 O6 Ru -","- C88 H72 N32 O24 Ru4 -","4","1","","Anna C. G. Hotze; Aldrik H. Velders; Franco Ugozzoli; Marina Biagini-Cingi; Anna M. Manotti-Lanfredi; Jaap G. Haasnoot; Jan Reedijk","Synthesis, Characterization, and Crystal Structure of α-[Ru(azpy)2(NO3)2] (azpy = 2-(Phenylazo)pyridine) and the Products of Its Reactions with Guanine Derivatives","Inorganic Chemistry","2000","39","","3838","3844","10.1021/ic000066v","","","0.71069","MoKα","","0.0797","0.042","","0.118","0.1083","","","","0.89","1.085","1.085","","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321252","11.628","0.004","12.719","0.004","8.479","0.002","104.79","0.02","106.8","0.02","101.32","0.03","1110.2","0.7","298.2","","298.2","","","","","","","","","6","P -1","-P 1","2","","","","- C11.5 H8 Br2 Cu O0.5 S10 -","- C11.5 H8 Br2 Cu O0.5 S10 -","- C23 H16 Br4 Cu2 O S20 -","2","1","","Masaki Iwamatsu; Tsuyoshi Kominami; Kazumasa Ueda; Toyonari Sugimoto; Tomohiro Adachi; Hideo Fujita; Harukazu Yoshino; Yoshiyuki Mizuno; Keizo Murata; Motoo Shiro","1:1 Complexes of Dimethylthio- and Ethylenedithio-tetrathiafulvalenothioquinone- 1,3-dithiolemethides with CuBr2 as a New Type of π/d Molecular System","Inorganic Chemistry","2000","39","","3810","3815","10.1021/ic0001098","","","0.7107","MoKα","","0.1748","0.0489","","0.1073","0.0839","0.1073","","","1.108","","","1.108","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321253","7.451","0.001","24.964","0.003","11.983","0.002","90","","99.9","0.01","90","","2195.7","0.5","298.2","","298.2","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13 H9 Br2 Cu N S9 -","- C13 H9 Br2 Cu N S9 -","- C52 H36 Br8 Cu4 N4 S36 -","4","1","","Masaki Iwamatsu; Tsuyoshi Kominami; Kazumasa Ueda; Toyonari Sugimoto; Tomohiro Adachi; Hideo Fujita; Harukazu Yoshino; Yoshiyuki Mizuno; Keizo Murata; Motoo Shiro","1:1 Complexes of Dimethylthio- and Ethylenedithio-tetrathiafulvalenothioquinone- 1,3-dithiolemethides with CuBr2 as a New Type of π/d Molecular System","Inorganic Chemistry","2000","39","","3810","3815","10.1021/ic0001098","","","0.7107","MoKα","","0.09","0.054","","0.1474","","0.1194","","","0.957","","","0.957","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321254","13.232","0.0005","15.5731","0.0007","26.015","0.001","90","","90.952","0.001","90","","5360","0.4","203","2","203","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C16 H168 Co6 K2 N36 Nd4 O78 -","- C16 H108 Co6.25 K1.76 N36 Nd4 O78.02 -","- C32 H216 Co12.5 K3.52 N72 Nd8 O156.04 -","2","0.5","","Deborah L. Bond; David L. Clark; Robert J. Donohoe; John C. Gordon; Pamela L. Gordon; D. Webster Keogh; Brian L. Scott; C. Drew Tait; John G. Watkin","A New Structural Class of Lanthanide Carbonates: Synthesis, Properties, and X-ray Structure of the One-Dimensional Chain Complex [Co(NH~3~)~6~]~6~[K~2~(H~2~O)~10~][Nd~2~(CO~3~)~8~]~2~^.^20H~2~O","Inorganic Chemistry","2000","39","","3934","3937","10.1021/ic0001255","","","0.71073","MoKα","","0.0751","0.0468","","","0.1107","0.1194","","","","","","1.242","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321255","17.578","0.001","17.596","0.001","20.639","0.001","90","","115.03","0.001","90","","5784.2","0.5","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Co(TpivPP)","(α,α,α,α-tetrakis(o-pivalamidophenyl) porphyrinato)cobalt(II)","","- C64 H64 Co N8 O4 -","- C64 H64 Co N8 O4 -","- C256 H256 Co4 N32 O16 -","4","1","","Paul G. Jene; James A. Ibers","Structural Characterization of the Picket Fence (TpivPP) Porphyrins Co(TpivPP), Co(TpivPP)(NO2)(1-MeIm), and Co(TpivPP)(NO2)(1,2-Me2Im)","Inorganic Chemistry","2000","39","","3823","3827","10.1021/ic000127p","","","0.71073","MoKα","","0.0783","0.05","","","0.1156","0.122","","","","","","1.283","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321256","18.522","0.004","18.942","0.004","18.177","0.004","90","","90.68","0.03","90","","6377","2","203","2","203","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Co(TpivPP)(NO~2~)(1-MeIm)","(nitro)(1-methylimidazolato)(α,α,α,α-tetrakis (o-pivalamidophenyl)porphyrinato)cobalt(III)","","- C68 H70 Co N11 O6 -","- C68 H70 Co N11 O6 -","- C272 H280 Co4 N44 O24 -","4","0.5","","Paul G. Jene; James A. Ibers","Structural Characterization of the Picket Fence (TpivPP) Porphyrins Co(TpivPP), Co(TpivPP)(NO2)(1-MeIm), and Co(TpivPP)(NO2)(1,2-Me2Im)","Inorganic Chemistry","2000","39","","3823","3827","10.1021/ic000127p","","","0.71073","MoKα","","0.1377","0.055","","","0.1024","0.12","","","","","","0.931","","","","has coordinates,has disorder","179315","2020-10-21","18:00:00",""
"4321257","18.998","0.004","19.187","0.004","18","0.004","90","","90.96","0.03","90","","6560","2","153","2","153","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Co(TpivPP)(NO~2~)(1,2-Me~2~Im)","(nitro)(1,2-dimethylimidazolato)(α,α,α,α-tetrakis (o-pivalamidophenyl)porphyrinato)cobalt(III)","","- C69 H72 Co N11 O6 -","- C69 H72 Co N11 O6 -","- C276 H288 Co4 N44 O24 -","4","0.5","","Paul G. Jene; James A. Ibers","Structural Characterization of the Picket Fence (TpivPP) Porphyrins Co(TpivPP), Co(TpivPP)(NO2)(1-MeIm), and Co(TpivPP)(NO2)(1,2-Me2Im)","Inorganic Chemistry","2000","39","","3823","3827","10.1021/ic000127p","","","0.71073","MoKα","","0.0957","0.076","","","0.1952","0.203","","","","","","1.615","","","","has coordinates,has disorder","179315","2020-10-21","18:00:00",""
"4321258","27.5025","0.0002","27.5025","0.0002","6.6317","0.0002","90","","90","","90","","5016.14","0.16","223","2","223","2","","","","","","","","3","P 42/n :2","-P 4bc","86","","","","- C60 H64 P2 -","- C60 H64 P2 -","- C240 H256 P8 -","4","0.5","","Shashin Shah; Tom E. Concolino; Arnold L. Rheingold; John D. Protasiewicz","Sterically Encumbered Systems for Two Low-Coordinate Phosphorus Centers","Inorganic Chemistry","2000","39","","3860","3867","10.1021/ic0001558","","","0.71073","MoKα","","0.1022","0.077","","","0.192","0.2179","","","","","","1.051","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321259","11.8495","0.0002","13.0427","0.0002","16.1474","0.0002","89.3505","0.0007","75.985","0.001","74.4804","0.0011","2329.18","0.06","233","2","233","2","","","","","","","","5","P -1","-P 1","2","","","","- C96 H102 Cl6 D2 P4 -","- C96 H104 Cl6 P4 -","- C96 H104 Cl6 P4 -","1","0.5","","Shashin Shah; Tom E. Concolino; Arnold L. Rheingold; John D. Protasiewicz","Sterically Encumbered Systems for Two Low-Coordinate Phosphorus Centers","Inorganic Chemistry","2000","39","","3860","3867","10.1021/ic0001558","","","0.71073","MoKα","","0.1216","0.0932","","","0.2348","0.2691","","","","","","1.081","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321260","14.266","0.0015","24.513","0.001","7.201","0.002","90","","90","","90","","2518.2","0.8","150","2","150","2","","","","","","","synthesis as described","6","C m c 21","C 2c -2","36","","","","- C12 H28 F12 N4 O4 U3 -","- C12 H28 F12 N4 O4 U3 -","- C48 H112 F48 N16 O16 U12 -","4","0.5","","Simon Allen; Stephen Barlow; P. Shiv Halasyamani; J. Frederick W. Mosselmans; Dermot O'Hare; Susan M. Walker; Richard I. Walton","Hydrothermal Synthesis of (C6N2H14)2(UVI2UIVO4F12), a Mixed-Valent One-Dimensional Uranium Oxyfluoride","Inorganic Chemistry","2000","39","","3791","3798","10.1021/ic000193r","","x-ray","0.71073","MoKα","","0.0521","0.0518","","0.1109","0.1093","","","","1.274","1.274","1.274","","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321261","13.652","0.005","11.792","0.003","16.253","0.003","90","","98.05","0.02","90","","2590.7","1.3","296.2","","296.2","","","","","","","","Recrystallized from nitromethane/diethyl ether","7","P 1 21/c 1","-P 2ybc","14","[Co(S~2~OS,S')(dmpp)~2~]PF~6~","Bis{1,3-bis(dimethylphosphino)propane}{oxodisulfido(2-)-S,S'}cobalt(III) hexafluorophosphate","","- C14 H36 Co F6 O P5 S2 -","- C14 H36 Co F6 O P5 S2 -","- C56 H144 Co4 F24 O4 P20 S8 -","4","1","","Takayoshi Suzuki; Naoki Tsuji; Kazuo Kashiwabara; Kazuyuki Tatsumi","Oxidative Additions of cyclo-Octasulfur and cyclo-Octaselenium to the Cobalt(II) Complex of 1,3-Bis(dimethylphosphino)propane (dmpp): Crystal Structures and Spectroscopic Properties of [Co(S2O)(dmpp)2]PF6 and [Co(Se2)(dmpp)2]BF4","Inorganic Chemistry","2000","39","","3938","3941","10.1021/ic000289l","","","0.7107","MoKα","","","0.0611","","","","0.0628","","","","","","1.97","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321262","9.631","0.004","8.934","0.003","28.377","0.003","90","","97.32","0.02","90","","2421.8","1.3","296.2","","296.2","","","","","","","","Recrystalized from acetone/diethyl ether","7","P 1 21/c 1","-P 2ybc","14","[Co(Se~2~)(dmpp)~2~]BF~4~","Bis{1,3-bis(dimethylphosphino)propane}{diselenido(2-)}cobalt(III) tetrafluoroborate","","- C14 H36 B Co F4 P4 Se2 -","- C14 H36 B Co F4 P4 Se2 -","- C56 H144 B4 Co4 F16 P16 Se8 -","4","1","","Takayoshi Suzuki; Naoki Tsuji; Kazuo Kashiwabara; Kazuyuki Tatsumi","Oxidative Additions of cyclo-Octasulfur and cyclo-Octaselenium to the Cobalt(II) Complex of 1,3-Bis(dimethylphosphino)propane (dmpp): Crystal Structures and Spectroscopic Properties of [Co(S2O)(dmpp)2]PF6 and [Co(Se2)(dmpp)2]BF4","Inorganic Chemistry","2000","39","","3938","3941","10.1021/ic000289l","","","0.7107","MoKα","","","0.041","","","","0.0346","","","","","","1.376","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321263","23.743","0.003","9.7522","0.0005","27.731","0.002","90","","114.58","0.01","90","","5839.2","1","293","2","293","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C23 H22 Cl2 Cu2 N4 O14 -","- C46 H36 Cl4 Cu4 N8 O28 -","- C184 H144 Cl16 Cu16 N32 O112 -","4","1","","Catalina Ruiz-Pérez; María Hernández-Molina; Pablo Lorenzo-Luis; Francesc Lloret; Juan Cano; Miguel Julve","Magnetic Coupling through the Carbon Skeleton of Malonate in Two Polymorphs of {[Cu(bpy)(H2O)][Cu(bpy)(mal)(H2O)]}(ClO4)2 (H2mal = Malonic Acid; bpy = 2,2'-Bipyridine)","Inorganic Chemistry","2000","39","","3845","3852","10.1021/ic000314n","","","1.5418","CuKα","","0.0753","0.0597","","0.2113","0.1591","","","","1.359","1.081","1.081","","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321264","23.7","0.005","25.162","0.005","9.693","0.005","90","","90","","90","","5780","3","293","2","293","2","","","","","","","","6","P b 21 a","P -2a -2ab","29","","","","- C23 H22 Cl2 Cu2 N4 O14 -","- C46 H36 Cl4 Cu4 N8 O28 -","- C184 H144 Cl16 Cu16 N32 O112 -","4","1","","Catalina Ruiz-Pérez; María Hernández-Molina; Pablo Lorenzo-Luis; Francesc Lloret; Juan Cano; Miguel Julve","Magnetic Coupling through the Carbon Skeleton of Malonate in Two Polymorphs of {[Cu(bpy)(H2O)][Cu(bpy)(mal)(H2O)]}(ClO4)2 (H2mal = Malonic Acid; bpy = 2,2'-Bipyridine)","Inorganic Chemistry","2000","39","","3845","3852","10.1021/ic000314n","","","1.54179","CuKα","","0.0693","0.0453","","0.2153","0.1264","","","","1.255","1.034","1.034","","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321265","14.148","0.002","17.524","0.002","16.006","0.003","90","","114.12","0.012","90","","3621.9","1","183","2","183","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","[HB(CF3)2Tp]AgGeCl[(Me)2ATI]","","","- C25 H17 Ag B Cl3 F18 Ge N8 -","- C25 H17 Ag B Cl3 F18 Ge N8 -","- C100 H68 Ag4 B4 Cl12 F72 Ge4 N32 -","4","1","","H. V. Rasika Dias; Ziyun Wang","Adduct Formation or Metathesis Reactions of Silver Complexes Containing the Fluorinated Ligands [HB(3,5-(CF3)2Pz)3]- and [CF3SO3]-: Formation of Silver Adducts Containing Unsupported Silver-Germanium Bonds","Inorganic Chemistry","2000","39","","3890","3893","10.1021/ic000414t","","","0.71073","MoKα","","0.0564","0.0393","","","0.0837","0.0905","","","","","","1.068","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321266","18.279","0.003","9.142","0.002","23.008","0.004","90","","108.248","0.008","90","","3651.4","1.2","183","2","183","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","[HB(CF3)2Tp]AgGe(OTf)[(Me)2ATI]","","","- C25 H15 Ag B F21 Ge N8 O3 S -","- C25 H15 Ag B F21 Ge N8 O3 S -","- C100 H60 Ag4 B4 F84 Ge4 N32 O12 S4 -","4","1","","H. V. Rasika Dias; Ziyun Wang","Adduct Formation or Metathesis Reactions of Silver Complexes Containing the Fluorinated Ligands [HB(3,5-(CF3)2Pz)3]- and [CF3SO3]-: Formation of Silver Adducts Containing Unsupported Silver-Germanium Bonds","Inorganic Chemistry","2000","39","","3890","3893","10.1021/ic000414t","","","0.71073","MoKα","","0.0682","0.0527","","","0.1311","0.1434","","","","","","1.045","","","","has coordinates,has disorder","179315","2020-10-21","18:00:00",""
"4321267","10.4911","0.0012","11.4778","0.0012","16.139","0.002","99.621","0.01","108.817","0.011","90.081","0.009","1810.4","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","[HB(3,5-(CF3)2Pz)3]CuN3Ad/0.5(C7H8)","","","- C28.5 H23 B Cu F18 N9 -","- C28.5 H23 B Cu F18 N9 -","- C57 H46 B2 Cu2 F36 N18 -","2","1","","H. V. Rasika Dias; Sharon A. Polach; Sor-Koon Goh; Edet F. Archibong; Dennis S. Marynick","Copper and Silver Complexes Containing Organic Azide Ligands: Syntheses, Structures, and Theoretical Investigation of [HB(3,5-(CF3)2Pz)3]CuNNN(1-Ad) and [HB(3,5-(CF3)2Pz)3]AgN(1-Ad)NN (Where Pz = Pyrazolyl and 1-Ad = 1-Adamantyl)","Inorganic Chemistry","2000","39","","3894","3901","10.1021/ic0004232","","","0.71073","MoKα","","0.0458","0.0374","","","0.0957","0.1019","","","","","","1.023","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4321268","13.2765","0.0016","13.787","0.0011","21.479","0.002","97.805","0.006","96.344","0.008","118.5","0.007","3353","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","[HB(3,5-(CF3)2Pz)3]AgN3Ad","","","- C25 H19 Ag B F18 N9 -","- C25 H19 Ag B F18 N9 -","- C100 H76 Ag4 B4 F72 N36 -","4","2","","H. V. Rasika Dias; Sharon A. Polach; Sor-Koon Goh; Edet F. Archibong; Dennis S. Marynick","Copper and Silver Complexes Containing Organic Azide Ligands: Syntheses, Structures, and Theoretical Investigation of [HB(3,5-(CF3)2Pz)3]CuNNN(1-Ad) and [HB(3,5-(CF3)2Pz)3]AgN(1-Ad)NN (Where Pz = Pyrazolyl and 1-Ad = 1-Adamantyl)","Inorganic Chemistry","2000","39","","3894","3901","10.1021/ic0004232","","","0.71073","MoKα","","0.0717","0.0475","","","0.1104","0.1238","","","","","","1.011","","","","has coordinates,has disorder","179315","2020-10-21","18:00:00",""
"4321269","13.296","0.002","22.363","0.003","18.625","0.003","90","","107.654","0.002","90","","5277.1","1.4","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C51 H48 Cl9 P3 Pt Ru -","- C51 H44 Cl9 P3 Pt Ru -","- C204 H176 Cl36 P12 Pt4 Ru4 -","4","1","","Mark E. Tess; Pamela L. Hill; Karen E. Torraca; Margaret E. Kerr; Khalil A. Abboud; Lisa McElwee-White","Bimetallic Pt/Ru Complexes as Catalysts for the Electrooxidation of Methanol","Inorganic Chemistry","2000","39","","3942","3944","10.1021/ic0004434","","","0.71073","MoKα","","0.0326","0.0233","","","0.048","0.0493","","","","","","1.004","","","","has coordinates,has disorder","179315","2020-10-21","18:00:00",""
"4321270","10.895","0.001","14.669","0.001","16.617","0.001","90","","101.37","0.01","90","","2603.6","0.3","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C17 H33 F6 Fe N3 O6 S2 -","- C17 H33 F6 Fe N3 O6 S2 -","- C68 H132 F24 Fe4 N12 O24 S8 -","4","1","","Alain Diebold; Abdelaziz Elbouadili; Karl S. Hagen","Crystal Structures and Solution Behavior of Paramagnetic Divalent Transition Metal Complexes (Fe, Co) of the Sterically Encumbered Tridentate Macrocycles 1,4,7-R3-1,4,7-Triazacyclononane: Coordination Numbers 5 (R = i-Pr) and 6 (R = i-Bu)","Inorganic Chemistry","2000","39","","3915","3923","10.1021/ic000456h","","","0.71073","MoKα","","0.0544","0.0432","","0.1111","0.1035","","","","1.015","1.042","1.042","","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321271","8.669","0.002","25.538","0.003","12.4349","0.0012","90","","103.132","0.013","90","","2681","0.8","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C17 H35 Co F6 N3 O7 S2 -","- C17 H33 Co F6 N3 O7 S2 -","- C68 H132 Co4 F24 N12 O28 S8 -","4","1","","Alain Diebold; Abdelaziz Elbouadili; Karl S. Hagen","Crystal Structures and Solution Behavior of Paramagnetic Divalent Transition Metal Complexes (Fe, Co) of the Sterically Encumbered Tridentate Macrocycles 1,4,7-R3-1,4,7-Triazacyclononane: Coordination Numbers 5 (R = i-Pr) and 6 (R = i-Bu)","Inorganic Chemistry","2000","39","","3915","3923","10.1021/ic000456h","","","1.54178","CuKα","","0.1051","0.074","","0.2168","0.1897","","","","1.039","1.081","1.081","","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321272","12.953","0.006","16.78","0.006","15.79","0.005","90","","96.32","0.02","90","","3411","2","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C24 H45 F6 Fe N5 O6 S2 -","- C24 H45 F6 Fe N5 O6 S2 -","- C96 H180 F24 Fe4 N20 O24 S8 -","4","1","","Alain Diebold; Abdelaziz Elbouadili; Karl S. Hagen","Crystal Structures and Solution Behavior of Paramagnetic Divalent Transition Metal Complexes (Fe, Co) of the Sterically Encumbered Tridentate Macrocycles 1,4,7-R3-1,4,7-Triazacyclononane: Coordination Numbers 5 (R = i-Pr) and 6 (R = i-Bu)","Inorganic Chemistry","2000","39","","3915","3923","10.1021/ic000456h","","","1.54178","CuKα","","0.0667","0.0581","","0.1561","0.1451","","","","1.034","1.021","1.021","","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321273","22.99","0.002","15.768","0.002","17.564","0.002","90","","107.65","0.01","90","","6067.3","1.2","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C20 H41 F6 Fe N3 O7 S2 -","- C20 H41 F6 Fe N3 O7 S2 -","- C160 H328 F48 Fe8 N24 O56 S16 -","8","1","","Alain Diebold; Abdelaziz Elbouadili; Karl S. Hagen","Crystal Structures and Solution Behavior of Paramagnetic Divalent Transition Metal Complexes (Fe, Co) of the Sterically Encumbered Tridentate Macrocycles 1,4,7-R3-1,4,7-Triazacyclononane: Coordination Numbers 5 (R = i-Pr) and 6 (R = i-Bu)","Inorganic Chemistry","2000","39","","3915","3923","10.1021/ic000456h","","","1.54178","CuKα","","0.0999","0.0794","","0.2297","0.2074","","","","1.054","1.095","1.095","","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321274","19.5002","0.0012","13.0582","0.0008","14.5741","0.0009","90","","90","","90","","3711.1","0.4","298","2","298","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C28 H34 La N11 O13 -","- C28 H34 La N11 O13 -","- C112 H136 La4 N44 O52 -","4","1","","Christophe Lescop; Dominique Luneau; Guillaume Bussière; Myriam Triest; Christian Reber","Ligand-Centered Near-Infrared Luminescence from Lanthanide Complexes with Chelating Nitronyl Nitroxide Free Radicals","Inorganic Chemistry","2000","39","","3740","3741","10.1021/ic0004941","","","0.71073","MoKα","","0.0868","0.0331","","0.1146","0.077","","","","0.629","0.558","0.558","","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321275","19.1831","0.001","13.16","0.0007","14.4107","0.0007","90","","90","","90","","3638","0.3","298","2","298","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C28 H34 Gd N11 O13 -","- C28 H34 Gd N11 O13 -","- C112 H136 Gd4 N44 O52 -","4","1","","Christophe Lescop; Dominique Luneau; Guillaume Bussière; Myriam Triest; Christian Reber","Ligand-Centered Near-Infrared Luminescence from Lanthanide Complexes with Chelating Nitronyl Nitroxide Free Radicals","Inorganic Chemistry","2000","39","","3740","3741","10.1021/ic0004941","","","0.71073","MoKα","","0.0382","0.0206","","0.0625","0.0528","","","","0.393","0.404","0.404","","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321276","19.2109","0.001","13.1447","0.0007","14.42","0.0007","90","","90","","90","","3641.4","0.3","298","2","298","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C28 H34 Eu N11 O13 -","- C28 H34 Eu N11 O13 -","- C112 H136 Eu4 N44 O52 -","4","1","","Christophe Lescop; Dominique Luneau; Guillaume Bussière; Myriam Triest; Christian Reber","Ligand-Centered Near-Infrared Luminescence from Lanthanide Complexes with Chelating Nitronyl Nitroxide Free Radicals","Inorganic Chemistry","2000","39","","3740","3741","10.1021/ic0004941","","","0.71073","MoKα","","0.0632","0.0347","","","0.0867","0.1048","","","","","","0.696","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321277","16.664","0.007","13.575","0.006","28.386","0.008","90","","90","","90","","6421","4","293","2","296","2","","","","","","","","7","C m c a","-C 2ac 2","64","","","","- C21 H40 Cr0.5 Fe0.5 N6 O2 S4 -","- C21 Cr0.5 Fe0.5 N6 O2 S4 -","- C168 Cr4 Fe4 N48 O16 S32 -","8","","","Smaïl Triki; Florence Bérézovsky; Jean Sala Pala; Eugenio Coronado; Carlos J. Gómez-García; Juan Modesto Clemente; Amédée Riou; Philippe Molinié","Oxalato-Bridged Dinuclear Complexes of Cr(III) and Fe(III): Synthesis, Structure, and Magnetism of [(C2H5)4N]4[MM'(ox)(NCS)8] with MM' = CrCr, FeFe, and CrFe","Inorganic Chemistry","2000","39","","3771","3776","10.1021/ic990439w","","","0.71073","MoKα","","0.3189","0.0878","","","0.2156","0.3157","","","","","","0.91","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321278","36.815","0.003","8.8104","0.0005","18.9973","0.0012","90","","115.515","0.003","90","","5560.9","0.7","109","","109","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C25 H48 Cl N P2 Ru -","- C25 H48 Cl N P2 Ru -","- C200 H384 Cl8 N8 P16 Ru8 -","8","1","","Joseph N. Coalter; William E. Streib; Kenneth G. Caulton","Reactivity of [RuHCl(PiPr3)2]2 with Functionalized Vinyl Substrates. The H2 Ligand as a Sensitive Probe of Electronic Structure","Inorganic Chemistry","2000","39","","3749","3756","10.1021/ic9905998","","","0.71069","MoKα","","","0.0324","","","","0.0393","","","","","","1.0952","","","","has coordinates,has disorder","179315","2020-10-21","18:00:00",""
"4321279","10.4396","0.0001","10.4396","0.0001","36.2157","0.0007","90","","90","","90","","3946.98","0.09","293","2","295","2","","","","","","","","6","P 41 21 2","P 4abw 2nw","92","","","","- C32 H46 N4 O20 Ru2 S2 -","- C32 H44 N4 O19 Ru2 S2 -","- C128 H176 N16 O76 Ru8 S8 -","4","0.5","","Beth R. Cameron; Gary J. Bridger; Kevin P. Maresca; Jon Zubieta","Synthesis of Bis-Thiolato-Bridged Ru(III) Dimers. The Crystal Structure of [Ru(H2edta)(μ-SC6H5)]2","Inorganic Chemistry","2000","39","","3928","3930","10.1021/ic990787y","","","0.71073","MoKα","","0.0714","0.0635","","","0.0976","0.0998","","","","","","1.395","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321280","13.403","0.009","18.805","0.013","36.46","0.03","90","","90","","90","","9190","12","","","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C36 H84 Cl3 P4 Ru2 -","- C36 H84 Cl3 P4 Ru2 -","- C288 H672 Cl24 P32 Ru16 -","8","1","","Joseph N. Coalter; John C. Huffman; William E. Streib; Kenneth G. Caulton","A New Class of Electron-Rich Unsaturated Molecules: Ru2HnX4-n(PiPr3)4, X = Anion","Inorganic Chemistry","2000","39","","3757","3764","10.1021/ic991112y","","","0.71069","MoKα","","","0.0673","","","","0.043","","","","","","1.0169","","","","has coordinates,has disorder","179315","2020-10-21","18:00:00",""
"4321281","13.659","0.006","16.671","0.006","11.757","0.005","100.67","0.02","104.436","0.017","106.106","0.017","2396","1.8","101","","101","","","","","","","","","5","P -1","-P 1","2","","","","- C39 H88 Cl P4 Ru2 -","- C39 H87 Cl P4 Ru2 -","- C78 H174 Cl2 P8 Ru4 -","2","1","","Joseph N. Coalter; John C. Huffman; William E. Streib; Kenneth G. Caulton","A New Class of Electron-Rich Unsaturated Molecules: Ru2HnX4-n(PiPr3)4, X = Anion","Inorganic Chemistry","2000","39","","3757","3764","10.1021/ic991112y","","","0.71069","MoKα","","","0.0616","","","","0.0477","","","","","","1.1969","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4321282","13.7504","0.0019","15.989","0.002","11.0235","0.0015","105.631","0.007","110.829","0.007","86.145","0.008","2180.3","0.5","102","","102","","","","","","","","","5","P -1","-P 1","2","","","","- C36 H86 F2 P4 Ru2 -","- C36 H86 F2 P4 Ru2 -","- C72 H172 F4 P8 Ru4 -","2","1","","Joseph N. Coalter; John C. Huffman; William E. Streib; Kenneth G. Caulton","A New Class of Electron-Rich Unsaturated Molecules: Ru2HnX4-n(PiPr3)4, X = Anion","Inorganic Chemistry","2000","39","","3757","3764","10.1021/ic991112y","","","0.71069","MoKα","","","0.0301","","","","0.0317","","","","","","1.5936","","","","has coordinates,has disorder","179315","2020-10-21","18:00:00",""
"4321283","17.155","0.008","19.934","0.008","14.204","0.006","90.13","0.02","101.9","0.02","73.13","0.02","4540","3","102","","102","","","","","","","","","5","P -1","-P 1","2","","","","- C36 H86 Cl2 P4 Ru2 -","- C35.5 H73.5 Cl2 P4 Ru2 -","- C142 H294 Cl8 P16 Ru8 -","4","2","","Joseph N. Coalter; John C. Huffman; William E. Streib; Kenneth G. Caulton","A New Class of Electron-Rich Unsaturated Molecules: Ru2HnX4-n(PiPr3)4, X = Anion","Inorganic Chemistry","2000","39","","3757","3764","10.1021/ic991112y","","","0.71069","MoKα","","","0.1048","","","","0.0957","","","","","","1.8145","","","","has coordinates,has disorder","179315","2020-10-21","18:00:00",""
"4321284","12.272","0.009","18.563","0.009","15.285","0.007","90","","113.18","0.03","90","","3201","3","150","0.1","150","0.1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H36 F12 P2 Pt Se6 -","- C16 H28 F12 P2 Pt Se6 -","- C64 H112 F48 P8 Pt4 Se24 -","4","1","","William Levason; Simon D. Orchard; Gillian Reid","Synthesis, Spectroscopic, and Structural Studies on Transition Metal Complexes Involving Homoleptic Tripodal Selenoether and Telluroether Coordination","Inorganic Chemistry","2000","39","","3853","3859","10.1021/ic991330r","","","0.71073","MoKα","","","0.0544","","","","0.0493","","","","","","2.244","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321285","8.12","0.002","15.374","0.003","14.071","0.002","90","","93.86","0.02","90","","1752.6","0.6","150","0.1","150","0.1","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C9 H18 Ag F3 O3 S Se3 -","- C9 H18 Ag F3 O3 S Se3 -","- C36 H72 Ag4 F12 O12 S4 Se12 -","4","1","","William Levason; Simon D. Orchard; Gillian Reid","Synthesis, Spectroscopic, and Structural Studies on Transition Metal Complexes Involving Homoleptic Tripodal Selenoether and Telluroether Coordination","Inorganic Chemistry","2000","39","","3853","3859","10.1021/ic991330r","","","0.71073","MoKα","","","0.0462","","","","0.0602","","","","","","2.29","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321286","8.658","0.003","11.533","0.003","8.659","0.002","108.33","0.02","91.53","0.03","106.01","0.02","782.8","0.4","298","","298","","","","","","","","","6","P -1","-P 1","2","","","","- C18 H36 F6 O6 Ru S8 -","- C18 H36 F6 O6 Ru0.5 S8 -","- C18 H36 F6 O6 Ru0.5 S8 -","1","0.5","","William Levason; Simon D. Orchard; Gillian Reid","Synthesis, Spectroscopic, and Structural Studies on Transition Metal Complexes Involving Homoleptic Tripodal Selenoether and Telluroether Coordination","Inorganic Chemistry","2000","39","","3853","3859","10.1021/ic991330r","","","0.71073","MoKα","","","0.0483","","","","0.0502","","","","","","2.569","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321287","11.21","0.0001","17.4512","0.0003","11.2999","0.0002","90","","97.952","0.001","90","","2189.32","0.06","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C16 H31 Mg N O S Si2 -","- C16 H31 Mg N O S Si2 -","- C64 H124 Mg4 N4 O4 S4 Si8 -","4","1","","Weijie Teng; Ulrich Englich; Karin Ruhlandt-Senge","Syntheses, Structures, and Reactivities of Heteroleptic Magnesium Amide Thiolates","Inorganic Chemistry","2000","39","","3875","3880","10.1021/ic9913738","","","0.71073","MoKα","","0.0934","0.0844","","0.2667","0.2484","","","","1.075","1.042","1.042","","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321288","11.1691","0.0001","11.0578","0.0001","26.0671","0.0004","90","","99.906","0.001","90","","3171.44","0.06","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C25 H49 Mg N O S Si2 -","- C25 H49 Mg N O S Si2 -","- C100 H196 Mg4 N4 O4 S4 Si8 -","4","1","","Weijie Teng; Ulrich Englich; Karin Ruhlandt-Senge","Syntheses, Structures, and Reactivities of Heteroleptic Magnesium Amide Thiolates","Inorganic Chemistry","2000","39","","3875","3880","10.1021/ic9913738","","","0.71073","MoKα","","0.0557","0.0398","","0.1039","0.0982","","","","1.025","1.098","1.098","","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321289","42.8293","0.0016","10.9737","0.0005","16.8305","0.0007","90","","98.755","0.003","90","","7818.1","0.6","91","2","91","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C68 H134 Mg2 N2 O5 S2 Si4 -","- C69 H126 Mg2 N2 O4 S2 Si4 -","- C276 H504 Mg8 N8 O16 S8 Si16 -","4","0.5","","Weijie Teng; Ulrich Englich; Karin Ruhlandt-Senge","Syntheses, Structures, and Reactivities of Heteroleptic Magnesium Amide Thiolates","Inorganic Chemistry","2000","39","","3875","3880","10.1021/ic9913738","","","0.71073","MoKα","","0.1331","0.0742","","","0.1865","0.2257","","","","","","1.017","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321290","18.8806","0.0002","19.385","0.0002","27.3012","0.0004","90","","97.25","0.001","90","","9912.4","0.2","90","2","90","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C104.5 H160 Mg2 O2 S4 -","- C79.97 H131.91 Mg2 O2 S4 -","- C319.88 H527.64 Mg8 O8 S16 -","4","1","","Weijie Teng; Ulrich Englich; Karin Ruhlandt-Senge","Syntheses, Structures, and Reactivities of Heteroleptic Magnesium Amide Thiolates","Inorganic Chemistry","2000","39","","3875","3880","10.1021/ic9913738","","","0.71073","MoKα","","0.1023","0.0764","","","0.1903","0.2043","","","","","","1.046","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4321291","11.158","0.005","11.003","0.005","22.109","0.008","90","","99.18","0.03","90","","2680","2","296","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bi[N(tBu)SiMe2]3CH","","- C19 H46 Bi N3 Si3 -","- C19 H46 Bi N3 Si3 -","- C76 H184 Bi4 N12 Si12 -","4","1","","Mark R. Mason; Stanley S. Phulpagar; Mark S. Mashuta; John F. Richardson","Synthesis and Characterization of Chelating Triamide Complexes of Bismuth and Antimony","Inorganic Chemistry","2000","39","","3931","3933","10.1021/ic991462k","","","0.71073","MoKα","","0.0408","0.0374","","","0.04","0.0636","","","","","","1.065","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4321292","11.12","0.003","10.978","0.003","22.086","0.006","90","","99.07","0.02","90","","2662.4","1.3","296","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Sb[N(tBu)SiMe2]3CH","","- C19 H46 N3 Sb Si3 -","- C19 H46 N3 Sb Si3 -","- C76 H184 N12 Sb4 Si12 -","4","1","","Mark R. Mason; Stanley S. Phulpagar; Mark S. Mashuta; John F. Richardson","Synthesis and Characterization of Chelating Triamide Complexes of Bismuth and Antimony","Inorganic Chemistry","2000","39","","3931","3933","10.1021/ic991462k","","","0.71073","MoKα","","0.0457","0.0308","","","0.0322","0.0478","","","","","","1.044","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4321293","14.429","0.001","14.4264","0.001","14.4206","0.001","103.939","0.001","103.928","0.001","103.936","0.001","2681.7","0.3","566","2","566","2","","","","","","","","6","P -1","-P 1","2","","hexakis dimethylpropylenurea bismuth(III) perchlorate","","- C36 H72 Bi Cl3 N12 O18 -","- C36 Bi Cl3 N12 O18 -","- C72 Bi2 Cl6 N24 O36 -","2","1","","Jan Näslund; Ingmar Persson; Magnus Sandstrom","Solvation of the Bismuth(III) Ion by Water, Dimethyl Sulfoxide, N,N'-Dimethylpropyleneurea, and N,N-Dimethylthioformamide. An EXAFS, Large-Angle X-ray Scattering, and Crystallographic Structural Study","Inorganic Chemistry","2000","39","","4012","4021","10.1021/ic000022m","","","0.71073","MoKα","","0.1469","0.0566","","","0.1566","0.1819","","","","","","0.906","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321294","13.837","0.002","13.837","0.002","7.407","0.001","90","","90","","120","","1228.2","0.3","293","2","293","2","","","","","","","","6","P 63/m","-P 6c","176","","nonaaquabismuth(III) trifluorormethanesulfonate","","- C3 H18 Bi F9 O18 S3 -","- C3 H18 Bi F9 O18 S3 -","- C6 H36 Bi2 F18 O36 S6 -","2","0.166667","","Jan Näslund; Ingmar Persson; Magnus Sandstrom","Solvation of the Bismuth(III) Ion by Water, Dimethyl Sulfoxide, N,N'-Dimethylpropyleneurea, and N,N-Dimethylthioformamide. An EXAFS, Large-Angle X-ray Scattering, and Crystallographic Structural Study","Inorganic Chemistry","2000","39","","4012","4021","10.1021/ic000022m","","","0.71069","MoKα","","0.0456","0.0258","","","0.0331","0.0417","","","","","","1","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321295","12.672","0.003","19.438","0.004","18.51","0.004","90","","100.86","0.03","90","","4477.7","1.8","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","octakisdimethylsulfoxidebismuth(III) perchlorate","","- C16 H48 Bi Cl3 O20 S8 -","- C16 Bi Cl3 O20 S8 -","- C64 Bi4 Cl12 O80 S32 -","4","1","","Jan Näslund; Ingmar Persson; Magnus Sandstrom","Solvation of the Bismuth(III) Ion by Water, Dimethyl Sulfoxide, N,N'-Dimethylpropyleneurea, and N,N-Dimethylthioformamide. An EXAFS, Large-Angle X-ray Scattering, and Crystallographic Structural Study","Inorganic Chemistry","2000","39","","4012","4021","10.1021/ic000022m","","","0.71073","MoKα","","0.1544","0.0565","","","0.1157","0.1369","","","","","","0.852","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321296","23","0.005","12.535","0.004","12.341","0.003","119.15","0.02","92.61","0.01","88.54","0.02","3104.1","1.5","298.2","","","","","","","","","","","8","P -1","-P 1","2","","","","- C28 H63 F18 N5 O13 P7 Ru2 S2 -","- C28 H62 F18.35 N5 O13 P7 Ru2 S2 -","- C56 H124 F36.7 N10 O26 P14 Ru4 S4 -","2","1","","Hiroyasu Sugiyama; Md. Munkir Hossain; Yong-Shou Lin; Kazuko Matsumoto","Syntheses of Ketonated Disulfide-Bridged Diruthenium Complexes via C-H Bond Activation and C-S Bond Formation","Inorganic Chemistry","2000","39","","3948","3956","10.1021/ic0000855","","","0.7107","MoKα","","","0.0584","","","","0.0718","","","","","","1.877","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321297","20.993","0.003","13.919","0.004","21.258","0.003","90","","94.95","0.01","90","","6188","2","298.2","","","","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C28 H61 F18 N5 O13 P4 Ru2 S2 Sb3 -","- C28 H60 F18 N5 O13 P4 Ru2 S2 Sb3 -","- C112 H240 F72 N20 O52 P16 Ru8 S8 Sb12 -","4","1","","Hiroyasu Sugiyama; Md. Munkir Hossain; Yong-Shou Lin; Kazuko Matsumoto","Syntheses of Ketonated Disulfide-Bridged Diruthenium Complexes via C-H Bond Activation and C-S Bond Formation","Inorganic Chemistry","2000","39","","3948","3956","10.1021/ic0000855","","","0.7107","MoKα","","","0.062","","","","0.2014","","","","","","0.962","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321298","15.7178","0.0007","24.4198","0.0011","16.8492","0.0008","90","","90.831","0.001","90","","6466.5","0.5","223","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C34 H60 F9 N5 O23 P4 Ru2 S5 -","- C34 H42 F9 N5 O23 P4 Ru2 S5 -","- C136 H168 F36 N20 O92 P16 Ru8 S20 -","4","1","","Hiroyasu Sugiyama; Md. Munkir Hossain; Yong-Shou Lin; Kazuko Matsumoto","Syntheses of Ketonated Disulfide-Bridged Diruthenium Complexes via C-H Bond Activation and C-S Bond Formation","Inorganic Chemistry","2000","39","","3948","3956","10.1021/ic0000855","","","0.71073","MoKα","","0.0961","0.0659","","","0.1953","0.2191","","","","","","1.011","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4321299","12.471","0.003","21.72","0.01","12.206","0.003","101.96","0.03","110.46","0.02","84.28","0.03","3029.1","1.8","298.2","","","","","","","","","","","8","P -1","-P 1","2","","","","- C26 H59 F18 N5 O13 P7 Ru2 S2 -","- C26 H58 F18.81 N5 O13 P7 Ru2 S2 -","- C52 H116 F37.62 N10 O26 P14 Ru4 S4 -","2","1","","Hiroyasu Sugiyama; Md. Munkir Hossain; Yong-Shou Lin; Kazuko Matsumoto","Syntheses of Ketonated Disulfide-Bridged Diruthenium Complexes via C-H Bond Activation and C-S Bond Formation","Inorganic Chemistry","2000","39","","3948","3956","10.1021/ic0000855","","","0.7107","MoKα","","","0.0979","","","","0.1076","","","","","","2.319","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321300","21.62","0.004","12.172","0.002","22.861","0.005","90","","94.75","0.03","90","","5995","2","190","2","190","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","[FeCp(dppe-CN-ZnPc]*0.5CH2Cl2*THF","","","- C68.5 H54 Cl Fe N9 O P2 Zn -","- C68.5 H54 Cl Fe N9 O P2 Zn -","- C274 H216 Cl4 Fe4 N36 O4 P8 Zn4 -","4","1","","Andreas Geiss; Heinrich Vahrenkamp","M(μ-CN)Fe(μ-CN)M' Chains with Phthalocyanine Iron Centers: Preparation, Structures, and Isomerization","Inorganic Chemistry","2000","39","","4029","4036","10.1021/ic0001412","","","0.71073","MoKα","","0.083","0.0706","","","0.212","0.2293","","","","","","1.06","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321301","13.57","0.004","15.394","0.004","18.178","0.006","93.98","0.02","103.32","0.03","108.34","0.02","3465.8","1.9","190","2","190","2","","","","","","","","7","P -1","-P 1","2","[RuCp(PPh3)2-CN-FePc-CN]*2CHCl3","Y","","- C77 H53 Cl6 Fe N10 P2 Ru -","- C77 H53 Cl6 Fe N10 P2 Ru -","- C154 H106 Cl12 Fe2 N20 P4 Ru2 -","2","1","","Andreas Geiss; Heinrich Vahrenkamp","M(μ-CN)Fe(μ-CN)M' Chains with Phthalocyanine Iron Centers: Preparation, Structures, and Isomerization","Inorganic Chemistry","2000","39","","4029","4036","10.1021/ic0001412","","","0.71073","MoKα","","0.1872","0.0749","","","0.1849","0.2404","","","","","","1.061","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321302","25.941","0.005","25.999","0.005","17.352","0.003","90","","119.5","0.03","90","","10186","4","190","2","190","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","[{RuCp(PPh3)2-CN}2-FePc]*1.5CH2Cl2","","","- C119 H92 Cl6 Fe N10 P4 Ru2 -","- C119 H92 Cl6 Fe N10 P4 Ru2 -","- C476 H368 Cl24 Fe4 N40 P16 Ru8 -","4","0.5","","Andreas Geiss; Heinrich Vahrenkamp","M(μ-CN)Fe(μ-CN)M' Chains with Phthalocyanine Iron Centers: Preparation, Structures, and Isomerization","Inorganic Chemistry","2000","39","","4029","4036","10.1021/ic0001412","","","0.71073","MoKα","","0.0808","0.0572","","","0.1553","0.1703","","","","","","1.037","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321303","18.935","0.004","9.017","0.001","25.538","0.007","90","","97.53","0.02","90","","4322.7","1.6","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","[{FeCp(dppe)-CN}2-FePc]SbF6","","","- C96 H74 F6 Fe3 N10 P4 Sb -","- C96 H74 F6 Fe3 N10 P4 Sb -","- C192 H148 F12 Fe6 N20 P8 Sb2 -","2","0.5","","Andreas Geiss; Heinrich Vahrenkamp","M(μ-CN)Fe(μ-CN)M' Chains with Phthalocyanine Iron Centers: Preparation, Structures, and Isomerization","Inorganic Chemistry","2000","39","","4029","4036","10.1021/ic0001412","","","0.71073","MoKα","","0.1789","0.0714","","","0.1981","0.2504","","","","","","1.082","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321304","14.348","0.003","16.021","0.003","25.072","0.005","81.22","0.03","81.26","0.03","79.73","0.03","5558","2","293","2","293","2","","","","","","","","8","P -1","-P 1","2","[{RuCp(PPh3)2-CN}2-FePc]SbF6","","","- C116 H86 F6 Fe N10 P4 Ru2 Sb -","- C116 H86 F6 Fe N10 P4 Ru2 Sb -","- C232 H172 F12 Fe2 N20 P8 Ru4 Sb2 -","2","1","","Andreas Geiss; Heinrich Vahrenkamp","M(μ-CN)Fe(μ-CN)M' Chains with Phthalocyanine Iron Centers: Preparation, Structures, and Isomerization","Inorganic Chemistry","2000","39","","4029","4036","10.1021/ic0001412","","","0.71073","MoKα","","0.2176","0.0728","","","0.187","0.248","","","","","","1.038","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321305","26.902","0.008","14.788","0.004","29.957","0.011","90","","108.08","0.02","90","","11329","6","190","2","190","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","[RuCp(PPh3)2-CN-FePc-CN-RuCp(PPh3)2]SbF6","","","- C116 H86 F6 Fe N10 P4 Ru2 Sb -","- C116 H86 F6 Fe N10 P4 Ru2 Sb -","- C464 H344 F24 Fe4 N40 P16 Ru8 Sb4 -","4","1","","Andreas Geiss; Heinrich Vahrenkamp","M(μ-CN)Fe(μ-CN)M' Chains with Phthalocyanine Iron Centers: Preparation, Structures, and Isomerization","Inorganic Chemistry","2000","39","","4029","4036","10.1021/ic0001412","","","0.71073","MoKα","","0.0975","0.0788","","","0.2384","0.2665","","","","","","1.037","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321306","19.1011","0.0009","18.2873","0.0009","21.507","0.001","90","","108.64","0.001","90","","7118.5","0.6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C62.5 H58.5 N6 O20 P4 Pu -","- C62.5 H56 N6 O20 P4 Pu -","- C250 H224 N24 O80 P16 Pu4 -","4","1","","Evelyn M. Bond; Eileen N. Duesler; Robert T. Paine; Mary P. Neu; John H. Matonic; Brian L. Scott","Synthesis and Molecular Structure of a Plutonium(IV) Coordination Complex: [Pu(NO3)2{2,6-[(C6H5)2P(O)CH2]2C5H3NO}2](NO3)2.1.5H2O.0.5MeOH","Inorganic Chemistry","2000","39","","4152","4155","10.1021/ic000146z","","","0.71073","MoKα","","0.0488","0.0368","","0.1039","0.0978","","","","1.172","1.216","1.216","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321307","47.576","0.002","12.9029","0.0015","13.664","0.002","90","","97.353","0.004","90","","8318.9","1.6","130","2","130","2","","","","","","","","6","C 1 2 1","C 2y","5","","[Fe(TMCP)(OH2)(HOEt)]2[Fe(TMCP)(HOEt)2](ClO4)3.(EtOH)2.(CHCl3)1.45","","- C157.46 H197.46 Cl7.36 Fe3 N12 O44 -","- C157.454 H195.454 Cl7.362 Fe3 N12 O44 -","- C314.908 H390.908 Cl14.724 Fe6 N24 O88 -","2","0.5","","Jean-Pierre Simonato; Jacques Pécaut; Laurent Le Pape; Jean-Louis Oddou; Claudine Jeandey; Maoyu Shang; W. Robert Scheidt; Jacek Wojaczyński; Stanisław Wołowiec; Lechosław Latos-Grażyński; Jean-Claude Marchon","An Integrated Approach to the Mid-Spin State (S= 3/2) in Six-Coordinate Iron(III) Chiroporphyrins","Inorganic Chemistry","2000","39","","3978","3987","10.1021/ic000150a","","","0.71073","MoKα","","0.0849","0.0671","","0.1754","0.1604","","","","1.022","1.033","1.033","","","","","has coordinates,has disorder","179316","2020-10-21","18:00:00",""
"4321308","13.1966","0.0002","13.89","0.0002","17.81","","79.215","0.001","76.486","0.001","89.173","0.001","3116.66","0.07","193","2","193","2","","","","","","","","6","P 1","P 1","1","","[Fe(TMCP)(OH2)(HOEt)](ClO4).[Fe(TMCP)(OH2)(HOEt)](H2O)(ClO4).(CHCl3)5","","- C52.5 H63.5 Cl8.5 Fe N4 O14.5 -","- C52.5 H57 Cl8.5 Fe N4 O14.5 -","- C105 H114 Cl17 Fe2 N8 O29 -","2","2","","Jean-Pierre Simonato; Jacques Pécaut; Laurent Le Pape; Jean-Louis Oddou; Claudine Jeandey; Maoyu Shang; W. Robert Scheidt; Jacek Wojaczyński; Stanisław Wołowiec; Lechosław Latos-Grażyński; Jean-Claude Marchon","An Integrated Approach to the Mid-Spin State (S= 3/2) in Six-Coordinate Iron(III) Chiroporphyrins","Inorganic Chemistry","2000","39","","3978","3987","10.1021/ic000150a","","","0.71073","MoKα","","0.0619","0.0587","","","0.1611","0.1664","","","","","","1.018","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321309","15.715","0.002","12.045","0.002","20.022","0.003","90","","94.863","0.012","90","","3776.3","1","150","","150","","","","","","","","see text","6","C 1 c 1","C -2yc","9","","","","- C34 H54 N3 O5 Re S2 -","- C34 H54 N3 O5 Re S2 -","- C136 H216 N12 O20 Re4 S8 -","4","1","","Kjeld J. C. van Bommel; Willem Verboom; Ron Hulst; Huub Kooijman; Anthony L. Spek; David N. Reinhoudt","Calix[4]arene Rhenium(V) Complexes as Potential Radiopharmaceuticals","Inorganic Chemistry","2000","39","","4099","4106","10.1021/ic000172x","","","0.71073","MoKα","","0.0388","0.0342","","","0.085","0.0878","","","","","","1.035","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321310","38.963","0.005","23.14","0.006","27.382","0.006","90","","128.456","0.01","90","","19333","8","150","","150","","","","","","","","see text","5","C 1 2/c 1","-C 2yc","15","","","","- C112 H120 N4 O15 Re2 -","- C112 H120 N4 O15 Re2 -","- C896 H960 N32 O120 Re16 -","8","1","","Kjeld J. C. van Bommel; Willem Verboom; Ron Hulst; Huub Kooijman; Anthony L. Spek; David N. Reinhoudt","Calix[4]arene Rhenium(V) Complexes as Potential Radiopharmaceuticals","Inorganic Chemistry","2000","39","","4099","4106","10.1021/ic000172x","","","0.71073","MoKα","","0.0786","0.0519","","","0.1138","0.1268","","","","","","1.025","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321311","9.401","0.005","14.712","0.002","29.956","0.006","90","","90","","90","","4143","2","293","2","293","2","","","","","","","","8","P c a b","-P 2bc 2ac","61","","","","- C13 H15 F4 Fe N3 O2 P4 S -","- C13 H15 F4 Fe N3 O2 P4 S -","- C104 H120 F32 Fe8 N24 O16 P32 S8 -","8","1","","K. Muralidharan; N. Dastagiri Reddy; Anil J. Elias","Syntheses of Novel Exo and Endo Isomers of Ansa-Substituted Fluorophosphazenes and Their Facile Transformations into Spiro Isomers in the Presence of Fluoride Ions","Inorganic Chemistry","2000","39","","3988","3994","10.1021/ic0001863","","","0.71073","MoKα","","0.0961","0.044","","","0.1395","0.1861","","","","","","1.236","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321312","11.209","","13.965","","14.969","","109.55","","97.07","","111.79","","1966.72","","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C13 H15 F4 Fe N3 O2 P4 S -","- C13 H15 F4 Fe N3 O2 P4 S -","- C52 H60 F16 Fe4 N12 O8 P16 S4 -","4","2","","K. Muralidharan; N. Dastagiri Reddy; Anil J. Elias","Syntheses of Novel Exo and Endo Isomers of Ansa-Substituted Fluorophosphazenes and Their Facile Transformations into Spiro Isomers in the Presence of Fluoride Ions","Inorganic Chemistry","2000","39","","3988","3994","10.1021/ic0001863","","","0.71073","MoKα","","0.0395","0.0314","","","0.0988","0.108","","","","","","0.948","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321313","13.247","","10.747","","13.995","","90","","100.21","","90","","1960.85","","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C13 H15 F4 Fe N3 O2 P4 S -","- C13 H15 F4 Fe N3 O2 P4 S -","- C52 H60 F16 Fe4 N12 O8 P16 S4 -","4","1","","K. Muralidharan; N. Dastagiri Reddy; Anil J. Elias","Syntheses of Novel Exo and Endo Isomers of Ansa-Substituted Fluorophosphazenes and Their Facile Transformations into Spiro Isomers in the Presence of Fluoride Ions","Inorganic Chemistry","2000","39","","3988","3994","10.1021/ic0001863","","","0.71073","MoKα","","0.0507","0.0316","","","0.0975","0.1145","","","","","","0.869","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321314","8.006","","8.685","","13.006","","86.39","","80.65","","70.67","","841.977","","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C9 H11 F4 N3 O2 P4 S -","- C9 H11 F4 N3 O2 P4 S -","- C18 H22 F8 N6 O4 P8 S2 -","2","1","","K. Muralidharan; N. Dastagiri Reddy; Anil J. Elias","Syntheses of Novel Exo and Endo Isomers of Ansa-Substituted Fluorophosphazenes and Their Facile Transformations into Spiro Isomers in the Presence of Fluoride Ions","Inorganic Chemistry","2000","39","","3988","3994","10.1021/ic0001863","","","0.71073","MoKα","","0.0559","0.0454","","","0.1254","0.129","","","","","","1.93","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321315","13.4186","0.0002","12.2468","0.0002","15.9193","0.0003","90","","92.143","0.001","90","","2614.27","0.08","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Er C9H9O6 4.5(H2O)","","","- C9 H18 Er O10.5 -","- C9 H9 Er O10.5 -","- C72 H72 Er8 O84 -","8","1","","Long Pan; E. Brice Woodlock; Xiaotai Wang; Chong Zheng","A New Porous Three-Dimensional Lanthanide Coordination Polymer","Inorganic Chemistry","2000","39","","4174","4178","10.1021/ic000209d","","","0.71073","MoKα","","0.0384","0.0356","","","0.0822","0.0837","","","","","","1.222","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321316","14.918","0.0008","9.3492","0.0005","8.8051","0.0005","90","","114.756","0.001","90","","1115.2","0.11","198","2","198","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H8 Mn N2 O4 -","- C12 H8 Mn N2 O4 -","- C48 H32 Mn4 N8 O16 -","4","0.5","","Wenbin Lin; Mary E. Chapman; Zhiyong Wang; Gordon T. Yee","Three-Dimensional Manganese(II) Coordination Polymers Based on m-Pyridinecarboxylates: Synthesis, X-ray Structures, and Magnetic Properties","Inorganic Chemistry","2000","39","","4169","4173","10.1021/ic000227v","","","0.71073","MoKα","","0.0258","0.025","","","0.0727","0.0738","","","","","","1.003","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321317","26.9621","0.0013","10.1005","0.0005","7.9512","0.0004","90","","93.393","0.002","90","","2161.56","0.18","198","2","198","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H16 Mn N2 O4 -","- C28 H16 Mn N2 O4 -","- C112 H64 Mn4 N8 O16 -","4","0.5","","Wenbin Lin; Mary E. Chapman; Zhiyong Wang; Gordon T. Yee","Three-Dimensional Manganese(II) Coordination Polymers Based on m-Pyridinecarboxylates: Synthesis, X-ray Structures, and Magnetic Properties","Inorganic Chemistry","2000","39","","4169","4173","10.1021/ic000227v","","","0.71073","MoKα","","0.1101","0.0642","","","0.1278","0.145","","","","","","1.342","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321318","19.7813","0.0003","12.4875","0.0003","20.3735","0.0004","90","","118.191","0.006","90","","4435.7","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C33 H43 Co N5 O15.5 Tb -","- C33.12 H7 Co N4.89 O15.5 Tb -","- C132.48 H28 Co4 N19.56 O62 Tb4 -","4","1","","Yong Cui; Gang Chen; Jin Ren; Yitai Qian; Jinshun Huang","Syntheses, Structures and Magnetic Behaviors of Di- and Trinuclear Pivalate Complexes Containing Both Cobalt(II) and Lanthanide(III) Ions","Inorganic Chemistry","2000","39","","4165","4168","10.1021/ic000230e","","","0.71073","MoKα","","0.1129","0.0801","","","0.2203","0.2479","","","","1.114","1.114","1.039","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4321319","12.2338","0.0002","13.367","0.0003","15.0987","0.0003","111.606","0.002","93.393","0.003","102.323","0.003","2216.76","0.09","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C38.5 H57.5 Co Gd N1.5 O11 -","- C38.04 H25 Co Gd N1.89 O11 -","- C76.08 H50 Co2 Gd2 N3.78 O22 -","2","1","","Yong Cui; Gang Chen; Jin Ren; Yitai Qian; Jinshun Huang","Syntheses, Structures and Magnetic Behaviors of Di- and Trinuclear Pivalate Complexes Containing Both Cobalt(II) and Lanthanide(III) Ions","Inorganic Chemistry","2000","39","","4165","4168","10.1021/ic000230e","","","0.71073","MoKα","","0.054","0.0441","","","0.119","0.1243","","","","1.11","1.11","1.054","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4321320","22.282","0.005","11.644","0.002","24.301","0.005","90","","115.79","0.03","90","","5677","2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C48 H68 Co2 Gd N3 O15 -","- C48 H14 Co2 Gd N3 O15 -","- C192 H56 Co8 Gd4 N12 O60 -","4","0.5","","Yong Cui; Gang Chen; Jin Ren; Yitai Qian; Jinshun Huang","Syntheses, Structures and Magnetic Behaviors of Di- and Trinuclear Pivalate Complexes Containing Both Cobalt(II) and Lanthanide(III) Ions","Inorganic Chemistry","2000","39","","4165","4168","10.1021/ic000230e","","","0.71073","MoKα","","0.1099","0.0558","","","0.1315","0.1553","","","","1.063","1.063","0.956","","","","has coordinates,has disorder","179316","2020-10-21","18:00:00",""
"4321321","12.9986","0.0003","19.977","0.0003","14.7452","0.0001","90","","97.592","0.001","90","","3795.37","0.11","173","2","173","2","","","","","","","J. Halfen / Prof. W. Tolman","5","P 1 21/n 1","-P 2yn","14","96170","","","- C41 H56 B Cu N4 -","- C41 H56 B Cu N4 -","- C164 H224 B4 Cu4 N16 -","4","1","","Bernice M. T. Lam; Jason A. Halfen; Victor G. Young,; John R. Hagadorn; Patrick L. Holland; Agustí Lledós; Lourdes Cucurull-Sánchez; Juan J. Novoa; Santiago Alvarez; William B. Tolman","Ligand Macrocycle Structural Effects on Copper-Dioxygen Reactivity","Inorganic Chemistry","2000","39","","4059","4072","10.1021/ic000248p","","","0.71073","MoKα","","0.1059","0.0629","","0.1105","0.0968","","","","1.094","1.18","1.18","","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321322","9.9638","0.0004","13.3049","0.0006","19.5424","0.0009","90","","90","","90","","2590.7","0.2","293","2","293","2","","","","","","","B. Lam/ Prof. W. Tolman","6","P 21 21 21","P 2ac 2ab","19","97011","","","- C18 H38 Cu F6 N4 Sb -","- C18 H38 Cu F6 N4 Sb -","- C72 H152 Cu4 F24 N16 Sb4 -","4","1","","Bernice M. T. Lam; Jason A. Halfen; Victor G. Young,; John R. Hagadorn; Patrick L. Holland; Agustí Lledós; Lourdes Cucurull-Sánchez; Juan J. Novoa; Santiago Alvarez; William B. Tolman","Ligand Macrocycle Structural Effects on Copper-Dioxygen Reactivity","Inorganic Chemistry","2000","39","","4059","4072","10.1021/ic000248p","","","0.71073","MoKα","","0.0612","0.0461","","0.119","0.1094","","","","1.04","1.093","1.093","","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321323","17.4559","0.0003","8.3552","0.0001","15.025","0.0003","90","","90","","90","","2191.36","0.06","173","2","173","2","","","","","","","B. Lam / Prof. W. Tolman","6","P c a 21","P 2c -2ac","29","97301a","","","- C18 H39 Cl Cu N3 O4 -","- C18 H39 Cl Cu N3 O4 -","- C72 H156 Cl4 Cu4 N12 O16 -","4","1","","Bernice M. T. Lam; Jason A. Halfen; Victor G. Young,; John R. Hagadorn; Patrick L. Holland; Agustí Lledós; Lourdes Cucurull-Sánchez; Juan J. Novoa; Santiago Alvarez; William B. Tolman","Ligand Macrocycle Structural Effects on Copper-Dioxygen Reactivity","Inorganic Chemistry","2000","39","","4059","4072","10.1021/ic000248p","","","0.71073","MoKα","","0.0352","0.0285","","0.0579","0.056","","","","1.074","1.094","1.094","","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321324","7.5134","0.0001","14.2737","0.0003","8.2653","0.0002","90","","98.264","0.001","90","","877.2","0.03","173","2","173","2","","","","","","","B. Lam / Prof. W. Tolman","6","P 1 21 1","P 2yb","4","97328aaa","","","- C12 H26 Cl Cu N4 O4 -","- C12 H26 Cl Cu N4 O4 -","- C24 H52 Cl2 Cu2 N8 O8 -","2","1","","Bernice M. T. Lam; Jason A. Halfen; Victor G. Young,; John R. Hagadorn; Patrick L. Holland; Agustí Lledós; Lourdes Cucurull-Sánchez; Juan J. Novoa; Santiago Alvarez; William B. Tolman","Ligand Macrocycle Structural Effects on Copper-Dioxygen Reactivity","Inorganic Chemistry","2000","39","","4059","4072","10.1021/ic000248p","","","0.71073","MoKα","","0.0596","0.0562","","0.1611","0.1561","","","","1.075","1.081","1.081","","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321325","14.4665","0.0003","11.7064","0.0002","27.8227","0.0006","90","","104.728","0.001","90","","4556.98","0.16","148","2","148","2","","","","","","","B. Lam / Prof. W. Tolman","8","P 1 n 1","P -2yac","7","98038cc","","","- C91 H90 B2 Cl4 Cu2 D42 N6 O5 -","- C80 H110 B2 Cu2 N6 O2 -","- C160 H220 B4 Cu4 N12 O4 -","2","1","","Bernice M. T. Lam; Jason A. Halfen; Victor G. Young,; John R. Hagadorn; Patrick L. Holland; Agustí Lledós; Lourdes Cucurull-Sánchez; Juan J. Novoa; Santiago Alvarez; William B. Tolman","Ligand Macrocycle Structural Effects on Copper-Dioxygen Reactivity","Inorganic Chemistry","2000","39","","4059","4072","10.1021/ic000248p","","","0.71073","MoKα","","0.084","0.0524","","0.1321","0.1197","","","","0.961","1.156","1.156","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321326","12.5429","0.0002","12.9911","0.0002","28.0132","0.0001","85.0661","0.0004","89.7265","0.0008","88.4361","0.0006","4546.02","0.1","173","2","173","2","","","","","","","B. Lam / Prof. W. Tolman","7","P -1","-P 1","2","98097","","","- C89.5 H127 B2 Cl8 Cu2 N6 O4.5 -","- C89.5 H127 B2 Cl8 Cu2 N6 O4.5 -","- C179 H254 B4 Cl16 Cu4 N12 O9 -","2","1","","Bernice M. T. Lam; Jason A. Halfen; Victor G. Young,; John R. Hagadorn; Patrick L. Holland; Agustí Lledós; Lourdes Cucurull-Sánchez; Juan J. Novoa; Santiago Alvarez; William B. Tolman","Ligand Macrocycle Structural Effects on Copper-Dioxygen Reactivity","Inorganic Chemistry","2000","39","","4059","4072","10.1021/ic000248p","","","0.71073","MoKα","","0.1433","0.0989","","0.2511","0.2259","","","","1.055","1.172","1.172","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4321327","8.7398","0.0006","8.5565","0.0006","20.5662","0.0015","90","","95.705","0.001","90","","1530.37","0.19","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","98165","","","- C20 H48 Cl2 Cu2 N6 O10 -","- C20 H48 Cl2 Cu2 N6 O10 -","- C40 H96 Cl4 Cu4 N12 O20 -","2","0.5","","Bernice M. T. Lam; Jason A. Halfen; Victor G. Young,; John R. Hagadorn; Patrick L. Holland; Agustí Lledós; Lourdes Cucurull-Sánchez; Juan J. Novoa; Santiago Alvarez; William B. Tolman","Ligand Macrocycle Structural Effects on Copper-Dioxygen Reactivity","Inorganic Chemistry","2000","39","","4059","4072","10.1021/ic000248p","","","0.71073","MoKα","","0.0785","0.0561","","0.1328","0.1231","","","","1.097","1.164","1.164","","","","","has coordinates,has disorder","179316","2020-10-21","18:00:00",""
"4321328","11.915","0.006","13.861","0.002","17.065","0.008","90","","102.14","0.02","90","","2755.3","1.9","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H39 Cl2 Cu N5 O12 -","- C18 H39 Cl2 Cu N5 O12 -","- C72 H156 Cl8 Cu4 N20 O48 -","4","1","","Paul V. Bernhardt; Philip C. Sharpe","C-Substituted Macrocycles as Candidates for Radioimmunotherapy","Inorganic Chemistry","2000","39","","4123","4129","10.1021/ic000315f","","","0.71073","MoKα","","0.062","0.0419","","","0.1175","0.1305","","","","","","1.045","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321329","9.55","0.003","17.977","0.002","14.612","0.004","90","","96.76","0.01","90","","2491.2","1.1","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H33 Cl2 Cu N5 O9 -","- C18 H33 Cl2 Cu N5 O9 -","- C72 H132 Cl8 Cu4 N20 O36 -","4","1","","Paul V. Bernhardt; Philip C. Sharpe","C-Substituted Macrocycles as Candidates for Radioimmunotherapy","Inorganic Chemistry","2000","39","","4123","4129","10.1021/ic000315f","","","0.71073","MoKα","","0.0943","0.0507","","","0.1362","0.1594","","","","","","1.027","","","","has coordinates,has disorder","179316","2020-10-21","18:00:00",""
"4321330","9.286","0.002","11.294","0.001","23.609","0.008","90","","93.68","0.01","90","","2470.9","1","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C19 H36 Cl3 Cu N5 O3 -","- C19 H36 Cl3 Cu N5 O3 -","- C76 H144 Cl12 Cu4 N20 O12 -","4","1","","Paul V. Bernhardt; Philip C. Sharpe","C-Substituted Macrocycles as Candidates for Radioimmunotherapy","Inorganic Chemistry","2000","39","","4123","4129","10.1021/ic000315f","","","0.71073","MoKα","","0.1013","0.0678","","","0.1745","0.2003","","","","","","1.075","","","","has coordinates,has disorder","179316","2020-10-21","18:00:00",""
"4321331","14.0535","0.0004","13.722","0.0003","11.398","0.0002","90","","106.057","0.001","90","","2112.26","0.09","188","2","188","2","","","","","","","","5","C 1 c 1","C -2yc","9","HtBuDATI","","","- C23 H27 N3 O2 S -","- C23 H27 N3 O2 S -","- C92 H108 N12 O8 S4 -","4","1","","Katherine J. Franz; Nisha Singh; Bernhard Spingler; Stephen J. Lippard","Aminotroponiminates as Ligands for Potential Metal-Based Nitric Oxide Sensors","Inorganic Chemistry","2000","39","","4081","4092","10.1021/ic000344q","","","0.71073","MoKα","","0.0265","0.0254","","","0.0686","0.0693","","","","","","1.028","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4321332","9.4007","0.0003","10.7556","0.0004","12.9497","0.0005","76.923","0.001","76.88","0.001","85.408","0.001","1241.53","0.08","188","2","188","2","","","","","","","","4","P -1","-P 1","2","[Co(i-Pr2ATI)2]","","","- C26 H38 Co N4 -","- C26 H38 Co N4 -","- C52 H76 Co2 N8 -","2","1","","Katherine J. Franz; Nisha Singh; Bernhard Spingler; Stephen J. Lippard","Aminotroponiminates as Ligands for Potential Metal-Based Nitric Oxide Sensors","Inorganic Chemistry","2000","39","","4081","4092","10.1021/ic000344q","","","0.71073","MoKα","","0.0442","0.037","","","0.0881","0.0933","","","","","","1.084","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321333","12.1739","0.0002","13.2855","0.0003","14.8238","0.0003","102.769","0.001","101.401","0.001","94.309","0.001","2274.34","0.08","188","2","188","2","","","","","","","","7","P -1","-P 1","2","[Co(iPrDATI)2]","","","- C45 H48 Cl2 Co N6 O4 S2 -","- C45 H48 Cl2 Co N6 O4 S2 -","- C90 H96 Cl4 Co2 N12 O8 S4 -","2","1","","Katherine J. Franz; Nisha Singh; Bernhard Spingler; Stephen J. Lippard","Aminotroponiminates as Ligands for Potential Metal-Based Nitric Oxide Sensors","Inorganic Chemistry","2000","39","","4081","4092","10.1021/ic000344q","","","0.71073","MoKα","","0.0762","0.0545","","","0.1353","0.1505","","","","","","1.016","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321334","12.5699","0.0003","13.3766","0.0003","14.7858","0.0002","104.016","0.001","93.837","0.002","100.807","0.001","2352.81","0.09","188","2","188","2","","","","","","","","7","P -1","-P 1","2","[Zn(iPrDATI)2]","","","- C50 H48 Cl N6 O4 S2 Zn -","- C50 H48 Cl N6 O4 S2 Zn -","- C100 H96 Cl2 N12 O8 S4 Zn2 -","2","1","","Katherine J. Franz; Nisha Singh; Bernhard Spingler; Stephen J. Lippard","Aminotroponiminates as Ligands for Potential Metal-Based Nitric Oxide Sensors","Inorganic Chemistry","2000","39","","4081","4092","10.1021/ic000344q","","","0.71073","MoKα","","0.1054","0.0577","","","0.1292","0.1458","","","","","","1.026","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321335","13.616","0.002","14.0595","0.0016","15.382","0.002","85.397","0.011","63.753","0.012","73.341","0.007","2526.5","0.6","188","2","188","2","","","","","","","","7","P -1","-P 1","2","[Co(tBuDATI)2]","","","- C51 H54 Cl2 Co N6 O5 S2 -","- C51 H54 Cl2 Co N6 O5 S2 -","- C102 H108 Cl4 Co2 N12 O10 S4 -","2","1","","Katherine J. Franz; Nisha Singh; Bernhard Spingler; Stephen J. Lippard","Aminotroponiminates as Ligands for Potential Metal-Based Nitric Oxide Sensors","Inorganic Chemistry","2000","39","","4081","4092","10.1021/ic000344q","","","0.71073","MoKα","","0.0562","0.0404","","","0.1111","0.1183","","","","","","1.04","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321336","17.3577","0.0005","22.5064","0.0007","25.2381","0.0008","90","","90","","90","","9859.5","0.5","188","2","188","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","[Co(BzDATI)2]","","","- C54.5 H48 Cl Co N6 O4.5 S2 -","- C54.5 H48 Cl Co N6 O4.5 S2 -","- C436 H384 Cl8 Co8 N48 O36 S16 -","8","1","","Katherine J. Franz; Nisha Singh; Bernhard Spingler; Stephen J. Lippard","Aminotroponiminates as Ligands for Potential Metal-Based Nitric Oxide Sensors","Inorganic Chemistry","2000","39","","4081","4092","10.1021/ic000344q","","","0.71073","MoKα","","0.0876","0.0447","","","0.1037","0.1203","","","","","","1.007","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4321337","21.216","0.002","11.089","0.001","7.287","0.001","90","","90","","90","","1714.4","0.3","173","2","173","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C9 H27 N5 S2 Si -","- C9 H27 N5 S2 Si -","- C36 H108 N20 S8 Si4 -","4","0.5","","Tobias Borrmann; Andrey V. Zibarev; Enno Lork; Gerd Knitter; Shan-Jia Chen; Paul G. Watson; Edgardo Cutin; Makhmut M. Shakirov; Wolf-Dieter Stohrer; Rüdiger Mews","TAS+(Z)-Me3CNSN- and TAS+(E)-Me3SiNSN-: Does the Anion-Cation Interaction Influence the Configuration?","Inorganic Chemistry","2000","39","","3999","4005","10.1021/ic0004030","","","0.71073","MoKα","","0.0477","0.0347","","","0.092","0.0957","","","","","","0.978","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321338","8.9861","0.0007","9.1766","0.0008","13.6563","0.0011","82.763","0.001","89.169","0.002","68.154","0.001","1036.29","0.15","293","2","293","2","","","","","","","","6","P -1","-P 1","2","Vanadium borophosphate","","","- B H22 N5 O20 P3 V3 -","- B N5 O20 P3 V3 -","- B2 N10 O40 P6 V6 -","2","1","","Ranko P. Bontchev; Junghwan Do; Allan J. Jacobson","The Vanadium(V) Borophosphate (NH4)5[V3BP3O19].H2O","Inorganic Chemistry","2000","39","","4179","4181","10.1021/ic000436f","","","0.71073","MoKα","","0.0444","0.0407","","0.1009","0.0993","","","","1.37","1.404","1.404","","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321339","7.5389","0.001","9.5627","0.0016","11.0499","0.0017","94.848","0.013","109.876","0.01","100.905","0.012","726","0.2","198","2","198","2","","","","","","","","4","P -1","-P 1","2","[(n-Pr)2ATI]GeN3","","","- C13 H19 Ge N5 -","- C13 H19 Ge N5 -","- C26 H38 Ge2 N10 -","2","1","","Ashley E. Ayers; Dennis S. Marynick; H. V. Rasika Dias","Azido Derivatives of Low-Valent Group 14 Elements: Synthesis, Characterization, and Electronic Structure of [(n-Pr)2ATI]GeN3 and [(n-Pr)2ATI]SnN3 Featuring Heterobicyclic 10-π-Electron Ring Systems","Inorganic Chemistry","2000","39","","4147","4151","10.1021/ic000545u","","","0.71073","MoKα","","0.0216","0.0211","","","0.0527","0.053","","","","","","1.083","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321340","7.9221","0.001","10.1385","0.0013","19.989","0.003","90.465","0.014","91.358","0.012","111.82","0.009","1489.8","0.4","198","2","198","2","","","","","","","","4","P -1","-P 1","2","[(n-Pr)2ATI]SnN3","","","- C13 H19 N5 Sn -","- C13 H19 N5 Sn -","- C52 H76 N20 Sn4 -","4","2","","Ashley E. Ayers; Dennis S. Marynick; H. V. Rasika Dias","Azido Derivatives of Low-Valent Group 14 Elements: Synthesis, Characterization, and Electronic Structure of [(n-Pr)2ATI]GeN3 and [(n-Pr)2ATI]SnN3 Featuring Heterobicyclic 10-π-Electron Ring Systems","Inorganic Chemistry","2000","39","","4147","4151","10.1021/ic000545u","","","0.71073","MoKα","","0.0279","0.0253","","","0.0667","0.0683","","","","","","1.095","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321341","12.233","0.002","14.341","0.002","20.726","0.003","90","","90","","90","","3636","0.9","293","2","293","2","","","","","","","gm","6","P b c a","-P 2ac 2ab","61","","Technetium(3+)[1,4,7-trithiacyclononane][2,2'-thiodiethanethiolate(2-)] tetraflouroborate(-)","","- C10 H20 B F4 S6 Tc -","- C10 H20 B F4 S6 Tc -","- C80 H160 B8 F32 S48 Tc8 -","8","1","","Gregory E. D. Mullen; Philip J. Blower; Daniel J. Price; Anne K. Powell; Mark J. Howard; Michael J. Went","Trithiacyclononane as a Ligand for Potential Technetium and Rhenium Radiopharmaceuticals: Synthesis of [M(9S3)(SC2H4SC2H4S)][BF4] (M =99Tc, Re, 188Re) via C-S Bond Cleavage","Inorganic Chemistry","2000","39","","4093","4098","10.1021/ic991240m","","","0.71073","MoKα","","0.0465","0.0358","","0.0935","0.0876","","","","0.988","1.034","1.034","","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321342","8.777","0.001","13.656","0.001","9.162","0.001","90","","113.6","0.2","90","","1006.3","1.5","298","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H26 Mn N4 O14 -","- C12 H26 Mn N4 O14 -","- C24 H52 Mn2 N8 O28 -","2","0.5","","M. Matzapetakis; N. Karligiano; A. Bino; M. Dakanali; C. P. Raptopoulou; V. Tangoulis; A. Terzis; J. Giapintzakis; A. Salifoglou","Manganese Citrate Chemistry: Syntheses, Spectroscopic Studies, and Structural Characterizations of Novel Mononuclear, Water-Soluble Manganese Citrate Complexes","Inorganic Chemistry","2000","39","","4044","4051","10.1021/ic9912631","","","0.71073","MoKα","","0.0422","0.0356","","0.0933","0.0903","","","","1.039","1.083","1.083","","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321343","9.606","0.003","9.914","0.003","7.247","0.003","91.05","0.01","105.6","0.01","119.16","0.01","571.3","0.4","298","","298","","","","","","","","","5","P -1","-P 1","2","","","","- C12 H32 Mn N5 O16 -","- C12 H32 Mn N5 O16 -","- C12 H32 Mn N5 O16 -","1","0.5","","M. Matzapetakis; N. Karligiano; A. Bino; M. Dakanali; C. P. Raptopoulou; V. Tangoulis; A. Terzis; J. Giapintzakis; A. Salifoglou","Manganese Citrate Chemistry: Syntheses, Spectroscopic Studies, and Structural Characterizations of Novel Mononuclear, Water-Soluble Manganese Citrate Complexes","Inorganic Chemistry","2000","39","","4044","4051","10.1021/ic9912631","","","0.71073","MoKα","","0.0324","0.0309","","0.0839","0.0823","","","","1.055","1.061","1.061","","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321344","11.8576","0.0012","12.671","0.0013","14.722","0.002","90","","90","","90","","2211.9","0.4","225","","225","","","","","","","","see text","6","P b c a","-P 2ac 2ab","61","","","","- C8 H10 Cl2 N O2 V -","- C8 H10 Cl2 N O2 V -","- C64 H80 Cl16 N8 O16 V8 -","8","1","","Henk Hagen; Chris Bezemer; Jaap Boersma; Huub Kooijman; Martin Lutz; Anthony L. Spek; Gerard van Koten","Vanadium(IV) and -(V) Complexes with O,N-Chelating Aminophenolate and Pyridylalkoxide Ligands","Inorganic Chemistry","2000","39","","3970","3977","10.1021/ic991415s","","","0.71073","MoKα","","0.0944","0.052","","","0.1173","0.1378","","","","","","1.045","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321345","11.1557","0.0006","12.5744","0.0012","13.1051","0.0014","64.244","0.008","70.472","0.007","87.95","0.006","1547.4","0.3","150","","150","","","","","","","","see text","5","P -1","-P 1","2","","","","- C32 H47 N3 O3 V -","- C28 H37 N3 O2 V -","- C56 H74 N6 O4 V2 -","2","1","","Henk Hagen; Chris Bezemer; Jaap Boersma; Huub Kooijman; Martin Lutz; Anthony L. Spek; Gerard van Koten","Vanadium(IV) and -(V) Complexes with O,N-Chelating Aminophenolate and Pyridylalkoxide Ligands","Inorganic Chemistry","2000","39","","3970","3977","10.1021/ic991415s","","","0.71073","MoKα","","0.1135","0.0666","","","0.1448","0.1634","","","","","","0.963","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321346","8.6034","0.0003","13.3614","0.0004","15.1044","0.0005","98.182","0.003","105.618","0.002","107.13","0.002","1551","0.1","150","","150","","","","","","","","see text","5","P -1","-P 1","2","","","","- C34 H43 N3 O2 V -","- C34 H43 N3 O2 V -","- C68 H86 N6 O4 V2 -","2","1","","Henk Hagen; Chris Bezemer; Jaap Boersma; Huub Kooijman; Martin Lutz; Anthony L. Spek; Gerard van Koten","Vanadium(IV) and -(V) Complexes with O,N-Chelating Aminophenolate and Pyridylalkoxide Ligands","Inorganic Chemistry","2000","39","","3970","3977","10.1021/ic991415s","","","0.71073","MoKα","","0.0739","0.0575","","","0.1489","0.159","","","","","","1.056","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321347","19.115","0.0013","11.296","0.0008","18.7432","0.0013","90","","107.986","0.001","90","","3849.3","0.5","153.2","","153.2","","","","","","","","hydro(solvato)thermal synthesis","7","C 1 2/c 1","-C 2yc","15","","","","- C30 H32 Cu F10 N6 O2 V2 -","- C30 H32 Cu0.5 F10 N6 O2 V2 -","- C120 H128 Cu2 F40 N24 O8 V8 -","4","0.5","","Margaret E. Welk; Alexander J. Norquist; Charlotte L. Stern; Kenneth R. Poeppelmeier","The Structure-Directing Properties of [VOF5]2-","Inorganic Chemistry","2000","39","","3946","3947","10.1021/ic000416d","","","0.7107","MoKα","","0.0374","0.037","","0.043","","0.043","","","1.686","","","1.69","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321348","15.165","0.003","22.185","0.004","14.989","0.003","105.76","0.01","90.82","0.02","75.23","0.01","4684.7","1.6","296.2","","296.2","","","","","","","","","7","P -1","-P 1","2","","","","- C72 H96 Cl4 Cu4 N12 O16 S4 -","- C72 H96 Cl4 Cu4 N12 O16 S4 -","- C144 H192 Cl8 Cu8 N24 O32 S8 -","2","1","","Takehiro Ohta; Takashi Tachiyama; Kazunari Yoshizawa; Tokio Yamabe; Takeshi Uchida; Teizo Kitagawa","Synthesis, Structure, and H2O2-Dependent Catalytic Functions of Disulfide-Bridged Dicopper(I) and Related Thioether-Copper(I) and Thioether-Copper(II) Complexes","Inorganic Chemistry","2000","39","","4358","4369","10.1021/ic000018a","","","0.7107","MoKα","","0.0954","0.0954","","","0.1254","0.1254","","","","","","2.846","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321349","17.78","0.02","17.7","0.01","15.75","0.01","90","","90","","90","","4957","7","296.2","","296.2","","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C21 H31 Cl Cu N3 O4 S -","- C21 H31 Cl Cu N3 O4 S -","- C168 H248 Cl8 Cu8 N24 O32 S8 -","8","1","","Takehiro Ohta; Takashi Tachiyama; Kazunari Yoshizawa; Tokio Yamabe; Takeshi Uchida; Teizo Kitagawa","Synthesis, Structure, and H2O2-Dependent Catalytic Functions of Disulfide-Bridged Dicopper(I) and Related Thioether-Copper(I) and Thioether-Copper(II) Complexes","Inorganic Chemistry","2000","39","","4358","4369","10.1021/ic000018a","","","0.7107","MoKα","","0.0587","0.0587","","","0.0611","0.0611","","","","","","1.486","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321350","18.1186","0.0003","17.5926","0.0002","25.0476","0.0002","90","0.001","98.142","0.001","90","0.001","7903.53","0.17","170","2","170","2","","","","","","","synthetic","5","C 1 2/c 1","-C 2yc","15","Ferric TREN-Me-3,2-HOPOIAM","Fe[TREN-Me-3,2-HOPOIAM]","","- C29 H32 Fe N5 O6 -","- C35.12 H37.3 Fe N7 O10.53 -","- C280.96 H298.4 Fe8 N56 O84.24 -","8","1","","Seth M. Cohen; Brendon O'Sulliva; Kenneth N. Raymond","Mixed Hydroxypyridinonate Ligands as Iron Chelators1","Inorganic Chemistry","2000","39","","4339","4346","10.1021/ic000239g","","","0.71073","MoKα","","0.0698","0.054","","0.1644","0.1495","","","","1.095","1.119","1.119","","","","","has coordinates,has disorder","179316","2020-10-21","18:00:00",""
"4321351","31.7556","0.0012","14.0087","0.0006","22.1557","0.0009","90","","127.919","0.001","90","","7775.3","0.6","293","2","293","2","","","","","","","synthetic","6","C 1 2/c 1","-C 2yc","15","K[Fe-TREN-Me-3,2-HOPOTAM]","K[Fe-TREN-Me-3,2-HOPOTAM]","","- C29 H31 Fe K N7 O10 -","- C32 H41.6 Fe K N8 O14.8 -","- C256 H332.8 Fe8 K8 N64 O118.4 -","8","1","","Seth M. Cohen; Brendon O'Sulliva; Kenneth N. Raymond","Mixed Hydroxypyridinonate Ligands as Iron Chelators1","Inorganic Chemistry","2000","39","","4339","4346","10.1021/ic000239g","","","0.71073","MoKα","","0.1068","0.0706","","0.1473","0.1259","","","","1.203","1.224","1.224","","","","","has coordinates,has disorder","179316","2020-10-21","18:00:00",""
"4321352","7.0174","0.0014","11.401","0.002","10.925","0.002","90","","90","","90","","874.1","0.3","223","2","223","2","","","","","","","","6","A e m 2","A 2 -2b","39","","","","- C4 H12 F N O4 Os -","- C4 H12 F N O4 Os -","- C16 H48 F4 N4 O16 Os4 -","4","0.5","","Michael Gerken; David A. Dixon; Gary J. Schrobilgen","The OsO4F-, OsO4F22-, and OsO3F3- Anions, Their Study by Vibrational and NMR Spectroscopy and Density Functional Theory Calculations, and the X-ray Crystal Structures of [N(CH3)4][OsO4F] and [N(CH3)4][OsO3F3]","Inorganic Chemistry","2000","39","","4244","4255","10.1021/ic000259i","","","0.56086","AgKα","","0.0301","0.0282","","0.0754","0.0748","","","","1.135","1.156","1.156","","","","","has coordinates","270822","2021-11-23","08:36:48",""
"4321353","16.347","0.004","13.475","0.003","11.435","0.003","90","","134.128","0.004","90","","1808","0.8","156","2","156","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C4 H12 F3 N O3 Os -","- C4 H12 F3 N O3 Os -","- C32 H96 F24 N8 O24 Os8 -","8","1","","Michael Gerken; David A. Dixon; Gary J. Schrobilgen","The OsO4F-, OsO4F22-, and OsO3F3- Anions, Their Study by Vibrational and NMR Spectroscopy and Density Functional Theory Calculations, and the X-ray Crystal Structures of [N(CH3)4][OsO4F] and [N(CH3)4][OsO3F3]","Inorganic Chemistry","2000","39","","4244","4255","10.1021/ic000259i","","","0.71073","MoKα","","0.1075","0.0614","","0.1508","0.1318","","","","1.005","1.119","1.119","","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321354","13.8944","0.0001","17.8668","0.0001","20.7647","0.0002","90","","90","","90","","5154.8","0.07","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C16 H32 N12 O6 Pt2 -","- C16 H32 N12 O6 Pt2 -","- C128 H256 N96 O48 Pt16 -","8","1","","Seiji Komeda; Martin Lutz; Anthony L. Spek; Masahiko Chikuma; Jan Reedijk","New Antitumor-Active Azole-Bridged Dinuclear Platinum(II) Complexes: Synthesis, Characterization, Crystal Structures, and Cytotoxic Studies","Inorganic Chemistry","2000","39","","4230","4236","10.1021/ic000273v","","","0.71073","MoKα","","0.0308","0.0272","","","0.0596","0.061","","","","","","1.133","","","","has coordinates,has disorder","179316","2020-10-21","18:00:00",""
"4321355","8.5225","0.0015","9.1977","0.0018","9.9771","0.0007","66.988","0.01","75.423","0.009","67.321","0.013","659.48","0.19","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C2 H15 N9 O7 Pt2 -","- C2 H15 N9 O7 Pt2 -","- C4 H30 N18 O14 Pt4 -","2","1","","Seiji Komeda; Martin Lutz; Anthony L. Spek; Masahiko Chikuma; Jan Reedijk","New Antitumor-Active Azole-Bridged Dinuclear Platinum(II) Complexes: Synthesis, Characterization, Crystal Structures, and Cytotoxic Studies","Inorganic Chemistry","2000","39","","4230","4236","10.1021/ic000273v","","","0.71073","MoKα","","0.0389","0.0289","","","0.0629","0.0663","","","","","","1.035","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321356","17.7653","0.0003","12.4076","0.0003","10.7091","0.0003","90","","90","","90","","2360.55","0.1","150","2","150","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C15 H34 N8 O8 Pt2 -","- C15 H34 N8 O8 Pt2 -","- C60 H136 N32 O32 Pt8 -","4","1","","Seiji Komeda; Martin Lutz; Anthony L. Spek; Masahiko Chikuma; Jan Reedijk","New Antitumor-Active Azole-Bridged Dinuclear Platinum(II) Complexes: Synthesis, Characterization, Crystal Structures, and Cytotoxic Studies","Inorganic Chemistry","2000","39","","4230","4236","10.1021/ic000273v","","","0.71073","MoKα","","0.0294","0.0274","","","0.0707","0.0723","","","","","","1.068","","","","has coordinates,has disorder","179316","2020-10-21","18:00:00",""
"4321357","14.174","0.006","16.451","0.004","18.381","0.004","90","","98","0.03","90","","4244","2","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C40 H33 Cl2 F6 N8 O P2 Ru -","- C40 H33 Cl2 F6 N8 O P2 Ru -","- C160 H132 Cl8 F24 N32 O4 P8 Ru4 -","4","1","","Maya Shivakumar; Kausikisankar Pramanik; Indranil Bhattacharyya; Animesh Chakravorty","Chemistry of Metal-Bound Anion Radicals. A Family of Mono- and Bis(azopyridine) Chelates of Bivalent Ruthenium","Inorganic Chemistry","2000","39","","4332","4338","10.1021/ic000356b","","","0.71073","MoKα","","0.0773","0.0578","","0.1648","0.1461","","","","1.09","1.11","1.11","","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321358","9.433","0.002","38.914","0.017","13.084","0.003","90","","103.47","0.02","90","","4671","3","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C47 H41 F6 N4 O2 P3 Ru -","- C47 H41 F5 N4 O2 P3 Ru -","- C188 H164 F20 N16 O8 P12 Ru4 -","4","1","","Maya Shivakumar; Kausikisankar Pramanik; Indranil Bhattacharyya; Animesh Chakravorty","Chemistry of Metal-Bound Anion Radicals. A Family of Mono- and Bis(azopyridine) Chelates of Bivalent Ruthenium","Inorganic Chemistry","2000","39","","4332","4338","10.1021/ic000356b","","","0.71073","MoKα","","0.1372","0.0828","","0.3961","0.2049","","","","1.163","1.082","1.082","","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321359","10.496","0.005","22.389","0.008","19.72","0.006","90","","90.53","0.03","90","","4634","3","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C48 H39 Cl F6 N3 O P3 Ru -","- C48 H39 Cl F6 N3 O P3 Ru -","- C192 H156 Cl4 F24 N12 O4 P12 Ru4 -","4","1","","Maya Shivakumar; Kausikisankar Pramanik; Indranil Bhattacharyya; Animesh Chakravorty","Chemistry of Metal-Bound Anion Radicals. A Family of Mono- and Bis(azopyridine) Chelates of Bivalent Ruthenium","Inorganic Chemistry","2000","39","","4332","4338","10.1021/ic000356b","","","0.71073","MoKα","","0.067","0.0471","","0.134","0.117","","","","1.072","1.08","1.08","","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321360","8.0636","0.0009","8.4566","0.001","9.0234","0.0011","111.941","0.002","107.957","0.002","103.649","0.002","498.09","0.1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C3 H11 N2 O8 P2 Zn2 -","- C3 H11 N2 O8 P2 Zn2 -","- C6 H22 N4 O16 P4 Zn4 -","2","1","","Amitava Choudhury; Srinivasan Natarajan; C. N. R. Rao","Formation of One-, Two-, and Three-Dimensional Open-Framework Zinc Phosphates in the Presence of a Tetramine","Inorganic Chemistry","2000","39","","4295","4304","10.1021/ic000366c","","","0.71073","MoKα","","0.0542","0.0437","","0.1152","0.1094","","","","1.059","1.104","1.104","","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321361","5.2176","0.0002","8.7802","0.0004","16.0811","0.0007","89.34","0.002","83.537","0.001","74.337","0.001","704.7","0.05","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C3 H12 N2 O12 P3 Zn3 -","- C3 H12 N2 O12 P3 Zn3 -","- C6 H24 N4 O24 P6 Zn6 -","2","1","","Amitava Choudhury; Srinivasan Natarajan; C. N. R. Rao","Formation of One-, Two-, and Three-Dimensional Open-Framework Zinc Phosphates in the Presence of a Tetramine","Inorganic Chemistry","2000","39","","4295","4304","10.1021/ic000366c","","","0.71073","MoKα","","0.0481","0.0423","","0.1222","0.1061","","","","1.062","0.995","0.995","","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321362","9.2187","0.0003","15.2389","0.0004","10.2265","0.0003","90","","105.209","0.001","90","","1386.33","0.07","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C3 H10 N2 O12 P3 Zn4 -","- C3 N2 O12 P3 Zn4 -","- C12 N8 O48 P12 Zn16 -","4","1","","Amitava Choudhury; Srinivasan Natarajan; C. N. R. Rao","Formation of One-, Two-, and Three-Dimensional Open-Framework Zinc Phosphates in the Presence of a Tetramine","Inorganic Chemistry","2000","39","","4295","4304","10.1021/ic000366c","","","0.71073","MoKα","","0.0415","0.0335","","0.0856","0.0827","","","","1.107","1.171","1.171","","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321363","12.7162","0.0003","18.2059","0.0002","24.2215","0.0004","90","","100.026","0.001","90","","5521.88","0.17","188","2","188","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","1","","","- C52 H52 Cl2 N8 Ni2 O16 P2 -","- C52 H52 Cl2 N8 Ni2 O16 P2 -","- C208 H208 Cl8 N32 Ni8 O64 P8 -","4","1","","Chuan He; Victoria Gomez; Bernhard Spingler; Stephen J. Lippard","Monodentate-Bridged Phosphodiester and Sulfate Complexes: Structural Insights into the Biological Activation of Phosphodiesters, Sulfate, and Sulfate Esters","Inorganic Chemistry","2000","39","","4188","4189","10.1021/ic000391i","","","0.71073","MoKα","","0.1189","0.0607","","","0.1417","0.1625","","","","","","0.924","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321364","10.1166","0.0001","18.8468","0.0002","22.1816","0.0001","90","","94.687","0.001","90","","4215.12","0.06","188","2","188","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","(2)3.5MeOH","","","- C37.5 H46 Mn2 N8 O11.5 S2 -","- C37.5 H32 Mn2 N8 O11.5 S2 -","- C150 H128 Mn8 N32 O46 S8 -","4","1","","Chuan He; Victoria Gomez; Bernhard Spingler; Stephen J. Lippard","Monodentate-Bridged Phosphodiester and Sulfate Complexes: Structural Insights into the Biological Activation of Phosphodiesters, Sulfate, and Sulfate Esters","Inorganic Chemistry","2000","39","","4188","4189","10.1021/ic000391i","","","0.71073","MoKα","","0.0513","0.0418","","","0.1351","0.1404","","","","","","1.138","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321365","11.2851","0.0002","20.8509","0.0005","17.2826","0.0004","90","","92.855","0.001","90","","4061.63","0.15","188","2","188","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","(2)4.5H2O.MeOH","","","- C35 H45 Mn2 N8 O13.5 S2 -","- C35 H32 Mn2 N8 O13.5 S2 -","- C140 H128 Mn8 N32 O54 S8 -","4","1","","Chuan He; Victoria Gomez; Bernhard Spingler; Stephen J. Lippard","Monodentate-Bridged Phosphodiester and Sulfate Complexes: Structural Insights into the Biological Activation of Phosphodiesters, Sulfate, and Sulfate Esters","Inorganic Chemistry","2000","39","","4188","4189","10.1021/ic000391i","","","0.71073","MoKα","","0.0747","0.0492","","","0.1337","0.1426","","","","","","1.151","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321366","21.552","0.0012","27.694","0.002","20.552","0.0012","90","","113.65","0.001","90","","11236.4","1.2","223","2","223","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","Strontium vanadium borophosphate","Ammoniumdiprotonatedethylenediammoniumbis(pentaaquostrontium) dodecavanadyl(IV)hexaborododecaphosphate decahydrate","","- C12 H108 B6 N14 O92 P12 Sr2 V12 -","- C1.34118 H3.52941 B0.705882 N1.55294 O11.8824 P1.41176 Sr0.235294 V1.41176 -","- C45.6 H120 B24 N52.8 O404 P48 Sr8 V48 -","34","4.25","","Junghwan Do; Ranko P. Bontchev; Allan J. Jacobson","Influence of Hydrogen Bonding on the Assembly of Six-Membered Vanadium Borophosphate Cluster Anions: Synthesis and Structures of (NH~4~)~2~(C~2~H~10~N~2~)~6~[Sr(H~2~O)~5~]~2~[V~2~P~2~BO~12~ ]~6~10H~2~O, (NH~4~)~2~(C~3~H~12~N~2~)~6~[Sr(H~2~O)~4~]~2~ [V~2~P~2~BO~12~]~6~17H~2~O, (NH~4~)~3~(C~2~H~10~N~2~)~4.5~ [Sr(H~2~O)~5~]~2~[Sr(H~2~O)~4~][V~2~P~2~BO~12~]~6~10H~2~O","Inorganic Chemistry","2000","39","","4305","4310","10.1021/ic000435n","","","0.71073","MoKα","","0.0762","0.0573","","0.1758","0.1602","","","","1.075","1.108","1.108","","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321367","15.7618","0.0009","16.4821","0.0009","21.1124","0.0012","90","","107.473","0.001","90","","5231.7","0.5","223","2","223","2","","","","","","","","8","I 1 2/m 1","-I 2y","12","Strontium vanadium borophosphate","Ammoniumdiprotonated1,3-diaminopropanebis(tetraaquostrontium) dodecavanadyl(IV)hexaborododecaphosphate hydrate","","- C18 H130 B6 N14 O97 P12 Sr2 V12 -","- C3.6 H14.4 B1.2 N2.6 O19.32 P2.4 Sr0.4 V2.4 -","- C36 H144 B12 N26 O193.2 P24 Sr4 V24 -","10","1.25","","Junghwan Do; Ranko P. Bontchev; Allan J. Jacobson","Influence of Hydrogen Bonding on the Assembly of Six-Membered Vanadium Borophosphate Cluster Anions: Synthesis and Structures of (NH~4~)~2~(C~2~H~10~N~2~)~6~[Sr(H~2~O)~5~]~2~[V~2~P~2~BO~12~ ]~6~10H~2~O, (NH~4~)~2~(C~3~H~12~N~2~)~6~[Sr(H~2~O)~4~]~2~ [V~2~P~2~BO~12~]~6~17H~2~O, (NH~4~)~3~(C~2~H~10~N~2~)~4.5~ [Sr(H~2~O)~5~]~2~[Sr(H~2~O)~4~][V~2~P~2~BO~12~]~6~10H~2~O","Inorganic Chemistry","2000","39","","4305","4310","10.1021/ic000435n","","","0.71073","MoKα","","0.0563","0.0448","","0.1345","0.1214","","","","1.09","1.076","1.076","","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321368","39.364","0.002","14.0924","0.0007","25.3424","0.0013","90","","121.259","0.001","90","","12017.4","1.1","223","2","223","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","Ammoniumdiprotonated1,4-diaminobutanebis(pentaaquostrontium)tetraaquo strontiumdodecavanadyl(IV)hexaborododecaphosphate decahydrate","","- C18 H123 B6 N12 O96 P12 Sr3 V12 -","- C2.19333 H4.66667 B N1.34 O17.2 P2 Sr0.5 V2 -","- C52.64 H112 B24 N32.16 O412.8 P48 Sr12 V48 -","24","3","","Junghwan Do; Ranko P. Bontchev; Allan J. Jacobson","Influence of Hydrogen Bonding on the Assembly of Six-Membered Vanadium Borophosphate Cluster Anions: Synthesis and Structures of (NH~4~)~2~(C~2~H~10~N~2~)~6~[Sr(H~2~O)~5~]~2~[V~2~P~2~BO~12~ ]~6~10H~2~O, (NH~4~)~2~(C~3~H~12~N~2~)~6~[Sr(H~2~O)~4~]~2~ [V~2~P~2~BO~12~]~6~17H~2~O, (NH~4~)~3~(C~2~H~10~N~2~)~4.5~ [Sr(H~2~O)~5~]~2~[Sr(H~2~O)~4~][V~2~P~2~BO~12~]~6~10H~2~O","Inorganic Chemistry","2000","39","","4305","4310","10.1021/ic000435n","","","0.71073","MoKα","","0.0595","0.0522","","0.155","0.1493","","","","1.063","1.095","1.095","","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321369","14.503","0.001","5.104","0.002","10.2019","0.0009","90","","90","","90","","755.2","0.3","295.2","","","","","","","","","","","7","P c a 21","P 2c -2ac","29","","","","- C2 H2 Ag Cl I N O4 -","- C2 H2 Ag Cl I N O4 -","- C8 H8 Ag4 Cl4 I4 N4 O16 -","4","1","","Ichiro Ino; Jian Chu Zhong; Megumu Munakata; Takayoshi Kuroda-Sowa; Masahiko Maekawa; Yusaku Suenaga; Yoshinobu Kitamori","2-D Interwoven and 3-D 5-fold Interpenetrating Silver(I) Complexes of 1-(Isocyanidomethyl)-1H-benzotriazole and 1,3-Bis(dicyanomethylidene)indan","Inorganic Chemistry","2000","39","","4273","4279","10.1021/ic000459u","","","0.7107","MoKα","","","0.046","","","","0.1589","","","","","","2.618","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321370","12.2705","0.0003","21.15","0.001","10.04","0.001","90","","90","","90","","2605.6","0.3","295.2","","","","","","","","","","","7","P n n a","-P 2a 2bc","52","","","","- C8 H6 Ag F4 N4 O P -","- C8 H6 Ag F4 N4 O P -","- C64 H48 Ag8 F32 N32 O8 P8 -","8","1","","Ichiro Ino; Jian Chu Zhong; Megumu Munakata; Takayoshi Kuroda-Sowa; Masahiko Maekawa; Yusaku Suenaga; Yoshinobu Kitamori","2-D Interwoven and 3-D 5-fold Interpenetrating Silver(I) Complexes of 1-(Isocyanidomethyl)-1H-benzotriazole and 1,3-Bis(dicyanomethylidene)indan","Inorganic Chemistry","2000","39","","4273","4279","10.1021/ic000459u","","","0.7107","MoKα","","","0.0595","","","","0.1769","","","","","","1.672","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321371","14.92","0.002","11.896","0.002","7.4","0.004","86.55","0.02","80.87","0.02","74.47","0.01","1249.2","0.7","296.2","","","","","","","","","","","4","P -1","-P 1","2","","","","- C30 H10 Ag2 N8 -","- C30 H10 Ag2 N8 -","- C60 H20 Ag4 N16 -","2","1","","Ichiro Ino; Jian Chu Zhong; Megumu Munakata; Takayoshi Kuroda-Sowa; Masahiko Maekawa; Yusaku Suenaga; Yoshinobu Kitamori","2-D Interwoven and 3-D 5-fold Interpenetrating Silver(I) Complexes of 1-(Isocyanidomethyl)-1H-benzotriazole and 1,3-Bis(dicyanomethylidene)indan","Inorganic Chemistry","2000","39","","4273","4279","10.1021/ic000459u","","","0.7107","MoKα","","","0.051","","","","0.1537","","","","","","1.365","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321372","17.09","0.005","21.612","0.004","24.548","0.005","90","","100.129","0.014","90","","8925","4","130","2","130","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[Ti4O2(i-PrO)6](CpFeCpCO2)6.1.32CH2Cl2","","- C85.32 H98.64 Cl2.64 Fe6 O20 Ti4 -","- C85.322 H98.644 Cl2.644 Fe6 O20 Ti4 -","- C341.288 H394.576 Cl10.576 Fe24 O80 Ti16 -","4","1","","Alec Bailey; Maoyu Shang; Thomas P. Fehlner","Synthesis and Characterization of a Novel Asymmetric Ferrocene Alkoxycarboxylate of Titanium, Ti4O2(OiPr)6{(η5-O2CC5H4)Fe(η5-C5H5)}6","Inorganic Chemistry","2000","39","","4374","4376","10.1021/ic000790d","","","0.71073","MoKα","","0.1124","0.0693","","","0.1549","0.1785","","","","","","1.016","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321373","8.888","0.002","19.169","0.007","33.614","0.01","90","","90","","90","","5727","3","293","2","295","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C35 H24 Cu N6 O3 -","- C35 H24 Cu N6 O3 -","- C280 H192 Cu8 N48 O24 -","8","1","","Éva Balogh-Hergovich; József Kaizer; Gábor Speier; Gottfried Huttner; Albrecht Jacobi","Preparation and Oxygenation of (Flavonolato)copper Isoindoline Complexes with Relevance to Quercetin Dioxygenase","Inorganic Chemistry","2000","39","","4224","4229","10.1021/ic990521r","","","0.71073","MoKα","","0.1718","0.0878","","0.1842","0.1495","","","","1.238","1.427","1.427","","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321374","8.048","0.007","8.969","0.009","19.244","0.018","85.69","0.08","80.24","0.07","77.87","0.07","1337","2","293","2","210","","","","","","","","","5","P -1","-P 1","2","","","","- C32 H22 Cu N5 O4 -","- C32 H22 Cu N5 O4 -","- C64 H44 Cu2 N10 O8 -","2","1","","Éva Balogh-Hergovich; József Kaizer; Gábor Speier; Gottfried Huttner; Albrecht Jacobi","Preparation and Oxygenation of (Flavonolato)copper Isoindoline Complexes with Relevance to Quercetin Dioxygenase","Inorganic Chemistry","2000","39","","4224","4229","10.1021/ic990521r","","","0.71073","MoKα","","0.0465","0.0393","","0.1158","0.1109","","","","1.221","1.251","1.251","","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321375","6.888","0.002","28.08","0.008","8.694","0.002","90","","100.064","0.007","90","","1655.7","0.8","298","","298","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H23 N2 O Re S2 -","- C14 H23 N2 O Re S2 -","- C56 H92 N8 O4 Re4 S8 -","4","1","","A. Rey; I. Pirmettis; M. Pelecanou; M. Papadopoulos; C. P. Raptopoulou; L. Mallo; C. I. Stassinopoulou; A. Terzis; E. Chiotellis; A. León","Synthesis and Characterization of Mixed-Ligand Oxorhenium Complexes with the SNN Type of Ligand. Isolation of a Novel ReO[SN][S][S] Complex","Inorganic Chemistry","2000","39","","4211","4218","10.1021/ic991491v","","","0.7107","MoKα","","0.046","0.0408","","0.1204","0.1138","","","","1.121","1.117","1.117","","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321376","10.231","0.006","9.277","0.005","18.316","0.009","90","","97.6","0.01","90","","1723.2","1.6","298","","298","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C15 H23 N2 O Re S2 -","- C15 H23 N2 O Re S2 -","- C60 H92 N8 O4 Re4 S8 -","4","1","","A. Rey; I. Pirmettis; M. Pelecanou; M. Papadopoulos; C. P. Raptopoulou; L. Mallo; C. I. Stassinopoulou; A. Terzis; E. Chiotellis; A. León","Synthesis and Characterization of Mixed-Ligand Oxorhenium Complexes with the SNN Type of Ligand. Isolation of a Novel ReO[SN][S][S] Complex","Inorganic Chemistry","2000","39","","4211","4218","10.1021/ic991491v","","","0.71073","MoKα","","0.0349","0.0323","","0.0962","0.0929","","","","1.086","1.092","1.092","","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321377","9.5","0.001","16.385","0.001","16.254","0.001","90","","95.905","0.002","90","","2516.6","0.3","298","","298","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H33 N2 O Re S3 -","- C22 H33 N2 O Re S3 -","- C88 H132 N8 O4 Re4 S12 -","4","1","","A. Rey; I. Pirmettis; M. Pelecanou; M. Papadopoulos; C. P. Raptopoulou; L. Mallo; C. I. Stassinopoulou; A. Terzis; E. Chiotellis; A. León","Synthesis and Characterization of Mixed-Ligand Oxorhenium Complexes with the SNN Type of Ligand. Isolation of a Novel ReO[SN][S][S] Complex","Inorganic Chemistry","2000","39","","4211","4218","10.1021/ic991491v","","","1.5418","CuKα","","0.0427","0.0387","","0.1145","0.11","","","","1.109","1.128","1.128","","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321378","11.687","0.007","14.462","0.007","16.273","0.009","90","","92.11","0.02","90","","2749","3","298","","298","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H37 N2 O Re S3 -","- C24 H37 N2 O Re S3 -","- C96 H148 N8 O4 Re4 S12 -","4","1","","A. Rey; I. Pirmettis; M. Pelecanou; M. Papadopoulos; C. P. Raptopoulou; L. Mallo; C. I. Stassinopoulou; A. Terzis; E. Chiotellis; A. León","Synthesis and Characterization of Mixed-Ligand Oxorhenium Complexes with the SNN Type of Ligand. Isolation of a Novel ReO[SN][S][S] Complex","Inorganic Chemistry","2000","39","","4211","4218","10.1021/ic991491v","","","0.71073","MoKα","","0.0292","0.024","","0.0636","0.0608","","","","1.1","1.12","1.12","","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321379","18.427","0.004","17.487","0.003","22.422","0.005","90","","113.44","0.06","90","","6629","4","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C32 H32 Cl2 N2 O2 P2 Ru -","- C32 H32 Cl2 N2 O2 P2 Ru -","- C256 H256 Cl16 N16 O16 P16 Ru8 -","8","2","","Pierre Braunstein; Claudia Graiff; Frédéric Naud; Andreas Pfaltz; Antonio Tiripicchio","Synthesis and Crystal Structures of Ru(II) Complexes Containing Chelating (Phosphinomethyl)oxazoline P,N-Type Ligands and Asymmetric Catalytic Transfer Hydrogenation of Acetophenone in Propan-2-ol","Inorganic Chemistry","2000","39","","4468","4475","10.1021/ic0000754","","","0.71073","MoKα","","0.1599","0.0673","","","0.191","0.2142","","","","","","1.043","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321380","15.757","0.005","12.212","0.004","11.39","0.003","68.47","0.05","73.75","0.06","67.25","0.05","1855.7","1.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C37 H42 Cl4 N2 O2 P2 Ru -","- C37 H40 Cl4 N2 O2 P2 Ru -","- C74 H80 Cl8 N4 O4 P4 Ru2 -","2","1","","Pierre Braunstein; Claudia Graiff; Frédéric Naud; Andreas Pfaltz; Antonio Tiripicchio","Synthesis and Crystal Structures of Ru(II) Complexes Containing Chelating (Phosphinomethyl)oxazoline P,N-Type Ligands and Asymmetric Catalytic Transfer Hydrogenation of Acetophenone in Propan-2-ol","Inorganic Chemistry","2000","39","","4468","4475","10.1021/ic0000754","","","0.71073","MoKα","","0.1274","0.0493","","","0.1392","0.1639","","","","","","0.844","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321381","14.368","0.001","14.099","0.001","26.116","0.003","90","","97.009","0.008","90","","5250.9","0.8","293","","293","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C16 H34 Cl2 Cu2 N6 O11 -","- C16 H31 Cl2 Cu2 N6 O11 -","- C128 H248 Cl16 Cu16 N48 O88 -","8","2","","Paolo Dapporto; Mauro Formica; Vieri Fusi; Mauro Micheloni; Paola Paoli; Roberto Pontellini; Patrizia Rossi","Synthesis of a Flexible Ligand for Assembling Two Metal Ions in Close Proximity. Crystal Structures of Binuclear Nickel and Copper Complexes","Inorganic Chemistry","2000","39","","4663","4665","10.1021/ic0000799","","","1.5418","CuKα","","0.0598","0.055","","","0.1505","0.1549","","","","","","1.027","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321382","11.142","0.005","10.307","0.004","18.692","0.008","90","","91.15","0.03","90","","2146.2","1.6","293","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H31 Cl3 N6 Ni2 O -","- C16 H31 Cl3 N6 Ni2 O -","- C64 H124 Cl12 N24 Ni8 O4 -","4","1","","Paolo Dapporto; Mauro Formica; Vieri Fusi; Mauro Micheloni; Paola Paoli; Roberto Pontellini; Patrizia Rossi","Synthesis of a Flexible Ligand for Assembling Two Metal Ions in Close Proximity. Crystal Structures of Binuclear Nickel and Copper Complexes","Inorganic Chemistry","2000","39","","4663","4665","10.1021/ic0000799","","","1.5418","CuKα","","0.0735","0.0617","","","0.1861","0.1974","","","","","","0.743","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321383","17.205","0.002","17.205","0.002","14.822","0.003","90","","90","","90","","4387.5","1.1","293","2","293","2","","","","","","","","6","P -4 21 c","P -4 2n","114","","","","- C72 H72 Cl4 Cu8 N12 O40 -","- C72 H72 Cl4 Cu8 N12 O40 -","- C144 H144 Cl8 Cu16 N24 O80 -","2","0.25","","Ming-Liang Tong; Hung Kay Lee; Ye-Xiang Tong; Xiao-Ming Chen; Thomas C. W. Mak","An Octanuclear Copper(II) Complex Containing thegem-Diol Anionic Form of Di-2-pyridyl Ketone (dpd-2H) and 2-Hydroxypyridine: Synthesis, Crystal Structure, and Properties of [Cu8(dpd-2H)4(μ2-O2CMe)4{2-(OH)C5H4N}4]- (ClO4)4.4H2O","Inorganic Chemistry","2000","39","","4666","4669","10.1021/ic000114b","","","0.71073","MoKα","","0.0567","0.0546","","","0.1431","0.1451","","","","","","1.12","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321384","7.672","0.006","11.1401","0.0011","11.322","0.004","91.207","0.014","105.52","0.04","90.48","0.02","932.1","0.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","[(2-aminomethyl)pyridine]silver(I) perchlorate","","- C12 H16 Ag2 Cl2 N4 O8 -","- C12 H16 Ag2 Cl2 N4 O8 -","- C24 H32 Ag4 Cl4 N8 O16 -","2","1","","Sunkari Sailaja; M. V. Rajasekharan","One-Dimensional Coordination Polymers of Silver(I) with Aminomethylpyridines. Example of a Triple Helical Infinite Chain","Inorganic Chemistry","2000","39","","4586","4590","10.1021/ic000139a","","","0.71073","MoKα","","0.0571","0.0463","","","0.113","0.1214","","","","","","1.094","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321385","8.345","0.004","8.6748","0.0007","26.056","0.009","90","","97.96","0.04","90","","1868.1","1.1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[(3-aminomethyl)pyridine]silver(I) perchlorate","","- C12 H16 Ag2 Cl2 N4 O8 -","- C12 H16 Ag2 Cl2 N4 O8 -","- C48 H64 Ag8 Cl8 N16 O32 -","4","1","","Sunkari Sailaja; M. V. Rajasekharan","One-Dimensional Coordination Polymers of Silver(I) with Aminomethylpyridines. Example of a Triple Helical Infinite Chain","Inorganic Chemistry","2000","39","","4586","4590","10.1021/ic000139a","","","0.71073","MoKα","","0.0889","0.06","","","0.1505","0.1705","","","","","","1.085","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321386","9.3154","0.0011","9.3154","0.0011","39.313","0.005","90","","90","","120","","2954.4","0.6","293","2","293","2","","","","","","","","6","P 65 2 2","P 65 2 (0 0 1)","179","","[(4-aminomethyl)pyridine]silver(I) perchlorate hemihydrate","","- C6 H8 Ag Cl N2 O4.5 -","- C6 H8 Ag Cl N2 O4.5 -","- C72 H96 Ag12 Cl12 N24 O54 -","12","1","","Sunkari Sailaja; M. V. Rajasekharan","One-Dimensional Coordination Polymers of Silver(I) with Aminomethylpyridines. Example of a Triple Helical Infinite Chain","Inorganic Chemistry","2000","39","","4586","4590","10.1021/ic000139a","","","0.71073","MoKα","","0.1148","0.0579","","","0.0981","0.1134","","","","","","1.032","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321387","21.183","0.003","11.645","0.004","16.791","0.006","90","","104.86","0.02","90","","4003","2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C39 H37 Cl6 N O3 P2 -","- C39 H37 Cl6 N O3 P2 -","- C156 H148 Cl24 N4 O12 P8 -","4","1","","Gan, Xin-Min; Parveen, Sahrah; Smith, Wayne L.; Duesler, Eileen N.; Paine, Robert T.","Synthesis, Characterization, and Coordination Chemistry of a New Geometrically Hindered Trifunctional Ligand, 4,5-Bis(diphenylphosphino)-sym-octahydroacridine N,P,P'-Trioxide","Inorganic Chemistry","2000","39","20","4591","4598","10.1021/ic000153n","","","0.71073","MoKα","","0.1366","0.0475","","","0.1059","0.142","","","","","","1.08","","","","has coordinates","209507","2020-10-21","18:00:00",""
"4321388","24.351","0.004","11.543","0.002","17.211","0.005","90","","133.48","0.01","90","","3510.3","1.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C39 H43 N O5 P2 -","- C39 H43 N O5 P2 -","- C156 H172 N4 O20 P8 -","4","0.5","","Gan, Xin-Min; Parveen, Sahrah; Smith, Wayne L.; Duesler, Eileen N.; Paine, Robert T.","Synthesis, Characterization, and Coordination Chemistry of a New Geometrically Hindered Trifunctional Ligand, 4,5-Bis(diphenylphosphino)-sym-octahydroacridine N,P,P'-Trioxide","Inorganic Chemistry","2000","39","20","4591","4598","10.1021/ic000153n","","","0.71073","MoKα","","0.0575","0.0425","","","0.1211","0.1258","","","","","","1.003","","","","has coordinates","209507","2020-10-21","18:00:00",""
"4321389","13.146","0.001","17.691","0.002","17.962","0.003","90","","90","","90","","4177.3","0.9","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C38 H39 La N4 O13 P2 -","- C38 H39 La N4 O13 P2 -","- C152 H156 La4 N16 O52 P8 -","4","1","","Gan, Xin-Min; Parveen, Sahrah; Smith, Wayne L.; Duesler, Eileen N.; Paine, Robert T.","Synthesis, Characterization, and Coordination Chemistry of a New Geometrically Hindered Trifunctional Ligand, 4,5-Bis(diphenylphosphino)-sym-octahydroacridine N,P,P'-Trioxide","Inorganic Chemistry","2000","39","20","4591","4598","10.1021/ic000153n","","","0.71073","MoKα","","0.0785","0.0432","","","0.0805","0.0889","","","","","","1.053","","","","has coordinates","209507","2020-10-21","18:00:00",""
"4321390","13.131","0.002","17.579","0.008","17.853","0.007","90","","90","","90","","4121","3","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C38 H39 N4 Nd O13 P2 -","- C38 H39 N4 Nd O13 P2 -","- C152 H156 N16 Nd4 O52 P8 -","4","1","","Gan, Xin-Min; Parveen, Sahrah; Smith, Wayne L.; Duesler, Eileen N.; Paine, Robert T.","Synthesis, Characterization, and Coordination Chemistry of a New Geometrically Hindered Trifunctional Ligand, 4,5-Bis(diphenylphosphino)-sym-octahydroacridine N,P,P'-Trioxide","Inorganic Chemistry","2000","39","20","4591","4598","10.1021/ic000153n","","","0.71073","MoKα","","0.0853","0.0386","","","0.075","0.0917","","","","","","1.039","","","","has coordinates","209507","2020-10-21","18:00:00",""
"4321391","17.436","0.004","17.436","0.004","10.907","0.003","90","","90","","120","","2871.6","1.2","213","2","213","2","","","","","","","","5","R 3 :H","R 3","146","","","","- C27 H33 N3 O13 Ru3 -","- C27 H33 N3 O13 Ru3 -","- C81 H99 N9 O39 Ru9 -","3","0.333333","","Scott B. Marr; Richard O. Carvel; David T. Richens; Hyun-Jin Lee; Michael Lane; Pericles Stavropoulos","Comparison between Iron and Ruthenium Reagents Mediating GifIV-Type Oxygenation of Cyclohexane","Inorganic Chemistry","2000","39","","4630","4638","10.1021/ic0001560","","","0.71073","MoKα","","0.0521","0.047","","","0.1319","0.1354","","","","","","1.337","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321392","11.7727","0.0005","19.277","0.002","10.387","0.0003","90.104","0.008","105.424","0.005","89.935","0.007","2272.3","0.3","298.2","","","","","","","","","","","6","P -1","-P 1","2","","","","- C56 H44 Cl Cr N6 O -","- C56 H42 Cl Cr N6 O -","- C112 H84 Cl2 Cr2 N12 O2 -","2","1","","Masahiko Inamo; Hideyuki Nakaba; Kiyohiko Nakajima; Mikio Hoshino","Laser Photolysis of Chromium(III) Porphyrins with Axial Pyridines in Dichloromethane and Toluene Solutions. Novel Effects of a Hydrogen Bond in the Ligand Exchange Reaction","Inorganic Chemistry","2000","39","","4417","4423","10.1021/ic0002059","","","0.7107","MoKα","","","0.0579","","","","0.089","","","","","","2.043","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321393","16.907","0.002","16.427","0.003","27.349","0.007","90","","98.525","0.007","90","","7512","3","213","2","213","2","","","","","","","synthesis","6","P 1 21/n 1","-P 2yn","14","","","","- C71 H72 Cl10 Cu6 N12 O -","- C71.18 H28 Cl10 Cu6 N12 O -","- C284.72 H112 Cl40 Cu24 N48 O4 -","4","1","","Rodolphe Clérac; F. Albert Cotton; Lee M. Daniels; Jiande Gu; Carlos A. Murillo; Hong-Cai Zhou","An Infinite Zigzag Chain and the First Linear Chain of Four Copper Atoms; Still No Copper-Copper Bonding","Inorganic Chemistry","2000","39","","4488","4493","10.1021/ic000208l","","","0.71073","MoKα","","0.1172","0.0983","","0.2715","0.2464","","","","1.036","1.072","1.072","","","","","has coordinates,has disorder","179316","2020-10-21","18:00:00",""
"4321394","16.259","0.004","6.147","0.002","16.544","0.008","90","","93.55","0.03","90","","1650.3","1","213","2","213","2","","","","","","","synthesis","6","P 1 21/n 1","-P 2yn","14","","Bis(2,6-diphenyliminopiperidinato)tricopper(I) bichlorocuperate(I)","","- C34 H33 Cl2 Cu4 N6 O0.5 -","- C34 H32 Cl2 Cu4 N6 O0.5 -","- C68 H64 Cl4 Cu8 N12 O -","2","0.5","","Rodolphe Clérac; F. Albert Cotton; Lee M. Daniels; Jiande Gu; Carlos A. Murillo; Hong-Cai Zhou","An Infinite Zigzag Chain and the First Linear Chain of Four Copper Atoms; Still No Copper-Copper Bonding","Inorganic Chemistry","2000","39","","4488","4493","10.1021/ic000208l","","","0.71073","MoKα","","0.094","0.0676","","0.2055","0.181","","","","1.06","1.13","1.13","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4321395","13.875","0.003","8.6423","0.0013","31.85","0.004","90","","95.062","0.014","90","","3804.3","1.1","213","2","213","2","","","","","","","symthesis","6","P 1 21/n 1","-P 2yn","14","","","","- C38 H40 Cl2 Cu4 N6 O -","- C38 H40 Cl2 Cu4 N6 O -","- C152 H160 Cl8 Cu16 N24 O4 -","4","1","","Rodolphe Clérac; F. Albert Cotton; Lee M. Daniels; Jiande Gu; Carlos A. Murillo; Hong-Cai Zhou","An Infinite Zigzag Chain and the First Linear Chain of Four Copper Atoms; Still No Copper-Copper Bonding","Inorganic Chemistry","2000","39","","4488","4493","10.1021/ic000208l","","","0.71073","MoKα","","0.064","0.0496","","0.1219","0.11","","","","1.089","1.111","1.111","","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321396","9.2774","0.0003","9.2774","0.0003","6.1149","0.0002","90","","90","","90","","526.31","0.03","298","2","298","2","","","","","","","D. Columbo / Prof. W. Gladfelter","3","I -4","I -4","82","1","Nitronium Tetranitratogallate","","- Ga N5 O14 -","- Ga N5 O14 -","- Ga2 N10 O28 -","2","0.25","","Daniel G. Colombo; Victor G. Young,; Wayne L. Gladfelter","Crystal Structures of Nitronium Tetranitratogallate and Its Reversible Solid-State Phase Transition Mediated by Nonmerohedral Twinning","Inorganic Chemistry","2000","39","","4621","4624","10.1021/ic0002418","","","0.71073","MoKα","","0.0228","0.0228","","0.057","","0.057","","","1.052","","","1.053","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321397","9.5857","0.0002","5.9399","0.0001","8.9759","0.0002","90","","90.409","0.001","90","","511.058","0.018","173","2","173","2","","","","","","","D. Columbo / Prof. W. Gladfelter","3","I 1 2 1","I 2y","5","2a","Nitronium Tetranitratogallate","","- Ga N5 O14 -","- Ga N5 O14 -","- Ga2 N10 O28 -","2","0.5","","Daniel G. Colombo; Victor G. Young,; Wayne L. Gladfelter","Crystal Structures of Nitronium Tetranitratogallate and Its Reversible Solid-State Phase Transition Mediated by Nonmerohedral Twinning","Inorganic Chemistry","2000","39","","4621","4624","10.1021/ic0002418","","","0.71073","MoKα","","0.0385","0.0384","","0.0992","","0.099","","","1.021","","","1.02","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321398","9.5898","0.0002","5.9376","0.0001","8.9784","0.0001","90","","90.42","0.001","90","","511.22","0.015","173","2","173","2","","","","","","","D. Columbo / Prof. W. Gladfelter","3","I 1 2 1","I 2y","5","2b","Nitronium Tetranitratogallate","","- Ga N5 O14 -","- Ga N5 O14 -","- Ga2 N10 O28 -","2","0.5","","Daniel G. Colombo; Victor G. Young,; Wayne L. Gladfelter","Crystal Structures of Nitronium Tetranitratogallate and Its Reversible Solid-State Phase Transition Mediated by Nonmerohedral Twinning","Inorganic Chemistry","2000","39","","4621","4624","10.1021/ic0002418","","","0.71073","MoKα","","0.0473","0.047","","0.1288","","0.1284","","","1.043","","","1.044","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321399","7.419","0.001","14.751","0.002","8.634","0.001","90","","89.95","0.01","90","","944.9","0.2","300","2","300","2","","","","","","","synthetic","5","P 1 21/n 1","-P 2yn","14","","cis-bis(carbonyl)platinum(II) fluorosulfate","","- C2 F2 O8 Pt S2 -","- C2 F2 O8 Pt S2 -","- C8 F8 O32 Pt4 S8 -","4","1","","Britta von Ahsen; Rudolf Wartchow; Helge Willner; Volker Jonas; Friedhelm Aubke","Bis(carbonyl)platinum(II) Derivatives: Molecular Structure of cis-Pt(CO)2(SO3F)2, Complete Vibrational Analysis of cis-Pt(CO)2Cl2, and Attempted Synthesis of cis-Pt(CO)2F2","Inorganic Chemistry","2000","39","","4424","4432","10.1021/ic000280j","","","0.71073","MoKα","","0.0689","0.0447","","0.1097","","0.1054","","","1.079","","","1.265","","","","has coordinates","179316","2020-10-21","18:00:00",""
"4321400","6.957","0.002","23.774","0.002","7.758","0.003","90","","94.72","0.03","90","","1278.8","0.6","296.2","","296.2","","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C24 H26 Cl Cu2 N4 O6 S -","- C24 H26 Cl Cu2 N4 O6 S -","- C48 H52 Cl2 Cu4 N8 O12 S2 -","2","1","","Misato Shinoura; Satoru Kita; Masaaki Ohba; Hisashi Ōkawa; Hideki Furutachi; Masatatsu Suzuki","A Heterodinuclear CoIICuI Complex with Co(salen) in a Macrocyclic Framework. Oxygenation Studies in Comparison with Analogous CuIICuI and CoIIPbII Complexes","Inorganic Chemistry","2000","39","","4520","4526","10.1021/ic000305e","","","0.7107","MoKα","","0","0","","","0","0.041","","","","","","1.86","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321401","7.087","0.001","19.593","0.006","19.447","0.003","90","","96.29","0.01","90","","2684.1","1","288.2","","","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C25.5 H29.5 Cl Co Cu N4.5 O6.5 S -","- C25.5 H26 Cl Co Cu N4.5 O6.5 S -","- C102 H104 Cl4 Co4 Cu4 N18 O26 S4 -","4","1","","Misato Shinoura; Satoru Kita; Masaaki Ohba; Hisashi Ōkawa; Hideki Furutachi; Masatatsu Suzuki","A Heterodinuclear CoIICuI Complex with Co(salen) in a Macrocyclic Framework. Oxygenation Studies in Comparison with Analogous CuIICuI and CoIIPbII Complexes","Inorganic Chemistry","2000","39","","4520","4526","10.1021/ic000305e","","","0.7107","MoKα","","","0","","","","0.049","","","","","","1.09","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321402","16.265","0.002","12.64","0.002","18.584","0.002","90","","90.431","0.009","90","","3820.6","0.9","296.2","","296.2","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C30 H40 Cl2 Co N6 O12 Pb S -","- C30 H40 Cl2 Co N6 O12 Pb S -","- C120 H160 Cl8 Co4 N24 O48 Pb4 S4 -","4","1","","Misato Shinoura; Satoru Kita; Masaaki Ohba; Hisashi Ōkawa; Hideki Furutachi; Masatatsu Suzuki","A Heterodinuclear CoIICuI Complex with Co(salen) in a Macrocyclic Framework. Oxygenation Studies in Comparison with Analogous CuIICuI and CoIIPbII Complexes","Inorganic Chemistry","2000","39","","4520","4526","10.1021/ic000305e","","","0.7107","MoKα","","0","0","","","0","0.033","","","","","","2.54","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321403","11.086","0.008","8.624","0.006","10.906","0.007","93.06","0.02","110.53","0.02","75.06","0.02","942.7","1.1","298","","298","","","","","","","","","6","P -1","-P 1","2","","","","- C14 H22 N O Re S4 -","- C14 H22 N O Re S4 -","- C28 H44 N2 O2 Re2 S8 -","2","1","","Berthold Nock; Theodosia Maina; Achilleas Tsortos; Maria Pelecanou; Catherine P. Raptopoulou; Minas Papadopoulos; Hans-Jürgen Pietzsch; Chariklia I. Stassinopoulou; Aris Terzis; Hartmut Spies; Georgios Nounesis; Efstratios Chiotellis","Glutathione Interaction with SNS/S Mixed-Ligand Complexes of Oxorhenium(V): Kinetic Aspects and Characterization of the Products","Inorganic Chemistry","2000","39","","4433","4441","10.1021/ic000350m","","","0.71073","MoKα","","0.0186","0.0181","","0.0522","0.0517","","","","1.135","1.137","1.137","","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321404","12.5","0.02","22.63","0.04","10.49","0.02","90","","101.37","0.04","90","","2909","9","298","","298","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C13 H12 N O Re S3 -","- C13 H12 N O Re S3 -","- C104 H96 N8 O8 Re8 S24 -","8","2","","Berthold Nock; Theodosia Maina; Achilleas Tsortos; Maria Pelecanou; Catherine P. Raptopoulou; Minas Papadopoulos; Hans-Jürgen Pietzsch; Chariklia I. Stassinopoulou; Aris Terzis; Hartmut Spies; Georgios Nounesis; Efstratios Chiotellis","Glutathione Interaction with SNS/S Mixed-Ligand Complexes of Oxorhenium(V): Kinetic Aspects and Characterization of the Products","Inorganic Chemistry","2000","39","","4433","4441","10.1021/ic000350m","","","0.71073","MoKα","","0.0889","0.0633","","0.1648","0.1421","","","","1.044","1.075","1.075","","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321405","16.962","0.002","13.933","0.005","17.125","0.004","90","","93.262","0.015","90","","4040.6","1.8","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C26 H56 N4 O4 P4 S4 -","- C26 H56 N4 O4 P4 S4 -","- C104 H224 N16 O16 P16 S16 -","4","2","","Praveen Kommana; K. C. Kumara Swamy","Synthesis and Structural Characterization of a New Class of Macrocycles Based on a Cyclodiphosphazane Skeleton","Inorganic Chemistry","2000","39","","4384","4385","10.1021/ic000359o","","","0.71073","MoKα","","0.0622","0.0392","","","0.0801","0.0952","","","","","","1.077","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321406","20.254","0.006","20.386","0.003","18.146","0.004","90","","111.49","0.02","90","","6972","3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C29.5 H40 Cl4 N2 O4 P2 -","- C29.5 H36 Cl4 N2 O4 P2 -","- C236 H288 Cl32 N16 O32 P16 -","8","1","","Praveen Kommana; K. C. Kumara Swamy","Synthesis and Structural Characterization of a New Class of Macrocycles Based on a Cyclodiphosphazane Skeleton","Inorganic Chemistry","2000","39","","4384","4385","10.1021/ic000359o","","","0.71073","MoKα","","0.1048","0.049","","","0.1276","0.1651","","","","","","1.002","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321407","16.8572","0.0004","14.118","0.0003","13.391","0.0001","90","","113.3","0.03","90","","2927","0.7","203","2","203","2","","","","","","","","4","C 1 2 1","C 2y","5","","Tetra(n-butyl)ammonium tetracyanotricuprate(I) acetronitrile solvate","","- C22 H39 Cu3 N6 -","- C22 H39 Cu3 N6 -","- C88 H156 Cu12 N24 -","4","1","","Graham A. Bowmaker; Hans Hartl; Victoria Urban","Crystal Structures and Vibrational Spectroscopy of [NBu4][Cu(CN)X] (X = Br, I) and [NBu4][Cu3(CN)4].CH3CN","Inorganic Chemistry","2000","39","","4548","4554","10.1021/ic000399s","","","0.71073","MoKα","","0.0639","0.0361","","","0.0864","0.1016","","","","","","1.007","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321408","21.683","0.002","12.233","0.002","17.632","0.003","90","","111.71","0.01","90","","4345.1","1.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tetra(n-butyl)ammonium iodo(cyano)cuprate(I)","","- C34 H72 Cu2 I2 N4 -","- C34 H72 Cu2 I2 N4 -","- C136 H288 Cu8 I8 N16 -","4","1","","Graham A. Bowmaker; Hans Hartl; Victoria Urban","Crystal Structures and Vibrational Spectroscopy of [NBu4][Cu(CN)X] (X = Br, I) and [NBu4][Cu3(CN)4].CH3CN","Inorganic Chemistry","2000","39","","4548","4554","10.1021/ic000399s","","","0.7107","MoKα","","0.0697","0.0344","","","0.0788","0.0904","","","","","","1.011","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321409","17.4956","0.0011","12.1741","0.0008","19.2434","0.0012","90","","90","","90","","4098.7","0.5","143","2","143","2","","","","","","","","5","P n a 21","P 2c -2n","33","","Tetra(n-butyl)ammonium bromo(cyano)cuprate(I)","","- C34 H72 Br2 Cu2 N4 -","- C34 H72 Br2 Cu2 N4 -","- C136 H288 Br8 Cu8 N16 -","4","1","","Graham A. Bowmaker; Hans Hartl; Victoria Urban","Crystal Structures and Vibrational Spectroscopy of [NBu4][Cu(CN)X] (X = Br, I) and [NBu4][Cu3(CN)4].CH3CN","Inorganic Chemistry","2000","39","","4548","4554","10.1021/ic000399s","","","0.71073","MoKα","","0.0703","0.0406","","","0.0813","0.0879","","","","","","0.922","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321410","4.2612","0.0003","19.407","0.0013","26.3972","0.0018","90","","90","","90","","2183","0.3","295","2","295","2","","","","","","","","3","I m m m","-I 2 2","71","praseodymium gallium antimonide","praseodymium gallium antimonide","","- Ga3.98 Pr12 Sb22.9 -","- Ga3.982 Pr12 Sb22.892 -","- Ga7.964 Pr24 Sb45.784 -","2","0.125","","Allison M. Mills; Arthur Mar","Rare-Earth Gallium Antimonides La13Ga8Sb21andRE12Ga4Sb23 (RE = La-Nd, Sm): Linking Sb Ribbons by Ga6-Rings or Ga2-Pairs","Inorganic Chemistry","2000","39","","4599","4607","10.1021/ic000519w","","","0.71073","MoKα","","0.0515","0.0297","","","0.0637","0.0723","","","","","","0.985","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321411","17.657","0.002","17.657","0.002","4.3378","0.0007","90","","90","","120","","1171.2","0.3","295","2","295","2","","","","","","","","3","P 6/m m m","-P 6 2","191","lanthanum gallium antimonide","lanthanum gallium antimonide","","- Ga7.56 La12.85 Sb21 -","- Ga7.564 La12.859 Sb21 -","- Ga7.564 La12.859 Sb21 -","1","0.0416667","","Allison M. Mills; Arthur Mar","Rare-Earth Gallium Antimonides La13Ga8Sb21andRE12Ga4Sb23 (RE = La-Nd, Sm): Linking Sb Ribbons by Ga6-Rings or Ga2-Pairs","Inorganic Chemistry","2000","39","","4599","4607","10.1021/ic000519w","","","0.71073","MoKα","","0.0755","0.0335","","","0.073","0.0845","","","","","","0.922","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321412","9.92","0.002","12.925","0.002","15.768","0.003","90","","93.17","0.01","90","","2018.6","0.6","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C34 H52 Cl2 Cu2 Fe2 N6 O12 -","- C34 H52 Cl2 Cu2 Fe2 N6 O12 -","- C68 H104 Cl4 Cu4 Fe4 N12 O24 -","2","0.5","","Concepción López; Ramon Costa; Francesc Illas; Elies Molins; Enric Espinosa","Ferromagnetic Copper(II) Complex Containing Ferrocenecarboxylato Bridging Ligands","Inorganic Chemistry","2000","39","","4560","4565","10.1021/ic000521n","","","0.71069","MoKα","","0.1608","0.0575","","","0.1377","0.1609","","","","","","0.932","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321413","23.225","0.002","24.799","0.007","22.912","0.003","90","","90","","90","","13196","4","173","2","173","2","","","","","","","","7","P b c n","-P 2n 2ab","60","","","","- C64 H64 Cl4 F3 Ir2 N8 O10 -","- C64 H60 Cl4 F3 Ir2 N8 O10 -","- C512 H480 Cl32 F24 Ir16 N64 O80 -","8","1","","F. Albert Cotton; Chun Lin; Carlos A. Murillo","A Reliable Method of Preparation of Diiridium Paddlewheel Complexes: Structures of the First Compounds with Ir25+ Cores","Inorganic Chemistry","2000","39","","4574","4578","10.1021/ic000527c","","","0.71073","MoKα","","0.1326","0.0425","","0.1158","0.0923","","","","1.017","1.145","1.145","","","","","has coordinates,has disorder","179317","2020-10-21","18:00:00",""
"4321414","14.107","0.004","12.51","0.002","16.406","0.003","90","","90.51","0.02","90","","2895.2","1.1","213","2","213","2","","","","","","","","7","P 1 2/n 1","-P 2yac","13","","","","- C55 H38 Cl10 F3 Ir2 N8 O2 -","- C55 H36 Cl10 F3 Ir2 N8 O2 -","- C110 H72 Cl20 F6 Ir4 N16 O4 -","2","0.5","","F. Albert Cotton; Chun Lin; Carlos A. Murillo","A Reliable Method of Preparation of Diiridium Paddlewheel Complexes: Structures of the First Compounds with Ir25+ Cores","Inorganic Chemistry","2000","39","","4574","4578","10.1021/ic000527c","","","0.71073","MoKα","","0.0823","0.0631","","0.1596","0.1364","","","","1.162","1.152","1.152","","","","","has coordinates,has disorder","179317","2020-10-21","18:00:00",""
"4321415","9.195","0.003","27.42","0.003","18.306","0.005","90","","90.16","0.02","90","","4615","2","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C53 H62 Ir2 N4 O4 -","- C53 H62 Ir2 N4 O4 -","- C212 H248 Ir8 N16 O16 -","4","1","","F. Albert Cotton; Chun Lin; Carlos A. Murillo","A Reliable Method of Preparation of Diiridium Paddlewheel Complexes: Structures of the First Compounds with Ir25+ Cores","Inorganic Chemistry","2000","39","","4574","4578","10.1021/ic000527c","","","0.71073","MoKα","","0.051","0.0296","","0.0773","0.0716","","","","1.054","1.093","1.093","","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321416","12.9795","0.0003","16.3959","0.0005","13.831","0.001","90","","116.987","0.004","90","","2622.9","0.2","213","2","213","2","","","","","","","","7","P 1 2/n 1","-P 2yac","13","","","","- C44 H51 B2 F8 Ir2 N11 O4 -","- C44 H48 B2 F8.002 Ir2 N11 O4 -","- C88 H96 B4 F16.004 Ir4 N22 O8 -","2","0.5","","F. Albert Cotton; Chun Lin; Carlos A. Murillo","A Reliable Method of Preparation of Diiridium Paddlewheel Complexes: Structures of the First Compounds with Ir25+ Cores","Inorganic Chemistry","2000","39","","4574","4578","10.1021/ic000527c","","","0.71073","MoKα","","0.0309","0.0281","","0.0699","0.0676","","","","1.131","1.136","1.136","","","","","has coordinates,has disorder","179317","2020-10-21","18:00:00",""
"4321417","18.9526","0.0004","18.9526","0.0004","15.8246","0.0002","90","","90","","90","","5684.21","0.18","200","1","200","1","","","","","","","","7","P -4 b 2","P -4 -2ab","117","","","","- C19 H33 Cl2 N3 O9 S2 Zn -","- C19 H33 Cl2 N3 O9 S2 Zn -","- C152 H264 Cl16 N24 O72 S16 Zn8 -","8","1","","Lisa M. Berreau; Magdalena M. Makowska-Grzyska; Atta M. Arif","Amide Alcoholysis in Mononuclear Zinc and Cadmium Complexes Ligated by Thioether Sulfur and Nitrogen Donors","Inorganic Chemistry","2000","39","","4390","4391","10.1021/ic000547e","","","0.71073","MoKα","","0.0471","0.041","","","0.1009","0.1056","","","","","","1.061","","","","has coordinates,has disorder","179317","2020-10-21","18:00:00",""
"4321418","8.9286","0.0002","12.9441","0.0003","13.1357","0.0003","91.6753","0.0014","104.379","","97.957","0.0014","1453.21","0.06","200","1","200","2","","","","","","","","7","P -1","-P 1","2","","","","- C18.5 H35 Cd Cl2 N3 O10.5 S2 -","- C18.57 H33 Cd Cl2 N3 O10.57 S2 -","- C37.14 H66 Cd2 Cl4 N6 O21.14 S4 -","2","1","","Lisa M. Berreau; Magdalena M. Makowska-Grzyska; Atta M. Arif","Amide Alcoholysis in Mononuclear Zinc and Cadmium Complexes Ligated by Thioether Sulfur and Nitrogen Donors","Inorganic Chemistry","2000","39","","4390","4391","10.1021/ic000547e","","","0.71073","MoKα","","0.0585","0.0431","","","0.1042","0.1127","","","","","","1.026","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321419","12.522","0.001","11.117","0.001","12.643","0.001","65.433","0.004","81.488","0.004","74.338","0.003","1540","0.2","298","","298","","","","","","","","","5","P -1","-P 1","2","","","","- C48 H74 Cu5 N4 O22 -","- C48 H74 Cu5 N4 O22 -","- C48 H74 Cu5 N4 O22 -","1","0.5","","Giannis S. Papaefstathiou; Catherine P. Raptopoulou; Alexandros Tsohos; Aris Terzis; Evangelos G. Bakalbassis; Spyros P. Perlepes","Alcoholysis of 2,2'-Pyridil, (2-C5H4N)C(O)C(O)(2-C5H4N), in the Presence of Copper(II): A Family of Planar Pentanuclear Copper(II) Complexes Stabilized by [(2-C5H4N)C(O)(OR)C(O)(OR)(2-C5H4N)]2- and Carboxylate Ligands","Inorganic Chemistry","2000","39","","4658","4662","10.1021/ic991169k","","","1.5418","CuKα","","0.0481","0.0381","","0.1115","0.1011","","","","1.04","1.041","1.041","","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321420","25.12","0.01","16.45","0.007","17.254","0.007","90","","92.32","0.01","90","","7124","5","298","","298","","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","","","- C52.4 H80.4 Cu5 N4 O20.8 -","- C52.4 H50 Cu5 N4 O20.8 -","- C209.6 H200 Cu20 N16 O83.2 -","4","0.5","","Giannis S. Papaefstathiou; Catherine P. Raptopoulou; Alexandros Tsohos; Aris Terzis; Evangelos G. Bakalbassis; Spyros P. Perlepes","Alcoholysis of 2,2'-Pyridil, (2-C5H4N)C(O)C(O)(2-C5H4N), in the Presence of Copper(II): A Family of Planar Pentanuclear Copper(II) Complexes Stabilized by [(2-C5H4N)C(O)(OR)C(O)(OR)(2-C5H4N)]2- and Carboxylate Ligands","Inorganic Chemistry","2000","39","","4658","4662","10.1021/ic991169k","","","0.71073","MoKα","","0.1154","0.0683","","0.2131","0.1736","","","","1.096","1.116","1.116","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321421","12.488","0.005","12.2","0.005","15.373","0.006","111.29","0.01","92.93","0.01","114.33","0.01","1932.1","1.4","298","","298","","","","","","","","","5","P -1","-P 1","2","","","","- C72 H90 Cu5 N4 O22 -","- C72 H88 Cu5 N4 O22 -","- C72 H88 Cu5 N4 O22 -","1","0.5","","Giannis S. Papaefstathiou; Catherine P. Raptopoulou; Alexandros Tsohos; Aris Terzis; Evangelos G. Bakalbassis; Spyros P. Perlepes","Alcoholysis of 2,2'-Pyridil, (2-C5H4N)C(O)C(O)(2-C5H4N), in the Presence of Copper(II): A Family of Planar Pentanuclear Copper(II) Complexes Stabilized by [(2-C5H4N)C(O)(OR)C(O)(OR)(2-C5H4N)]2- and Carboxylate Ligands","Inorganic Chemistry","2000","39","","4658","4662","10.1021/ic991169k","","","0.71073","MoKα","","0.071","0.0458","","0.1077","0.0966","","","","1.159","1.221","1.221","","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321422","20.8","0.007","10.99","0.003","25.177","0.004","90","","96.04","0.02","90","","5723","3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C20.5 H31 B Cl3 N8 Y -","- C20.5 H30 B Cl3 N8 Y -","- C164 H240 B8 Cl24 N64 Y8 -","8","1","","David P. Long; A. Chandrasekaran; Roberta O. Day; Patricia A. Bianconi; Arnold L. Rheingold","Yttrium and Neodymium Di- and Monohalide Complexes Based on Scorpionate (Poly(pyrazolyl)borate) Ligands","Inorganic Chemistry","2000","39","","4476","4487","10.1021/ic991179l","","","0.71073","MoKα","","0.1699","0.0525","","0.1882","0.1092","","","","1.104","1.1","1.1","","","","","has coordinates,has Fobs","176467","2020-10-21","18:00:00",""
"4321423","14.813","0.007","14.813","0.007","15.084","0.007","90","","90","","120","","2866","2","298","2","298","2","","","","","","","","5","P -3","-P 3","147","","","","- C30 H35.5 Fe3 N13 O32.75 -","- C30 H15 Fe3 N13 O32.75 -","- C60 H30 Fe6 N26 O65.5 -","2","0.333333","","Catherine P. Raptopoulou; Vaslis Tangoulis; Vassilis Psycharis","Synthesis and Structural, Spectroscopic, and Magnetic Characterization of (NH4)[Fe3(μ3-OH)(H2L)3(HL)3] (H3L = Orotic Acid) Presenting Two Novel Metal-Binding Modes of the Orotate Ligand: The Case of a Spin-Frustrated System","Inorganic Chemistry","2000","39","","4452","4459","10.1021/ic9914084","","","0.71073","MoKα","","0.0788","0.0621","","","0.1755","0.1908","","","","","","1.101","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321424","18.91","0.002","10.0519","0.0011","12.8339","0.0012","90","","110.301","0.007","90","","2288","0.4","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C20 H24 B Cu F4 N4 S2 -","- C20 H24 B Cu F4 N4 S2 -","- C80 H96 B4 Cu4 F16 N16 S8 -","4","0.5","","Markus Albrecht; Klaus Hübler; Stanislav Zalis; Wolfgang Kaim","Crucial Role of Cu-S Bonding for Structural Changes Accompanying the Reversible CuI/CuII Transition in an Unrestrained Cu(N^S)2 Coordination Arrangement. An Experimental and DFT Study","Inorganic Chemistry","2000","39","","4731","4734","10.1021/ic000021u","","","0.71073","MoKα","","0.0638","0.0399","","","0.0947","0.1069","","","","","","1.026","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321425","9.534","0.002","18.227","0.002","17.775","0.002","90","","94.39","0.01","90","","3079.8","0.8","296.2","","296.2","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C28 H34 S8 Ti -","- C28 H34 S8 Ti -","- C112 H136 S32 Ti4 -","4","1","","Koyu Saito; Motohiro Nakano; Hatsue Tamura; Gen-etsu Matsubayashi","Preparation and Properties of Cyclopentadienyl- and Pentamethylcyclopentadienyl-Titanium(IV) Complexes with the C8H4S8 Ligand, Electrical Conductivities of Their Oxidized Species, and X-ray Crystal Structure of Ti(C5Me5)2(C8H4S8)","Inorganic Chemistry","2000","39","","4815","4820","10.1021/ic0000348","","","0.7107","MoKα","","","0.036","","","","0.04","","","","","","1.35","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321426","13.4542","0.0014","26.1232","0.0014","24.5392","0.0015","90","","96.528","0.01","90","","8568.8","1.1","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","tetrakis[(THF)magnesium tri(tert-butyl)silylphosphandiide]","","- C68 H148 Mg4 O5 P4 Si4 -","- C68 H148 Mg4 O5 P4 Si4 -","- C272 H592 Mg16 O20 P16 Si16 -","4","1","","Matthias Westerhausen; Mathias Krofta; Peter Mayer; Marcus Warchhold; Heinrich Nöth","Polyhedral Members of the Mg2nP2m Family Derived from Dimeric Magnesium Trialkylsilylphosphandiide","Inorganic Chemistry","2000","39","","4721","4724","10.1021/ic000038c","","","0.71073","MoKα","","0.0721","0.0542","","","0.143","0.1516","","","","","","1.062","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321427","13.9513","0.001","14.2692","0.001","24.2088","0.0017","90","","102.415","0.001","90","","4706.6","0.6","183","2","183","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","tetramagnesium bis[tri(tert-butylsilyl)phosphanide] bis[tri(tert-butyl)silylphosphandiide]","","- C36 H83 Mg2 P3 Si3 -","- C36 H83 Mg2 P3 Si3 -","- C144 H332 Mg8 P12 Si12 -","4","1","","Matthias Westerhausen; Mathias Krofta; Peter Mayer; Marcus Warchhold; Heinrich Nöth","Polyhedral Members of the Mg2nP2m Family Derived from Dimeric Magnesium Trialkylsilylphosphandiide","Inorganic Chemistry","2000","39","","4721","4724","10.1021/ic000038c","","","0.71073","MoKα","","0.077","0.0611","","","0.1569","0.175","","","","","","1.026","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321428","12.8914","0.0003","14.927","0.0005","15.1652","0.0004","77.293","0.002","65.019","0.002","72.234","0.002","2505.01","0.13","143","","143","","","","","","","","see text","4","P -1","-P 1","2","","","","- C50 H72 O4 Si2 -","- C50 H72 O4 Si2 -","- C100 H144 O8 Si4 -","2","1","","Reiner Anwander; Jörg Eppinger; Iris Nagl; Wolfgang Scherer; Maxim Tafipolsky; Peter Sirsch","Yttrium Calix[4]arene Complexes. Silylation and Silylamine Elimination Reactions on Model Oxo Surfaces","Inorganic Chemistry","2000","39","","4713","4720","10.1021/ic000147r","","","0.71073","MoKα","","0.0639","0.051","","","0.1283","0.1403","","","","","","1.161","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4321429","13.2625","0.0004","14.5894","0.0003","17.0458","0.0005","65.0986","0.0014","77.8786","0.0008","85.5125","0.0013","2924.71","0.14","193","","193","","","","","","","","see text","5","P -1","-P 1","2","","","","- C112 H146 O10 Si2 Y2 -","- C112 H146 O10 Si2 Y2 -","- C112 H146 O10 Si2 Y2 -","1","0.5","","Reiner Anwander; Jörg Eppinger; Iris Nagl; Wolfgang Scherer; Maxim Tafipolsky; Peter Sirsch","Yttrium Calix[4]arene Complexes. Silylation and Silylamine Elimination Reactions on Model Oxo Surfaces","Inorganic Chemistry","2000","39","","4713","4720","10.1021/ic000147r","","","0.71073","MoKα","","0.0588","0.0505","","","0.1402","0.1471","","","","","","1.053","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321430","10.1774","0.0002","14.168","0.0002","18.7206","0.0002","95.8195","0.0008","95.5294","0.0008","98.1098","0.0007","2641.78","0.07","170","","170","","","","","","","","see text","4","P -1","-P 1","2","","","","- C52 H80 O4 Si4 -","- C52 H80 O4 Si4 -","- C104 H160 O8 Si8 -","2","1","","Reiner Anwander; Jörg Eppinger; Iris Nagl; Wolfgang Scherer; Maxim Tafipolsky; Peter Sirsch","Yttrium Calix[4]arene Complexes. Silylation and Silylamine Elimination Reactions on Model Oxo Surfaces","Inorganic Chemistry","2000","39","","4713","4720","10.1021/ic000147r","","","0.71073","MoKα","","0.0763","0.0607","","","0.1597","0.1684","","","","","","1.033","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4321431","7.8669","0.001","14.358","0.002","21.503","0.003","90","","90","","90","","2428.8","0.6","160","2","160","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C22 H30 N Na O5 S2 Zn -","- C22 H30 N Na O5 S2 Zn -","- C88 H120 N4 Na4 O20 S8 Zn4 -","4","1","","Núria Duran; William Clegg; Lourdes Cucurull-Sánchez; Robert A. Coxall; Hermas R. Jiménez; José-María Moratal; Francesc Lloret; Pilar González-Duarte","Unprecedented Stabilization of Cobalt(II) in a Tetrahedral S2O2 Environment: The Use of a Redox-Noninnocent Ligand","Inorganic Chemistry","2000","39","","4821","4832","10.1021/ic000223q","","","0.71073","MoKα","","0.037","0.0335","","0.0752","0.0733","","","","1.101","1.106","1.106","","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321432","12.168","0.0002","17.9288","0.0002","19.1155","0.0002","90","","92.659","0.002","90","","4165.7","0.09","160","2","160","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C74 H110 Co2 N4 Na2 O16 S6 -","- C74 H24 Co2 N4 Na2 O19.832 S6 -","- C148 H48 Co4 N8 Na4 O39.664 S12 -","2","0.5","","Núria Duran; William Clegg; Lourdes Cucurull-Sánchez; Robert A. Coxall; Hermas R. Jiménez; José-María Moratal; Francesc Lloret; Pilar González-Duarte","Unprecedented Stabilization of Cobalt(II) in a Tetrahedral S2O2 Environment: The Use of a Redox-Noninnocent Ligand","Inorganic Chemistry","2000","39","","4821","4832","10.1021/ic000223q","","","0.71073","MoKα","","0.0792","0.0671","","0.2054","0.185","","","","1.125","1.123","1.123","","","","","has coordinates,has disorder","179317","2020-10-21","18:00:00",""
"4321433","16.3925","0.0013","16.3925","0.0013","58.502","0.005","90","","90","","120","","13614.2","1.9","160","2","160","2","","","","","","","","7","R -3 c :H","-R 3 2""c","167","","","","- C72 H108 Co2 N3 Na3 O18 S6 -","- C77.191 H108 Co2 N3.65 Na3 O18 S6 -","- C463.146 H648 Co12 N21.9 Na18 O108 S36 -","6","0.166667","","Núria Duran; William Clegg; Lourdes Cucurull-Sánchez; Robert A. Coxall; Hermas R. Jiménez; José-María Moratal; Francesc Lloret; Pilar González-Duarte","Unprecedented Stabilization of Cobalt(II) in a Tetrahedral S2O2 Environment: The Use of a Redox-Noninnocent Ligand","Inorganic Chemistry","2000","39","","4821","4832","10.1021/ic000223q","","","0.71073","MoKα","","0.0861","0.0548","","0.1573","0.1278","","","","1.173","1.152","1.152","","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321434","7.7256","0.0014","11.141","0.002","15.606","0.003","103.105","0.005","99.194","0.005","104.501","0.004","1232.7","0.4","160","2","160","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H21 Co O6 S3 -","- C24 H21 Co O6 S3 -","- C48 H42 Co2 O12 S6 -","2","1","","Núria Duran; William Clegg; Lourdes Cucurull-Sánchez; Robert A. Coxall; Hermas R. Jiménez; José-María Moratal; Francesc Lloret; Pilar González-Duarte","Unprecedented Stabilization of Cobalt(II) in a Tetrahedral S2O2 Environment: The Use of a Redox-Noninnocent Ligand","Inorganic Chemistry","2000","39","","4821","4832","10.1021/ic000223q","","","0.71073","MoKα","","0.0458","0.0403","","0.1022","0.0971","","","","1.092","1.094","1.094","","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321435","14.2372","0.0011","18.7351","0.0014","17.1012","0.0013","90","","112.658","0.002","90","","4209.4","0.6","160","2","160","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C44 H60 N2 O4 S2 Zn -","- C44 H60 N2 O4 S2 Zn -","- C176 H240 N8 O16 S8 Zn4 -","4","1","","Núria Duran; William Clegg; Lourdes Cucurull-Sánchez; Robert A. Coxall; Hermas R. Jiménez; José-María Moratal; Francesc Lloret; Pilar González-Duarte","Unprecedented Stabilization of Cobalt(II) in a Tetrahedral S2O2 Environment: The Use of a Redox-Noninnocent Ligand","Inorganic Chemistry","2000","39","","4821","4832","10.1021/ic000223q","","","0.71073","MoKα","","0.0844","0.0767","","0.1864","0.1811","","","","1.174","1.218","1.218","","","","","has coordinates,has disorder","179317","2020-10-21","18:00:00",""
"4321436","14.2439","0.001","18.7125","0.0013","17.1556","0.0011","90","","112.826","0.002","90","","4214.5","0.5","160","2","160","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C44 H60 Co N2 O4 S2 -","- C44 H60 Co N2 O4 S2 -","- C176 H240 Co4 N8 O16 S8 -","4","1","","Núria Duran; William Clegg; Lourdes Cucurull-Sánchez; Robert A. Coxall; Hermas R. Jiménez; José-María Moratal; Francesc Lloret; Pilar González-Duarte","Unprecedented Stabilization of Cobalt(II) in a Tetrahedral S2O2 Environment: The Use of a Redox-Noninnocent Ligand","Inorganic Chemistry","2000","39","","4821","4832","10.1021/ic000223q","","","0.71073","MoKα","","0.1132","0.0937","","0.2468","0.2288","","","","1.138","1.186","1.186","","","","","has coordinates,has disorder","179317","2020-10-21","18:00:00",""
"4321437","14.632","0.002","14.655","0.002","26.239","0.004","90","","100.25","","90","","5536.7","1.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[OsCl(dcpe)2]PF6","","","- C52 H96 Cl F6 Os P5 -","- C52 H96 Cl F6 Os P5 -","- C208 H384 Cl4 F24 Os4 P20 -","4","1","","Peter Barthazy; Michael Wörle; Heinz Rüegger; Antonio Mezzetti","Oxo Complexes of Osmium(IV) Formed via Dioxygen Activation. X-ray Structures of [OsX(dcpe)2]PF6 (X = Cl, Br), [OsCl(η2-O2)(dcpe)2]BPh4, and [OsCl(O)(dcpe)2]BPh4 (dcpe = 1,2-Bis(dicyclohexylphosphino)ethane)","Inorganic Chemistry","2000","39","","4903","4912","10.1021/ic0002420","","","0.71073","MoKα","","0.0348","0.0273","","","0.0588","0.063","","","","","","1.097","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321438","14.546","0.006","14.682","0.007","26.171","0.012","90","","100.68","0.03","90","","5492","4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[OsBr(dcpe)2]PF6","","","- C52 H96 Br F6 Os P5 -","- C52 H85 Br F6 Os P5 -","- C208 H340 Br4 F24 Os4 P20 -","4","1","","Peter Barthazy; Michael Wörle; Heinz Rüegger; Antonio Mezzetti","Oxo Complexes of Osmium(IV) Formed via Dioxygen Activation. X-ray Structures of [OsX(dcpe)2]PF6 (X = Cl, Br), [OsCl(η2-O2)(dcpe)2]BPh4, and [OsCl(O)(dcpe)2]BPh4 (dcpe = 1,2-Bis(dicyclohexylphosphino)ethane)","Inorganic Chemistry","2000","39","","4903","4912","10.1021/ic0002420","","","0.71073","MoKα","","0.0665","0.0581","","","0.1418","0.1437","","","","","","0.968","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321439","23.585","0.004","12.764","0.002","25.587","0.004","90","","103.988","0.001","90","","7474","2","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","[OsCl(O2)(dcpe)2]BPh4","","","- C77 H118 B Cl3 O2 Os P4 -","- C77 H107 B Cl3 O2 Os P4 -","- C308 H428 B4 Cl12 O8 Os4 P16 -","4","1","","Peter Barthazy; Michael Wörle; Heinz Rüegger; Antonio Mezzetti","Oxo Complexes of Osmium(IV) Formed via Dioxygen Activation. X-ray Structures of [OsX(dcpe)2]PF6 (X = Cl, Br), [OsCl(η2-O2)(dcpe)2]BPh4, and [OsCl(O)(dcpe)2]BPh4 (dcpe = 1,2-Bis(dicyclohexylphosphino)ethane)","Inorganic Chemistry","2000","39","","4903","4912","10.1021/ic0002420","","","0.71073","MoKα","","0.0869","0.046","","0.1181","0.0999","","","","0.973","1.044","1.044","","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321440","23.605","0.004","12.824","0.002","25.648","0.004","90","","104.041","0.0005","90","","7532","2","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","[OsCl(O)(dcpe)2]BPh4","","","- C77 H118 B Cl3 O Os P4 -","- C77 H102 B Cl3 O Os P4 -","- C308 H408 B4 Cl12 O4 Os4 P16 -","4","1","","Peter Barthazy; Michael Wörle; Heinz Rüegger; Antonio Mezzetti","Oxo Complexes of Osmium(IV) Formed via Dioxygen Activation. X-ray Structures of [OsX(dcpe)2]PF6 (X = Cl, Br), [OsCl(η2-O2)(dcpe)2]BPh4, and [OsCl(O)(dcpe)2]BPh4 (dcpe = 1,2-Bis(dicyclohexylphosphino)ethane)","Inorganic Chemistry","2000","39","","4903","4912","10.1021/ic0002420","","","0.71073","MoKα","","0.1163","0.0462","","0.1148","0.0904","","","","0.979","1.067","1.067","","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321441","11.0952","0.0002","19.2672","0.0002","24.9759","0.0003","90","","90.637","0.001","90","","5338.85","0.13","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C35 H64 F9 La N8 O17 S3 -","- C35 H64 F9 La N8 O17 S3 -","- C140 H256 F36 La4 N32 O68 S12 -","4","1","","Brian M. Rapko; Bruce K. McNamara; Robin D. Rogers; Grant A. Broker; Gregg J. Lumetta; Benjamin P. Hay","Coordination of Lanthanide Triflates and Perchlorates with N,N,N',N'-Tetramethylsuccinamide","Inorganic Chemistry","2000","39","","4858","4867","10.1021/ic000244k","","","0.71073","MoKα","","0.0625","0.0428","","0.107","0.0901","","","","1.056","1.039","1.039","","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321442","24.6586","0.001","19.3078","0.0007","11.1429","0.0004","90","","90.45","","90","","5305","0.3","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C35 H64 F9 N8 Nd O17 S3 -","- C35 H64 F9 N8 Nd O17 S3 -","- C140 H256 F36 N32 Nd4 O68 S12 -","4","0.5","","Brian M. Rapko; Bruce K. McNamara; Robin D. Rogers; Grant A. Broker; Gregg J. Lumetta; Benjamin P. Hay","Coordination of Lanthanide Triflates and Perchlorates with N,N,N',N'-Tetramethylsuccinamide","Inorganic Chemistry","2000","39","","4858","4867","10.1021/ic000244k","","","0.71073","MoKα","","0.1195","0.0591","","0.1643","0.1236","","","","0.938","0.97","0.97","","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321443","24.4934","0.0002","19.3702","0.0001","11.1542","0.0001","90","","90.229","0.001","90","","5291.98","0.07","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C35 H64 Eu F9 N8 O17 S3 -","- C35 H64 Eu F9 N8 O17 S3 -","- C140 H256 Eu4 F36 N32 O68 S12 -","4","0.5","","Brian M. Rapko; Bruce K. McNamara; Robin D. Rogers; Grant A. Broker; Gregg J. Lumetta; Benjamin P. Hay","Coordination of Lanthanide Triflates and Perchlorates with N,N,N',N'-Tetramethylsuccinamide","Inorganic Chemistry","2000","39","","4858","4867","10.1021/ic000244k","","","0.71073","MoKα","","0.0756","0.0601","","0.1762","0.1545","","","","1.053","1.033","1.033","","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321444","10.9611","0.0002","14.6144","0.0003","15.7992","0.0002","106.594","0.001","91.538","0.001","90.311","0.001","2424.37","0.07","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H64 Cl3 Eu N8 O20 -","- C32 H64 Cl3 Eu N8 O20 -","- C64 H128 Cl6 Eu2 N16 O40 -","2","1","","Brian M. Rapko; Bruce K. McNamara; Robin D. Rogers; Grant A. Broker; Gregg J. Lumetta; Benjamin P. Hay","Coordination of Lanthanide Triflates and Perchlorates with N,N,N',N'-Tetramethylsuccinamide","Inorganic Chemistry","2000","39","","4858","4867","10.1021/ic000244k","","","0.71073","MoKα","","0.0713","0.045","","0.1137","0.0935","","","","0.992","1.036","1.036","","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321445","24.2435","0.0004","19.6141","0.0002","11.2635","0.0001","90","","90.049","0.001","90","","5355.95","0.11","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C35 H64 F9 Lu N8 O17 S3 -","- C35 H64 F9 Lu N8 O17 S3 -","- C140 H256 F36 Lu4 N32 O68 S12 -","4","0.5","","Brian M. Rapko; Bruce K. McNamara; Robin D. Rogers; Grant A. Broker; Gregg J. Lumetta; Benjamin P. Hay","Coordination of Lanthanide Triflates and Perchlorates with N,N,N',N'-Tetramethylsuccinamide","Inorganic Chemistry","2000","39","","4858","4867","10.1021/ic000244k","","","0.71073","MoKα","","0.0279","0.0239","","0.0676","0.0603","","","","1.011","1.004","1.004","","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321446","8.9443","0.0003","11.1924","0.0004","44.2517","0.0013","90","","93.264","0.001","90","","4422.8","0.3","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C27 H50 F9 N6 O16 S3 Yb -","- C27 H50 F9 N6 O16 S3 Yb -","- C108 H200 F36 N24 O64 S12 Yb4 -","4","1","","Brian M. Rapko; Bruce K. McNamara; Robin D. Rogers; Grant A. Broker; Gregg J. Lumetta; Benjamin P. Hay","Coordination of Lanthanide Triflates and Perchlorates with N,N,N',N'-Tetramethylsuccinamide","Inorganic Chemistry","2000","39","","4858","4867","10.1021/ic000244k","","","0.71073","MoKα","","0.0618","0.0514","","0.1157","0.1093","","","","1.178","1.204","1.204","","","","","has coordinates,has disorder","179317","2020-10-21","18:00:00",""
"4321447","19.2312","0.0006","11.1552","0.0003","19.8016","0.0004","90","","111.426","0.0001","90","","3954.42","0.18","173","2","173","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C24 H50 Cl3 N6 O19 Yb -","- C24 H48 Cl3 N6 O19 Yb -","- C96 H192 Cl12 N24 O76 Yb4 -","4","1","","Brian M. Rapko; Bruce K. McNamara; Robin D. Rogers; Grant A. Broker; Gregg J. Lumetta; Benjamin P. Hay","Coordination of Lanthanide Triflates and Perchlorates with N,N,N',N'-Tetramethylsuccinamide","Inorganic Chemistry","2000","39","","4858","4867","10.1021/ic000244k","","","0.71073","MoKα","","0.0399","0.0393","","0.1067","0.1036","","","","1.122","1.123","1.123","","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321448","8.6719","0.00001","12.2683","0.0002","19.8094","0.0003","75.815","0.0001","86.805","0.001","72.607","0.0001","1949.48","0.04","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C19 H38 F9 N4 O16 S3 Yb -","- C19 H32 F9 N4 O16 S3 Yb -","- C38 H64 F18 N8 O32 S6 Yb2 -","2","1","","Brian M. Rapko; Bruce K. McNamara; Robin D. Rogers; Grant A. Broker; Gregg J. Lumetta; Benjamin P. Hay","Coordination of Lanthanide Triflates and Perchlorates with N,N,N',N'-Tetramethylsuccinamide","Inorganic Chemistry","2000","39","","4858","4867","10.1021/ic000244k","","","0.71073","MoKα","","0.0885","0.0843","","0.2237","0.2142","","","","1.168","1.175","1.175","","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321449","8.9306","0.0015","25.385","0.002","14.011","0.002","90","","102.55","0.018","90","","3100.4","0.8","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","[HB(3,5-(CF3)2Pz)3]Ag(MeOCO)2CN2","","","- C20 H10 Ag B F18 N8 O4 -","- C20 H10 Ag B F18 N8 O4 -","- C80 H40 Ag4 B4 F72 N32 O16 -","4","1","","H. V. Rasika Dias; Sharon A. Polach","An Isolable, Oxygen-Coordinated Silver(I) Complex of Dimethyl Diazomalonate: Synthesis and Characterization of [HB(3,5-(CF3)2Pz)3]Ag[OC(OCH3)]2CN2 (Where Pz = Pyrazolyl)","Inorganic Chemistry","2000","39","","4676","4677","10.1021/ic0002521","","","0.71073","MoKα","","0.0496","0.0343","","","0.0752","0.0827","","","","","","1.035","","","","has coordinates,has disorder","179317","2020-10-21","18:00:00",""
"4321450","22.844","0.002","8.668","0.001","16.216","0.002","90","","100.11","0.01","90","","3161.1","0.6","173","2","173","2","","","","","","","","6","P 1 c 1","P -2yc","7","","","","- C8 H18 F6 N4 O S2 -","- C8 H18 F6 N4 O S2 -","- C64 H144 F48 N32 O8 S16 -","8","4","","Enno Lork; Detlef Viets; Rüdiger Mews; Heinz Oberhammer","Reactions of (Carbonylimido)sulfur(IV) Derivatives with TAS-Fluoride, (Me2N)3S+Me3SiF2-","Inorganic Chemistry","2000","39","","4838","4842","10.1021/ic0002824","","","0.71073","MoKα","","0.1393","0.0838","","","0.2088","0.254","","","","","","1.055","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321451","11.0625","0.0009","15.9246","0.0012","17.2104","0.0014","72.327","0.002","83.934","0.002","79.556","0.002","2836.8","0.4","160","2","160","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H70 O5 P2 Si4 Sm -","- C36 H70 O5 P2 Si4 Sm -","- C72 H140 O10 P4 Si8 Sm2 -","2","1","","Keith Izod; Paul O'Shaughnessy; Joanne M. Sheffield; William Clegg; Stephen T. Liddle","Synthesis and Structural Characterization of Sm(II) and Yb(II) Complexes Containing Sterically Demanding, Chelating Secondary Phosphide Ligands","Inorganic Chemistry","2000","39","","4741","4748","10.1021/ic0002871","","","0.71073","MoKα","","0.0915","0.0648","","","0.1696","0.189","","","","","","1.073","","","","has coordinates,has disorder","179317","2020-10-21","18:00:00",""
"4321452","13.176","0.004","13.08","0.004","14.546","0.004","90","","95.363","0.006","90","","2495.9","1.3","160","2","160","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C38 H76 O5 P2 Si4 Sm -","- C38 H76 O5 P2 Si4 Sm -","- C76 H152 O10 P4 Si8 Sm2 -","2","1","","Keith Izod; Paul O'Shaughnessy; Joanne M. Sheffield; William Clegg; Stephen T. Liddle","Synthesis and Structural Characterization of Sm(II) and Yb(II) Complexes Containing Sterically Demanding, Chelating Secondary Phosphide Ligands","Inorganic Chemistry","2000","39","","4741","4748","10.1021/ic0002871","","","0.71073","MoKα","","0.1251","0.1015","","","0.2418","0.2533","","","","","","1.033","","","","has coordinates,has disorder","179317","2020-10-21","18:00:00",""
"4321453","14.988","0.0017","13.0528","0.0015","24.33","0.003","90","","104.507","0.002","90","","4608.1","0.9","160","2","160","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C36 H70 N2 O P2 Si4 Sm -","- C36 H70 N2 O P2 Si4 Sm -","- C144 H280 N8 O4 P8 Si16 Sm4 -","4","0.5","","Keith Izod; Paul O'Shaughnessy; Joanne M. Sheffield; William Clegg; Stephen T. Liddle","Synthesis and Structural Characterization of Sm(II) and Yb(II) Complexes Containing Sterically Demanding, Chelating Secondary Phosphide Ligands","Inorganic Chemistry","2000","39","","4741","4748","10.1021/ic0002871","","","0.71073","MoKα","","0.0426","0.0386","","","0.0854","0.0868","","","","","","1.239","","","","has coordinates,has disorder","179317","2020-10-21","18:00:00",""
"4321454","8.892","0.002","15.285","0.003","15.466","0.003","90","","91.05","0.03","90","","2101.7","0.7","149","2","149","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","[Co(cyclen)(1,2-diaminoethane)](ClO4)3","","","- C10 H28 Cl3 Co N6 O12 -","- C10 H28 Cl3 Co N6 O12 -","- C40 H112 Cl12 Co4 N24 O48 -","4","1","","Andrea J. Clarkson; David A. Buckingham; Andrew J. Rogers; Allan G. Blackman; Charles R. Clark","Kinetic Origin of the Chelate Effect. Base Hydrolysis, H-Exchange Reactivity, and Structures of syn,anti-[Co(cyclen)(NH3)2]3+ and syn,anti-[Co(cyclen)(diamine)]3+ Ions (diamine = H2N(CH2)2NH2, H2N(CH2)3NH2)","Inorganic Chemistry","2000","39","","4769","4775","10.1021/ic000325g","","","0.71073","MoKα","","0.0715","0.0657","","","0.1622","0.1666","","","","","","1.077","","","","has coordinates,has disorder","179317","2020-10-21","18:00:00",""
"4321455","17.805","0.004","12.123","0.003","9.493","0.002","90","","90","","90","","2049.1","0.8","163","2","163","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C8 H26 Cl3 Co N6 O13 -","- C8 H28 Cl3 Co N6 O13 -","- C32 H112 Cl12 Co4 N24 O52 -","4","0.5","","Andrea J. Clarkson; David A. Buckingham; Andrew J. Rogers; Allan G. Blackman; Charles R. Clark","Kinetic Origin of the Chelate Effect. Base Hydrolysis, H-Exchange Reactivity, and Structures of syn,anti-[Co(cyclen)(NH3)2]3+ and syn,anti-[Co(cyclen)(diamine)]3+ Ions (diamine = H2N(CH2)2NH2, H2N(CH2)3NH2)","Inorganic Chemistry","2000","39","","4769","4775","10.1021/ic000325g","","","0.71073","MoKα","","0.0308","0.03","","","0.0848","0.0861","","","","","","0.999","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321456","14.17","0.004","10.623","0.003","12.362","0.004","90","","90","","90","","1860.8","1","168","2","168","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C11 H30 Br3 Co N6 -","- C11 H30 Br3 Co N6 -","- C44 H120 Br12 Co4 N24 -","4","1","","Andrea J. Clarkson; David A. Buckingham; Andrew J. Rogers; Allan G. Blackman; Charles R. Clark","Kinetic Origin of the Chelate Effect. Base Hydrolysis, H-Exchange Reactivity, and Structures of syn,anti-[Co(cyclen)(NH3)2]3+ and syn,anti-[Co(cyclen)(diamine)]3+ Ions (diamine = H2N(CH2)2NH2, H2N(CH2)3NH2)","Inorganic Chemistry","2000","39","","4769","4775","10.1021/ic000325g","","","0.71073","MoKα","","0.0295","0.0289","","","0.0777","0.078","","","","","","1.076","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321457","9.802","0.003","10.022","0.003","15.188","0.004","72.56","0.02","82.77","0.02","89.47","0.02","1411.5","0.7","293","2","293","2","","","","","","","synthesized by the authors, see text","6","P -1","-P 1","2","","","","- C19 H26 Cl4 N8 O4 Re2 -","- C19 H26 Cl4 N8 O4 Re2 -","- C38 H52 Cl8 N16 O8 Re4 -","2","1","","Sébastien Fortin; André L. Beauchamp","Preparation and Characterization of Oxorhenium(V) Complexes with 2,2'-Biimidazole: The Strong Affinity of Coordinated Biimidazole for Chloride Ions via N-H...Cl-Hydrogen Bonding","Inorganic Chemistry","2000","39","","4886","4893","10.1021/ic000328t","","","1.54056","CuKα","","0.046","0.037","","0.0978","","0.0942","","","1.023","","","1.088","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4321458","9.37","0.003","9.573","0.003","16.394","0.005","86.46","0.02","80.57","0.02","68.69","0.03","1351.5","0.8","293","2","293","2","","","","","","","synthesized by the authors, see text","7","P -1","-P 1","2","","","","- C24 H21 Cl3 N4 O2 P Re -","- C24 H21 Cl3 N4 O2 P Re -","- C48 H42 Cl6 N8 O4 P2 Re2 -","2","1","","Sébastien Fortin; André L. Beauchamp","Preparation and Characterization of Oxorhenium(V) Complexes with 2,2'-Biimidazole: The Strong Affinity of Coordinated Biimidazole for Chloride Ions via N-H...Cl-Hydrogen Bonding","Inorganic Chemistry","2000","39","","4886","4893","10.1021/ic000328t","","","1.54056","CuKα","","0.0301","0.0293","","0.0821","","0.0816","","","1.11","","","1.121","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321459","10.323","0.003","11.794","0.003","13.548","0.004","86.22","0.02","83.63","0.02","71.64","0.02","1555","0.8","293","2","293","2","","","","","","","synthesized by the authors, see text","7","P -1","-P 1","2","","","","- C30 H28 Cl3 N4 O2.5 P Re -","- C30 H28 Cl3 N4 O2.5 P Re -","- C60 H56 Cl6 N8 O5 P2 Re2 -","2","1","","Sébastien Fortin; André L. Beauchamp","Preparation and Characterization of Oxorhenium(V) Complexes with 2,2'-Biimidazole: The Strong Affinity of Coordinated Biimidazole for Chloride Ions via N-H...Cl-Hydrogen Bonding","Inorganic Chemistry","2000","39","","4886","4893","10.1021/ic000328t","","","1.54056","CuKα","","0.0585","0.0554","","0.1573","","0.1547","","","1.044","","","1.08","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321460","9.269","0.002","9.635","0.003","18.86","0.004","80.52","0.02","83.65","0.02","62.81","0.02","1476.5","0.7","295","2","295","2","","","","","","","","4","P -1","-P 1","2","[Mn(4-Methylpyridine)2(N3)2]n","","","- C12 H14 Mn N8 -","- C12 H14 Mn N8 -","- C48 H56 Mn4 N32 -","4","2","","Albert Escuer; Joan Cano; Mohamed A. S. Goher; Yves Journaux; Francesc Lloret; Franz A. Mautner; Ramon Vicente","Synthesis, Structural Characterization, and Monte Carlo Simulation of the Magnetic Properties of Two New Alternating MnII Azide 2-D Honeycombs. Study of the Ferromagnetic Ordered Phase below 20 K","Inorganic Chemistry","2000","39","","4688","4695","10.1021/ic000335h","","","0.71069","MoKα","","0.085","0.0519","","0.1297","0.1155","","","","1.043","1.127","1.127","","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321461","14.416","0.003","8.515","0.002","15.728","0.004","90","","117.06","0.02","90","","1719.3","0.8","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","[Mn(4-Ethylpyridine)2(N3)2]n","","","- C14 H18 Mn N8 -","- C14 H18 Mn N8 -","- C56 H72 Mn4 N32 -","4","1","","Albert Escuer; Joan Cano; Mohamed A. S. Goher; Yves Journaux; Francesc Lloret; Franz A. Mautner; Ramon Vicente","Synthesis, Structural Characterization, and Monte Carlo Simulation of the Magnetic Properties of Two New Alternating MnII Azide 2-D Honeycombs. Study of the Ferromagnetic Ordered Phase below 20 K","Inorganic Chemistry","2000","39","","4688","4695","10.1021/ic000335h","","","0.71069","MoKα","","0.1004","0.0523","","0.1577","0.1143","","","","1.123","1.077","1.077","","","","","has coordinates,has disorder","179317","2020-10-21","18:00:00",""
"4321462","12.756","0.004","13.006","0.003","15.291","0.003","92.61","0.02","103.85","0.02","112.01","0.02","2257.7","1.1","220","2","220","2","","","","","","","","4","P -1","-P 1","2","","","","- C53 H66 O4 Si -","- C53 H66 O4 Si -","- C106 H132 O8 Si2 -","2","1","","Maomian Fan; Igor V. Shevchenko; R. Harmony Voorhies; Scott F. Eckert; Hongming Zhang; Michael Lattman","Main-Group-Element Calix[4]arenes: Variable Coordination and Conformational Isomerism at Phosphorus and Silicon","Inorganic Chemistry","2000","39","","4704","4712","10.1021/ic000349n","","","0.71073","MoKα","","0.0808","0.0519","","0.1453","0.1237","","","","1.017","1.068","1.068","","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4321463","13.328","0.002","21.56","0.004","20.72","0.004","90","","104.18","0.01","90","","5772.5","1.8","220","2","220","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C50 H71 I6 O4 P -","- C50.01 H55 I6.01 O4 P -","- C200.04 H220 I24.04 O16 P4 -","4","1","","Maomian Fan; Igor V. Shevchenko; R. Harmony Voorhies; Scott F. Eckert; Hongming Zhang; Michael Lattman","Main-Group-Element Calix[4]arenes: Variable Coordination and Conformational Isomerism at Phosphorus and Silicon","Inorganic Chemistry","2000","39","","4704","4712","10.1021/ic000349n","","","0.71073","MoKα","","0.1063","0.0681","","0.1971","0.1641","","","","1.024","1.084","1.084","","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321464","44.267","0.004","44.267","0.004","13.311","0.001","90","","90","","120","","22589","3","228","2","228","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C53 H71 O6 P -","- C53 H71 O6 P -","- C954 H1278 O108 P18 -","18","1","","Maomian Fan; Igor V. Shevchenko; R. Harmony Voorhies; Scott F. Eckert; Hongming Zhang; Michael Lattman","Main-Group-Element Calix[4]arenes: Variable Coordination and Conformational Isomerism at Phosphorus and Silicon","Inorganic Chemistry","2000","39","","4704","4712","10.1021/ic000349n","","","0.71073","MoKα","","0.1582","0.1012","","0.3669","0.2562","","","","1.03","1.115","1.115","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321465","10.751","0.003","17.892","0.005","11.774","0.003","90","","103.88","0.02","90","","2198.7","1.1","220","2","220","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C29 H24 O4 Si -","- C29 H23 O4 Si -","- C116 H92 O16 Si4 -","4","1","","Maomian Fan; Igor V. Shevchenko; R. Harmony Voorhies; Scott F. Eckert; Hongming Zhang; Michael Lattman","Main-Group-Element Calix[4]arenes: Variable Coordination and Conformational Isomerism at Phosphorus and Silicon","Inorganic Chemistry","2000","39","","4704","4712","10.1021/ic000349n","","","0.71073","MoKα","","0.1268","0.0774","","0.206","0.1668","","","","1.041","1.13","1.13","","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321466","12.395","0.002","18.021","0.004","18.763","0.004","86.45","0.03","79.09","0.03","74.87","0.03","3972.3","1.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","1,3-dialkyl derivative of p-t-Butylcalix[4]arene, cone conformation","","","- C79.5 H112 Cl N6 O11.5 -","- C79.5 H110 Cl N6 O11.5 -","- C159 H220 Cl2 N12 O23 -","2","1","","Pascal Froidevaux; Jack M. Harrowfield; Alexander N. Sobolev","Calixarenes as Scaffolds: Introduction of Tridentate Rare Earth Metal Binding Units into Calix[4]arene","Inorganic Chemistry","2000","39","","4678","4687","10.1021/ic000353z","","","0.71073","MoKα","","0.1411","0.1098","","0.3314","0.2982","","","","1.004","1.14","1.14","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4321467","14.19","0.003","13.444","0.003","18.258","0.004","90","","108.57","0.03","90","","3301.7","1.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","1,3-dialkyl derivative of p-t-Butylcalix[4]arene, 1,2-alternate conformation","","","- C70 H88 N2 O15 -","- C70 H86 N2 O15 -","- C140 H172 N4 O30 -","2","0.5","","Pascal Froidevaux; Jack M. Harrowfield; Alexander N. Sobolev","Calixarenes as Scaffolds: Introduction of Tridentate Rare Earth Metal Binding Units into Calix[4]arene","Inorganic Chemistry","2000","39","","4678","4687","10.1021/ic000353z","","","0.71073","MoKα","","0.1238","0.0811","","0.2389","0.1953","","","","1.247","1.322","1.322","","","","","has coordinates,has disorder","179317","2020-10-21","18:00:00",""
"4321468","12.483","0.001","19.099","0.001","19.176","0.001","100.93","0.01","108.14","0.01","108.28","0.01","3910.7","0.7","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C146 H212 Eu2 N14 O22 -","- C146 H212 Eu2 N14 O22 -","- C146 H212 Eu2 N14 O22 -","1","0.5","","Pascal Froidevaux; Jack M. Harrowfield; Alexander N. Sobolev","Calixarenes as Scaffolds: Introduction of Tridentate Rare Earth Metal Binding Units into Calix[4]arene","Inorganic Chemistry","2000","39","","4678","4687","10.1021/ic000353z","","","0.71073","MoKα","","0.0947","0.0696","","","0.1873","0.2014","","","","","","1.034","","","","has coordinates,has disorder","179317","2020-10-21","18:00:00",""
"4321469","12.0309","0.0016","9.7063","0.0018","28.769","0.003","90","0.012","93.074","0.01","90","0.013","3354.7","0.8","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","6S^*^,7S^*^,16S^*^,17S^*^-3,3,10,10,13,13,20,20-Octamethyl- diperhydrobenzo-[f,p]-1,2,10,12-tetrathia-5,8,15,18- tetraaza-cycloicosane","","- C28 H56 N4 S4 -","- C28 H56 N4 S4 -","- C112 H224 N16 S16 -","4","1","","Stephen Fox; Robert T. Stibrany; Joseph A. Potenza; Spencer Knapp; Harvey J. Schugar","Copper(II) and Nickel(II) Complexes of Binucleating Macrocyclic Bis(disulfide)tetramine Ligands","Inorganic Chemistry","2000","39","","4950","4961","10.1021/ic000380p","","","1.54184","CuKα","","0.0935","0.0589","","","0.1595","0.1852","","","","","","1.022","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321470","10.085","0.002","12.325","0.002","10.091","0.002","104.81","0.03","98.72","0.03","104.59","0.03","1141.8","0.5","298","1","293","2","","","","","","","","6","P 1","P 1","1","","[Cu~2~(rac-9)I~2~(CH~3~CN)~2~]^2+^2I^-^","","- C32 H62 Cu2 I4 N6 S4 -","- C32 H62 Cu2 I4 N6 S4 -","- C32 H62 Cu2 I4 N6 S4 -","1","1","","Stephen Fox; Robert T. Stibrany; Joseph A. Potenza; Spencer Knapp; Harvey J. Schugar","Copper(II) and Nickel(II) Complexes of Binucleating Macrocyclic Bis(disulfide)tetramine Ligands","Inorganic Chemistry","2000","39","","4950","4961","10.1021/ic000380p","","","0.71069","MoKα","","0.0822","0.0771","","","0.1947","0.2022","","","","","","1.101","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321471","10.119","0.003","12.288","0.004","10.121","0.003","104.68","0.02","98.39","0.02","104.75","0.02","1147.1","0.6","298","1","299","1","","","","","","","","6","P 1","P 1","1","","[Ni~2~(rac-9)I~2~(CH~3~CN)~2~]^2+^2I^-^","","- C32 H62 I4 N6 Ni2 S4 -","- C32 H62 I4 N6 Ni2 S4 -","- C32 H62 I4 N6 Ni2 S4 -","1","1","","Stephen Fox; Robert T. Stibrany; Joseph A. Potenza; Spencer Knapp; Harvey J. Schugar","Copper(II) and Nickel(II) Complexes of Binucleating Macrocyclic Bis(disulfide)tetramine Ligands","Inorganic Chemistry","2000","39","","4950","4961","10.1021/ic000380p","","","0.71069","MoKα","","0.0431","0.0324","","","0.0873","0.0941","","","","","","1.027","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321472","44.762","0.01","19.032","0.004","22.079","0.008","90","","98.893","0.002","90","","18583","9","295","2","295","","","","","","","","?","7","C 1 2/c 1","-C 2yc","15","","","","- C56 H128 N3 O38 P Si2 W10 -","- C54.5727 N3 O38 P Si2 W10 -","- C436.582 N24 O304 P8 Si16 W80 -","8","1","","Agnès Mazeaud; Yves Dromzee; René Thouvenot","Organic-Inorganic Hybrids Based on Polyoxometalates. 6.1 Syntheses, Structure, and Reactivity of the Bis(tert-butylsilyl)decatungstophosphate [(γ-PW10O36)(t-BuSiOH)2]3-","Inorganic Chemistry","2000","39","","4735","4740","10.1021/ic0004784","","","0.71069","MoKα","","","0.0796","","","0.0918","","","","","1.142","1.142","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4321473","14.7147","0.0009","11.8158","0.0008","21.6449","0.0016","90","","106.449","0.005","90","","3609.3","0.4","200","2","200","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","acetyl iodide carbonyl triisopropylphosphine di-mu-diamidonaphthalene di-rhodium","","- C31 H53 I N2 O2 P2 Rh2 -","- C31 H53 I N2 O2 P2 Rh2 -","- C124 H212 I4 N8 O8 P8 Rh8 -","4","1","","M. Victoria Jiménez; Eduardo Sola; M. Angeles Egea; Aline Huet; Ana C. Francisco; Fernando J. Lahoz; Luis A. Oro","Key Factors Determining the Course of Methyl Iodide Oxidative Addition to Diamidonaphthalene-Bridged Diiridium(I) and Dirhodium(I) Complexes","Inorganic Chemistry","2000","39","","4868","4878","10.1021/ic000497d","","","0.71073","MoKα","","0.0379","0.0282","","","0.063","0.0668","","","","","","1.032","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321474","17.8409","0.0018","11.9065","0.0012","15.81","0.0016","90","","101.049","0.002","90","","3296.1","0.6","153","2","153","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C30 H50 N2 O2 P2 Rh2 -","- C30 H50 N2 O2 P2 Rh2 -","- C120 H200 N8 O8 P8 Rh8 -","4","0.5","","M. Victoria Jiménez; Eduardo Sola; M. Angeles Egea; Aline Huet; Ana C. Francisco; Fernando J. Lahoz; Luis A. Oro","Key Factors Determining the Course of Methyl Iodide Oxidative Addition to Diamidonaphthalene-Bridged Diiridium(I) and Dirhodium(I) Complexes","Inorganic Chemistry","2000","39","","4868","4878","10.1021/ic000497d","","","0.71073","MoKα","","0.0775","0.0385","","","0.0661","0.0759","","","","","","0.997","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321475","7.605","0.001","7.36","0.001","15.017","0.001","90","","90","","90","","840.54","0.17","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","(Difluoro)methoxioxo Iodine(V)","","- C H3 F2 I O2 -","- C H3 F2 I O2 -","- C8 H24 F16 I8 O16 -","8","1","","Rolf Minkwitz; Michael Berkei; Marc Studentkowski; Ralf Ludwig","Crystal Structure of (Difluoro)methoxyoxo Iodine(V) IF2(O)OCH3","Inorganic Chemistry","2000","39","","4766","4768","10.1021/ic000525s","","","0.71069","MoKα","","0.0497","0.0264","","0.0569","0.0516","","","","0.948","1.029","1.029","","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4321476","7.7729","0.0016","19.049","0.004","17.865","0.004","90","","93.13","0.03","90","","2641.3","1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H20 Cd N10 O6 -","- C24 H20 Cd N10 O6 -","- C96 H80 Cd4 N40 O24 -","4","1","","Yu-Bin Dong; Mark D. Smith; Hans-Conrad zur Loye","New Inorganic/Organic Coordination Polymers Generated from Bidentate Schiff-Base Ligands","Inorganic Chemistry","2000","39","","4927","4935","10.1021/ic0006504","","","0.7107","MoKα","","0.0415","0.0376","","","0.1024","0.1061","","","","","","1.057","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321477","19.031","0.004","33.627","0.007","14.299","0.003","90","","90","","90","","9151","3","293","2","293","2","","","","","","","","5","C c c a :2","-C 2a 2ac","68","","","","- C18 H17 Co N8 O7 -","- C72 H60 Co4 N32 O27.96 -","- C288 H240 Co16 N128 O111.84 -","4","0.25","","Yu-Bin Dong; Mark D. Smith; Hans-Conrad zur Loye","New Inorganic/Organic Coordination Polymers Generated from Bidentate Schiff-Base Ligands","Inorganic Chemistry","2000","39","","4927","4935","10.1021/ic0006504","","","0.7107","MoKα","","0.0628","0.0437","","","0.1063","0.1165","","","","","","1.086","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321478","8.5802","0.0017","17.506","0.004","10.443","0.002","90","","96.59","0.03","90","","1558.2","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H28 Cd N10 O6 -","- C28 H28 Cd N10 O6 -","- C56 H56 Cd2 N20 O12 -","2","0.5","","Yu-Bin Dong; Mark D. Smith; Hans-Conrad zur Loye","New Inorganic/Organic Coordination Polymers Generated from Bidentate Schiff-Base Ligands","Inorganic Chemistry","2000","39","","4927","4935","10.1021/ic0006504","","","0.7107","MoKα","","0.0404","0.0332","","","0.0877","0.0929","","","","","","1.092","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321479","16.387","0.002","3.8258","0.0005","9.9788","0.0014","90","","90","","90","","625.6","0.14","295","2","295","2","","","","","","","","3","P n m a","-P 2ac 2n","62","zirconium palladium phosphide","zirconium palladium phosphide","","- P1.5 Pd2 Zr1.5 -","- P1.5 Pd2 Zr1.5 -","- P12 Pd16 Zr12 -","8","1","","Meitian Wang; Robert McDonald; Arthur Mar","Ternary Early-Transition-Metal Palladium Pnictides Zr3Pd4P3, Hf3Pd4P3, HfPdSb, and Nb5Pd4P4","Inorganic Chemistry","2000","39","","4936","4941","10.1021/ic0006551","","","0.71073","MoKα","","0.096","0.0439","","","0.0709","0.0805","","","","","","0.853","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321480","16.3399","0.0016","3.7867","0.0003","9.9536","0.001","90","","90","","90","","615.87","0.1","295","2","295","2","","","","","","","","3","P n m a","-P 2ac 2n","62","hafnium palladium phosphide","hafnium palladium phosphide","","- Hf1.5 P1.5 Pd2 -","- Hf1.5 P1.5 Pd2 -","- Hf12 P12 Pd16 -","8","1","","Meitian Wang; Robert McDonald; Arthur Mar","Ternary Early-Transition-Metal Palladium Pnictides Zr3Pd4P3, Hf3Pd4P3, HfPdSb, and Nb5Pd4P4","Inorganic Chemistry","2000","39","","4936","4941","10.1021/ic0006551","","","0.71073","MoKα","","0.0948","0.0488","","","0.0688","0.0789","","","","","","0.915","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321481","10.5055","0.0002","10.065","0.0004","16.246","0.0005","90","","93.764","0.002","90","","1714.11","0.09","200","1","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H34 Cu2 N2 O10 -","- C34 H34 Cu2 N2 O10 -","- C68 H68 Cu4 N4 O20 -","2","0.5","","Rico E. Del Sesto; Atta M. Arif; Joel S. Miller","Copper(II) Benzoate Nitroxide Dimers and Chains: Structure and Magnetic Studies","Inorganic Chemistry","2000","39","","4894","4902","10.1021/ic0007106","","","0.71073","MoKα","","0.0271","0.0258","","","0.072","0.073","","","","","","1.047","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321482","15.861","0.0009","5.869","0.0002","14.972","0.0008","90","","121.381","0.0015","90","","1189.85","0.1","200","1","293","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C24 H20 Br2 Cu N2 O5 -","- C24 H20 Br2 Cu N2 O5 -","- C48 H40 Br4 Cu2 N4 O10 -","2","0.5","","Rico E. Del Sesto; Atta M. Arif; Joel S. Miller","Copper(II) Benzoate Nitroxide Dimers and Chains: Structure and Magnetic Studies","Inorganic Chemistry","2000","39","","4894","4902","10.1021/ic0007106","","","0.7107","MoKα","","0.0226","0.0221","","","0.0582","0.0586","","","","","","1.06","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321483","5.9662","0.0002","8.186","0.0003","12.8681","0.0005","94.12","0.0019","99.512","0.002","99.944","0.002","607.25","0.04","200","1","200","1","","","","","","","","6","P -1","-P 1","2","","","","- C24 H18 Br2 Cu N2 O4 -","- C24 H18 Br2 Cu N2 O4 -","- C24 H18 Br2 Cu N2 O4 -","1","0.5","","Rico E. Del Sesto; Atta M. Arif; Joel S. Miller","Copper(II) Benzoate Nitroxide Dimers and Chains: Structure and Magnetic Studies","Inorganic Chemistry","2000","39","","4894","4902","10.1021/ic0007106","","","0.71073","MoKα","","0.0805","0.077","","","0.2413","0.2461","","","","","","1.135","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321484","20.4992","0.0004","10.404","0.0002","19.8147","0.0004","90","","111.323","0.0012","90","","3936.67","0.14","295","2","295","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C32 H44 B2 F8 Fe N12 -","- C32 H44 B2 F8 Fe N12 -","- C128 H176 B8 F32 Fe4 N48 -","4","0.5","","Daniel L. Reger; Christine A. Little; Arnold L. Rheingold; Matthew Lam; Tom Concolino; Amitabh Mohan; Gary J. Long","Structural, Electronic, and Magnetic Properties of {Fe[HC(3,5-Me2pz)3]2}(BF4)2 (pz = Pyrazolyl): Observation of Unusual Spin-Crossover Behavior","Inorganic Chemistry","2000","39","","4674","4675","10.1021/ic000721z","","","0.71073","MoKα","","0.0897","0.0644","","","0.1793","0.1982","","","","","","1.608","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321485","10.869","0.005","14.314","0.002","14.428","0.002","118.44","0.01","92.97","0.02","93.93","0.02","1960","1","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C34 H39.5 Ag F3 N7 O3.25 S -","- C34 H39 Ag F3 N7 O3.25 S -","- C68 H78 Ag2 F6 N14 O6.5 S2 -","2","1","","Cheng-Yong Su; Bei-Sheng Kang; Chen-Xia Du; Qing-Chuan Yang; Thomas C. W. Mak","Formation of Mono-, Bi-, Tri-, and Tetranuclear Ag(I) Complexes of C3-Symmetric Tripodal Benzimidazole Ligands","Inorganic Chemistry","2000","39","","4843","4849","10.1021/ic991140g","","","0.71073","MoKα","","0.1387","0.0734","","0.2224","0.1741","","","","1.03","1.123","1.123","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4321486","11.629","0.002","12.226","0.002","13.236","0.003","70.69","0.03","67.27","0.03","71.76","0.03","1600.5","0.7","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C56 H56 Ag2 F6 N14 O7 S2 -","- C56 H54 Ag2 F6 N14 O7 S2 -","- C56 H54 Ag2 F6 N14 O7 S2 -","1","0.5","","Cheng-Yong Su; Bei-Sheng Kang; Chen-Xia Du; Qing-Chuan Yang; Thomas C. W. Mak","Formation of Mono-, Bi-, Tri-, and Tetranuclear Ag(I) Complexes of C3-Symmetric Tripodal Benzimidazole Ligands","Inorganic Chemistry","2000","39","","4843","4849","10.1021/ic991140g","","","0.71073","MoKα","","0.0829","0.0772","","0.2462","0.2338","","","","1.06","1.078","1.078","","","","","has coordinates,has disorder","179317","2020-10-21","18:00:00",""
"4321487","5.0794","0.0001","15.2154","0.0001","16.3604","0.0001","90","","95.696","0.001","90","","1258.17","0.03","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","ehtylenediammonium cobalt phosphate","","- C4 H20 Co7 N4 O24 P6 -","- C2 H10 Co3.5 N2 O12 P3 -","- C8 H40 Co14 N8 O48 P12 -","4","1","","Ray-Kuang Chiang","Synthesis and Structure of (H3NC2H4NH3)2Co7(PO4)6: A Novel Open Framework Cobalt Phosphate","Inorganic Chemistry","2000","39","","4985","4988","10.1021/ic991233y","","","0.71073","MoKα","","0.0461","0.0323","","","0.0664","0.0719","","","","","","1.094","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321488","12.3907","0.001","14.5179","0.0011","21.3739","0.0014","76.1521","0.0015","86.5411","0.0016","73.2969","0.0013","3575.5","0.5","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C69 H86 N4 Na2 P4 Si4 -","- C69 H78 N4 Na2 P4 Si4 -","- C138 H156 N8 Na4 P8 Si8 -","2","1","","Ruppa P. Kamalesh Babu; Kasani Aparna; Robert McDonald; Ronald G. Cavell","Dimeric Bridged and Chelated Alkali Metal (Li and Na) Bis(iminophosphorano)methanide Complexes with Contrasting Structures","Inorganic Chemistry","2000","39","","4981","4984","10.1021/ic991364z","","","0.71073","MoKα","","0.1178","0.0656","","","0.1654","0.1861","","","","","","0.948","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321489","13.5173","0.0012","21.335","0.002","24.581","0.002","90","","91.086","0.002","90","","7087.7","1.1","193","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C69 H86 Li2 N4 P4 Si4 -","- C69 H78 Li2 N4 P4 Si4 -","- C276 H312 Li8 N16 P16 Si16 -","4","1","","Ruppa P. Kamalesh Babu; Kasani Aparna; Robert McDonald; Ronald G. Cavell","Dimeric Bridged and Chelated Alkali Metal (Li and Na) Bis(iminophosphorano)methanide Complexes with Contrasting Structures","Inorganic Chemistry","2000","39","","4981","4984","10.1021/ic991364z","","","0.71073","MoKα","","0.1407","0.0807","","","0.2042","0.2281","","","","","","1.024","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321490","20.623","0.0002","8.333","0.0002","11.997","0.0004","90","","102.512","0.001","90","","2012.74","0.09","100","","100","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","(Br2MeSnCp)CpZrBr2 Sn-THF adduct","","","- C15 H20 Br4 O Sn Zr -","- C15 H20 Br4 O Sn Zr -","- C60 H80 Br16 O4 Sn4 Zr4 -","4","1","","Xu Cheng; Carla Slebodnick; Paul A. Deck; Damon R. Billodeaux; Frank R. Fronczek","Selective Tin-Carbon Bond Cleavage Reactions of Trimethylstannylzirconocene Dichloride with Electrophiles","Inorganic Chemistry","2000","39","","4921","4926","10.1021/ic991461s","","","0.71073","MoKα","","0.0599","0.0484","","","0.1126","0.1189","","","","","","1.094","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321491","21.6517","0.0015","12.872","0.001","14.1878","0.0009","90","","103.389","0.005","90","","3846.7","0.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","(ClMe2SnCp)CpZrCl2 toluene solvate","","","- C15.5 H19 Cl3 Sn Zr -","- C15.5 H19 Cl3 Sn Zr -","- C124 H152 Cl24 Sn8 Zr8 -","8","1","","Xu Cheng; Carla Slebodnick; Paul A. Deck; Damon R. Billodeaux; Frank R. Fronczek","Selective Tin-Carbon Bond Cleavage Reactions of Trimethylstannylzirconocene Dichloride with Electrophiles","Inorganic Chemistry","2000","39","","4921","4926","10.1021/ic991461s","","","0.71073","MoKα","","0.0769","0.0384","","","0.0779","0.0852","","","","","","0.806","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321492","13.9804","0.001","22.8924","0.0012","15.5757","0.0012","90","","91.71","0.003","90","","4982.7","0.6","180","2","180","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C48 H40 Mn2 Mo N16 O4 -","- C48 H32 Mn2 Mo N16 O4 -","- C192 H128 Mn8 Mo4 N64 O16 -","4","1","","Barbara Sieklucka; Janusz Szklarzewicz; Terence J. Kemp; William Errington","X-ray Evidence of CN Bridging in Bimetallic Complexes Based on [M(CN)8]4- (M = Mo, W). The Crystal Structure of {[Mn(bpy)2]2(μ-NC)2[Mo(CN)6]2(μ-CN)2[Mn(bpy)2]2}.8H2O","Inorganic Chemistry","2000","39","","5156","5158","10.1021/ic0000404","","","0.71073","MoKα","","0.1257","0.0644","","","0.1333","0.1635","","","","","","1.037","","","","has coordinates","198632","2020-10-21","18:00:00",""
"4321493","12.122","0.006","12.627","0.005","14.352","0.006","82.75","0.03","85.38","0.04","61.57","0.03","1915.9","1.6","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C24 H60 Cl Fe Li N2 O3 Si4 -","- C24 H60 Cl Fe Li N2 O3 Si4 -","- C48 H120 Cl2 Fe2 Li2 N4 O6 Si8 -","2","1","","Ulrich Siemeling; Udo Vorfeld; Beate Neumann; Hans-Georg Stammler","(THF)3LiCl as a Ligand for Low-Coordinate Fe(II): Crystal Structure of [(Me~3~Si)~2~N]~2~Fe(μ-Cl)Li(THF)~3~","Inorganic Chemistry","2000","39","","5159","5160","10.1021/ic000086x","","","0.71073","MoKα","","0.1692","0.0987","","","0.2481","0.3006","","","","","","1.001","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321494","10.7852","0.0006","14.7376","0.0008","18.2479","0.0009","94.057","0.002","91.513","0.002","108.029","0.002","2747.6","0.3","160","2","160","2","","","","","","","","5","P -1","-P 1","2","","","","- C62 H71 N5 O4 W -","- C62 H71 N5 O4 W -","- C124 H142 N10 O8 W2 -","2","1","","Carl Redshaw; Mark R. J. Elsegood","Group 6 Metallocalixarenes Bearing ""Hydrazido(2-)"" Groups","Inorganic Chemistry","2000","39","","5164","5168","10.1021/ic000098i","","","0.71073","MoKα","","0.0256","0.0227","","","0.0554","0.0576","","","","","","1.064","","","","has coordinates,has disorder","179317","2020-10-21","18:00:00",""
"4321495","16.7386","0.0014","18.809","0.002","20.0969","0.0017","94.791","0.006","108.422","0.005","99.972","0.008","5847.2","1","160","2","160","2","","","","","","","","6","P -1","-P 1","2","","","","- C120.5 H138 Cl5 N7 O8 W2 -","- C120.5 H138 Cl5 N7 O8 W2 -","- C241 H276 Cl10 N14 O16 W4 -","2","1","","Carl Redshaw; Mark R. J. Elsegood","Group 6 Metallocalixarenes Bearing ""Hydrazido(2-)"" Groups","Inorganic Chemistry","2000","39","","5164","5168","10.1021/ic000098i","","","0.6875","synchrotron","","0.0718","0.0554","","","0.1444","0.1511","","","","","","0.986","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4321496","16.0888","0.0011","17.7004","0.0012","19.4921","0.0014","90","","91.078","0.002","90","","5549.9","0.7","160","2","160","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C124 H148 Mo2 N4 O12 -","- C124 H148 Mo2 N4 O12 -","- C248 H296 Mo4 N8 O24 -","2","0.5","","Carl Redshaw; Mark R. J. Elsegood","Group 6 Metallocalixarenes Bearing ""Hydrazido(2-)"" Groups","Inorganic Chemistry","2000","39","","5164","5168","10.1021/ic000098i","","","0.71073","MoKα","","0.0845","0.0595","","","0.1362","0.152","","","","","","1.06","","","","has coordinates,has disorder","179317","2020-10-21","18:00:00",""
"4321497","20.3075","0.0012","17.8252","0.0011","26.0735","0.0016","90","","112.312","0.002","90","","8731.6","0.9","160","2","160","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C98 H110 Mo2 N8 O7 -","- C98 H110 Mo2 N8 O7 -","- C392 H440 Mo8 N32 O28 -","4","1","","Carl Redshaw; Mark R. J. Elsegood","Group 6 Metallocalixarenes Bearing ""Hydrazido(2-)"" Groups","Inorganic Chemistry","2000","39","","5164","5168","10.1021/ic000098i","","","0.71073","MoKα","","0.1087","0.0627","","","0.1097","0.1243","","","","","","1.091","","","","has coordinates,has disorder","179317","2020-10-21","18:00:00",""
"4321498","9.1044","0.0002","14.7918","0.0002","17.7688","0.0002","84.5085","0.0002","76.488","0.0002","81.7951","0.0002","2298.04","0.06","213","2","213","2","","","","","","","","10","P -1","-P 1","2","","","","- C32.5 H48 B Br Co F6 Fe N14 O7.5 P -","- C32.5 H46 B Br Co F6 Fe N14 O7.5 P -","- C65 H92 B2 Br2 Co2 F12 Fe2 N28 O15 P2 -","2","1","","Chaiwat Engtrakul; William J. Shoemaker; Joseph J. Grzybowski; Ilia Guzei; Arnold Rheingold","Synthesis of a Clathrochelate Complex with an Appended Pyridine and Its Coordination to a Cobaloxime Complex","Inorganic Chemistry","2000","39","","5161","5163","10.1021/ic0002465","","","0.71073","MoKα","","0.1131","0.0719","","0.2025","0.1782","","","","0.928","1.089","1.089","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321499","13.23","0.003","14.95","0.003","15.799","0.004","95.87","0.02","112","0.02","112.09","0.01","2574.9","1.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","(1,3-dimethyl tetra-p-tert-butylcalix[4]arene-O1,O2,O4)dichlorooxomolybdenum(VI)","","- C49 H63 Cl5 Mo O5 -","- C49 H46 Cl5 Mo O5 -","- C98 H92 Cl10 Mo2 O10 -","2","1","","Andrew J. Millar; Jonathan M. White; Christian J. Doonan; Charles G. Young","Synthesis and Characterization of Monomeric Oxo Dichloro 1,3-Dialkyl p-tert-Butylcalix[4]arene Complexes of Molybdenum(VI,V) and Tungsten(VI,V)","Inorganic Chemistry","2000","39","","5151","5155","10.1021/ic000431i","","","0.71069","MoKα","","0.0651","0.0478","","","0.1214","0.1327","","","","","","1.012","","","","has coordinates","179317","2020-10-21","18:00:00",""
"4321500","10.242","0.002","15.71","0.002","16.236","0.005","88.64","0.03","79.91","0.03","78.67","0.02","2521.7","1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","(1,3-dimethyl tetra-p-tert-butylcalix[4]arene-O1,O2,O4)dichlorooxotungsten(VI)","","- C47 H59 Cl5 O5 W -","- C47 H32 Cl5 O5 W -","- C94 H64 Cl10 O10 W2 -","2","1","","Andrew J. Millar; Jonathan M. White; Christian J. Doonan; Charles G. Young","Synthesis and Characterization of Monomeric Oxo Dichloro 1,3-Dialkyl p-tert-Butylcalix[4]arene Complexes of Molybdenum(VI,V) and Tungsten(VI,V)","Inorganic Chemistry","2000","39","","5151","5155","10.1021/ic000431i","","","0.71069","MoKα","","0.0352","0.0304","","","0.0868","0.09","","","","","","1.067","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321501","26.89","0.003","9.2373","0.0009","19.761","0.002","90","","124.812","0.005","90","","4030","0.8","168","2","168","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","[Li(OPh)(THF)]4","","","- C20 H26 Li2 O4 -","- C20 H26 Li2 O4 -","- C160 H208 Li16 O32 -","8","1","","Timothy J. Boyle; Dawn M. Pedrotty; Todd M. Alam; Sara C. Vick; Mark A. Rodriguez","Structural Diversity in Solvated Lithium Aryloxides. Syntheses, Characterization, and Structures of [Li(OAr)(THF)x]n and [Li(OAr)(py)x]2 Complexes Where OAr = OC6H5, OC6H4(2-Me), OC6H3(2,6-(Me))2, OC6H4(2-Pri), OC6H3(2,6-(Pri))2, OC6H4(2-But), OC6H3(2,6-(But))2","Inorganic Chemistry","2000","39","","5133","5146","10.1021/ic000432a","","","0.71073","MoKα","","0.157","0.0541","","","0.1252","0.1582","","","","","","0.829","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321502","16.187","0.007","14.941","0.007","18.92","0.01","90","","108.425","0.012","90","","4341","4","168","2","168","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","[Li(OMP)(THF)]4","","","- C44 H60 Li4 O8 -","- C44 H60 Li4 O8 -","- C176 H240 Li16 O32 -","4","1","","Timothy J. Boyle; Dawn M. Pedrotty; Todd M. Alam; Sara C. Vick; Mark A. Rodriguez","Structural Diversity in Solvated Lithium Aryloxides. Syntheses, Characterization, and Structures of [Li(OAr)(THF)x]n and [Li(OAr)(py)x]2 Complexes Where OAr = OC6H5, OC6H4(2-Me), OC6H3(2,6-(Me))2, OC6H4(2-Pri), OC6H3(2,6-(Pri))2, OC6H4(2-But), OC6H3(2,6-(But))2","Inorganic Chemistry","2000","39","","5133","5146","10.1021/ic000432a","","","0.71073","MoKα","","0.19","0.0864","","","0.276","0.3087","","","","","","1.08","","","","has coordinates,has disorder","179318","2020-10-21","18:00:00",""
"4321503","12.5624","0.0014","20.819","0.003","17.135","0.002","90","","91.769","0.002","90","","4479.3","1","168","2","168","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","[Li(DMP)(THF)]4","","","- C48 H68 Li4 O8 -","- C48 H68 Li4 O8 -","- C192 H272 Li16 O32 -","4","1","","Timothy J. Boyle; Dawn M. Pedrotty; Todd M. Alam; Sara C. Vick; Mark A. Rodriguez","Structural Diversity in Solvated Lithium Aryloxides. Syntheses, Characterization, and Structures of [Li(OAr)(THF)x]n and [Li(OAr)(py)x]2 Complexes Where OAr = OC6H5, OC6H4(2-Me), OC6H3(2,6-(Me))2, OC6H4(2-Pri), OC6H3(2,6-(Pri))2, OC6H4(2-But), OC6H3(2,6-(But))2","Inorganic Chemistry","2000","39","","5133","5146","10.1021/ic000432a","","","0.71073","MoKα","","0.1112","0.0901","","","0.248","0.2768","","","","","","1.043","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321504","12.9466","0.0018","15.119","0.002","27.015","0.004","90","","101.012","0.003","90","","5190.5","1.3","168","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","[Li(OIP)(THF)]4","","","- C52 H76 Li4 O8 -","- C52 H76 Li4 O8 -","- C208 H304 Li16 O32 -","4","1","","Timothy J. Boyle; Dawn M. Pedrotty; Todd M. Alam; Sara C. Vick; Mark A. Rodriguez","Structural Diversity in Solvated Lithium Aryloxides. Syntheses, Characterization, and Structures of [Li(OAr)(THF)x]n and [Li(OAr)(py)x]2 Complexes Where OAr = OC6H5, OC6H4(2-Me), OC6H3(2,6-(Me))2, OC6H4(2-Pri), OC6H3(2,6-(Pri))2, OC6H4(2-But), OC6H3(2,6-(But))2","Inorganic Chemistry","2000","39","","5133","5146","10.1021/ic000432a","","","0.71073","MoKα","","0.1796","0.0862","","","0.2337","0.2935","","","","","","0.93","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4321505","13.316","0.002","16.148","0.003","22.427","0.003","90","","90","0.004","90","","4822.4","1.3","168","2","168","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","[Li(DIP)(THF)]3","","","- C48 H75 Li3 O6 -","- C48 H75 Li3 O6 -","- C192 H300 Li12 O24 -","4","1","","Timothy J. Boyle; Dawn M. Pedrotty; Todd M. Alam; Sara C. Vick; Mark A. Rodriguez","Structural Diversity in Solvated Lithium Aryloxides. Syntheses, Characterization, and Structures of [Li(OAr)(THF)x]n and [Li(OAr)(py)x]2 Complexes Where OAr = OC6H5, OC6H4(2-Me), OC6H3(2,6-(Me))2, OC6H4(2-Pri), OC6H3(2,6-(Pri))2, OC6H4(2-But), OC6H3(2,6-(But))2","Inorganic Chemistry","2000","39","","5133","5146","10.1021/ic000432a","","","0.71073","MoKα","","0.262","0.0626","","","0.1566","0.2179","","","","","","0.811","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321506","9.151","0.0007","14.4287","0.0012","14.1346","0.0012","90","","105.326","0.001","90","","1799.9","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","[Li(OBP)(THF)2]2","","","- C18 H29 Li O3 -","- C18 H29 Li O3 -","- C72 H116 Li4 O12 -","4","1","","Timothy J. Boyle; Dawn M. Pedrotty; Todd M. Alam; Sara C. Vick; Mark A. Rodriguez","Structural Diversity in Solvated Lithium Aryloxides. Syntheses, Characterization, and Structures of [Li(OAr)(THF)x]n and [Li(OAr)(py)x]2 Complexes Where OAr = OC6H5, OC6H4(2-Me), OC6H3(2,6-(Me))2, OC6H4(2-Pri), OC6H3(2,6-(Pri))2, OC6H4(2-But), OC6H3(2,6-(But))2","Inorganic Chemistry","2000","39","","5133","5146","10.1021/ic000432a","","","0.71073","MoKα","","0.0916","0.0527","","","0.1471","0.1724","","","","","","1.015","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321507","12.483","0.003","14.693","0.004","20.207","0.005","90","","107.993","0.004","90","","3525","1.6","168","2","168","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","[Li(DBP)(THF)]2","","","- C36 H58 Li2 N0 O4 -","- C36 H58 Li2 O4 -","- C144 H232 Li8 O16 -","4","1","","Timothy J. Boyle; Dawn M. Pedrotty; Todd M. Alam; Sara C. Vick; Mark A. Rodriguez","Structural Diversity in Solvated Lithium Aryloxides. Syntheses, Characterization, and Structures of [Li(OAr)(THF)x]n and [Li(OAr)(py)x]2 Complexes Where OAr = OC6H5, OC6H4(2-Me), OC6H3(2,6-(Me))2, OC6H4(2-Pri), OC6H3(2,6-(Pri))2, OC6H4(2-But), OC6H3(2,6-(But))2","Inorganic Chemistry","2000","39","","5133","5146","10.1021/ic000432a","","","0.71073","MoKα","","0.1714","0.0576","","","0.1289","0.1673","","","","","","0.833","","","","has coordinates,has disorder","179318","2020-10-21","18:00:00",""
"4321508","12.44","0.002","11.425","0.001","13.869","0.002","90","","93.14","0.01","90","","1968.2","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H22 Cu2 N16 -","- C10 H22 Cu2 N16 -","- C40 H88 Cu8 N64 -","4","1","","Partha Sarathi Mukherjee; Tapas Kumar Maji; Golam Mostafa; Talal Mallah; Nirmalendu Ray Chaudhuri","The First Structurally Alternating Copper(II) Chain with Alternate Single End-on and End-to-End Azido Bridging: A Synthesis, Crystal Structure, and Low-Temperature Magnetic Study","Inorganic Chemistry","2000","39","","5147","5150","10.1021/ic000507a","","","1.5418","CuKα","","0.0481","0.0478","","0.1278","0.1275","","","","1.111","1.117","1.117","","","","","has coordinates,has disorder","179318","2020-10-21","18:00:00",""
"4321509","11.201","0.003","14.499","0.004","14.308","0.004","90","","106.05","0.02","90","","2233.1","1.1","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","[Mn(3-pic)2(N3)2]n","","","- C12 H14 Mn N8 -","- C12 H14 Mn N8 -","- C72 H84 Mn6 N48 -","6","1.5","","Morsy A. M. Abu-Youssef; Marc Drillon; Albert Escuer; Mohamed A. S. Goher; Franz A. Mautner; Ramon Vicente","Topological Ferrimagnetic Behavior of Two New [Mn(L)2(N3)2]n Chains with the New AF/AF/F Alternating Sequence (L = 3-Methylpyridine or 3,4-Dimethylpyridine)","Inorganic Chemistry","2000","39","","5022","5027","10.1021/ic000516j","","","0.71069","MoKα","","0.0498","0.0363","","0.0943","0.0839","","","","1.033","1.054","1.054","","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321510","11.502","0.004","14.246","0.005","16.2","0.008","84.17","0.03","84.87","0.03","71.33","0.03","2497.2","1.8","298","2","298","2","","","","","","","","4","P -1","-P 1","2","[Mn(3,4-dimethylpyridine)2(N3)2]","","","- C14 H18 Mn N8 -","- C14 H18 Mn N8 -","- C84 H108 Mn6 N48 -","6","3","","Morsy A. M. Abu-Youssef; Marc Drillon; Albert Escuer; Mohamed A. S. Goher; Franz A. Mautner; Ramon Vicente","Topological Ferrimagnetic Behavior of Two New [Mn(L)2(N3)2]n Chains with the New AF/AF/F Alternating Sequence (L = 3-Methylpyridine or 3,4-Dimethylpyridine)","Inorganic Chemistry","2000","39","","5022","5027","10.1021/ic000516j","","","0.71069","MoKα","","0.102","0.0574","","0.1402","0.1077","","","","1.09","1.101","1.101","","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321511","3.986","0.003","6.579","0.005","11.399","0.001","90","","96.621","0.003","90","","296.9","0.3","293","2","293.2","","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C4 H4 Br Cu N2 -","- C4 H4 Br2 Cu2 N2 -","- C8 H8 Br4 Cu4 N4 -","2","0.5","","Peter M. Graham; Robert D. Pike; Michal Sabat; Rosa D. Bailey; William T. Pennington","Coordination Polymers of Copper(I) Halides","Inorganic Chemistry","2000","39","","5121","5132","10.1021/ic0005341","","","0.7107","MoKα","","0.0558","0.0488","","0.1226","","0.1283","","","1.113","","","1.113","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321512","8.4327","0.0005","10.499","0.0009","13.907","0.001","74.083","0.003","77.501","0.002","62.8164","0.0008","1047.27","0.13","293.2","","293.2","","","","","","","","","7","P -1","-P 1","2","","","","- C40 H34 Br2 Cu2 N2 O6 P2 -","- C40 H34 Br2 Cu2 N2 O6 P2 -","- C40 H34 Br2 Cu2 N2 O6 P2 -","1","0.5","","Peter M. Graham; Robert D. Pike; Michal Sabat; Rosa D. Bailey; William T. Pennington","Coordination Polymers of Copper(I) Halides","Inorganic Chemistry","2000","39","","5121","5132","10.1021/ic0005341","","","0.7107","MoKα","","0.0465","0.042","","0.0848","","0.0868","","","1.186","","","1.186","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321513","12.638","0.002","11.71","0.003","17.3401","0.0005","90","","103.501","0.0007","90","","2495.3","0.8","293","2","293.2","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C24 H27 Br Cu N4 O3 P -","- C24 H27 Br Cu N4 O3 P -","- C96 H108 Br4 Cu4 N16 O12 P4 -","4","1","","Peter M. Graham; Robert D. Pike; Michal Sabat; Rosa D. Bailey; William T. Pennington","Coordination Polymers of Copper(I) Halides","Inorganic Chemistry","2000","39","","5121","5132","10.1021/ic0005341","","","0.7107","MoKα","","0.1105","0.047","","0.085","","0.1067","","","1.051","","","1.051","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321514","4.3718","0.0006","17.718","0.002","14.7481","0.0004","90","","110.163","0.0006","90","","1072.37","0.19","293","2","293.2","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 H6 Cu2 I2 N2 -","- C8 H6 Cu2 I2 N2 -","- C32 H24 Cu8 I8 N8 -","4","1","","Peter M. Graham; Robert D. Pike; Michal Sabat; Rosa D. Bailey; William T. Pennington","Coordination Polymers of Copper(I) Halides","Inorganic Chemistry","2000","39","","5121","5132","10.1021/ic0005341","","","0.7107","MoKα","","0.0668","0.0618","","0.1305","","0.1282","","","1.318","","","1.318","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321515","9.356","0.003","13.298","0.004","9.446","0.003","105.51","0.02","96.29","0.03","70.38","0.02","1066.4","0.6","173.2","","173.2","","","","","","","","","7","P -1","-P 1","2","","","","- C46 H38 Br2 Cu2 N2 O6 P2 -","- C46 H38 Br2 Cu2 N2 O6 P2 -","- C46 H38 Br2 Cu2 N2 O6 P2 -","1","0.5","","Peter M. Graham; Robert D. Pike; Michal Sabat; Rosa D. Bailey; William T. Pennington","Coordination Polymers of Copper(I) Halides","Inorganic Chemistry","2000","39","","5121","5132","10.1021/ic0005341","","","0.7107","MoKalpha","","","0.0305","","","0.0359","","","","","1.29","1.29","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321516","8.023","0.009","34.81","0.01","9.38","0.01","90","","112.76","0.05","90","","2416","4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13 H35 Cl2 Cu N5 O13 -","- C13 H35 Cl2 Cu N5 O13 -","- C52 H140 Cl8 Cu4 N20 O52 -","4","1","","Paul V. Bernhardt; Philip C. Sharpe","Self-Assembly of a Noncovalently Bonded Dicopper(II) Complex in the Solid State and in Solution","Inorganic Chemistry","2000","39","","4994","4995","10.1021/ic000587i","","","0.71073","MoKα","","0.0915","0.0815","","","0.2373","0.2696","","","","","","1.3","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321517","9.3205","0.0009","14.447","0.002","17.185","0.002","78.301","0.009","74.512","0.008","88.837","0.009","2182.3","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H60 Cl4 Cu2 N10 O21 -","- C26 H60 Cl4 Cu2 N10 O21 -","- C52 H120 Cl8 Cu4 N20 O42 -","2","1","","Paul V. Bernhardt; Philip C. Sharpe","Self-Assembly of a Noncovalently Bonded Dicopper(II) Complex in the Solid State and in Solution","Inorganic Chemistry","2000","39","","4994","4995","10.1021/ic000587i","","","0.71073","MoKα","","0.0419","0.0336","","","0.0927","0.0979","","","","","","1.035","","","","has coordinates,has disorder","179318","2020-10-21","18:00:00",""
"4321518","15.438","0.002","14.691","0.002","33.046","0.002","90","","94.832","0.009","90","","7468.2","1.5","296.2","","296.2","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C8 H11.02 Mn1.5 N8 O5.51 W -","- C8 Mn1.5 N8 O5.75 W -","- C128 Mn24 N128 O92 W16 -","16","4","","Zhuang Jin Zhong; Hidetake Seino; Yasushi Mizobe; Masanobu Hidai; Michel Verdaguer; Shin-ichi Ohkoshi; Kazuhito Hashimoto","Crystal Structure and Magnetic Properties of an Octacyanometalate-Based Three-Dimensional Tungstate(V)-Manganese(II) Bimetallic Assembly","Inorganic Chemistry","2000","39","","5095","5101","10.1021/ic0005994","","","0.7107","MoKα","","0.0458","0.0458","","","0.0551","0.0551","","","","","","1.486","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321519","16.598","0.003","23.884","0.003","33.59","0.005","90","","100.38","0.03","90","","13098","4","143","","","","","","","","","","","10","P 1 21/c 1","-P 2ybc","14","","","","- C112 H134 Cl4 Eu F6 N28 O34 P S3 Zn -","- C112 H120 Cl4 Eu F6 N28 O34 P S3 Zn -","- C448 H480 Cl16 Eu4 F24 N112 O136 P4 S12 Zn4 -","4","1","","Carine Edder; Claude Piguet; Gérald Bernardinelli; Jiri Mareda; Christian G. Bochet; Jean-Claude G. Bünzli; Gérard Hopfgartner","Unusual Electronic Effects of Electron-Withdrawing Sulfonamide Groups in Optically and Magnetically Active Self-Assembled Noncovalent Heterodimetallic d-f Podates","Inorganic Chemistry","2000","39","","5059","5073","10.1021/ic000687o","","","0.71073","MoKα","","","0.068","","","","0.064","","","","","","2.472","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321520","13.7877","0.0016","15.3611","0.0011","16.8511","0.0007","90","","106.241","0.006","90","","3426.5","0.5","130","2","130","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C36 H44 Cl Fe N5 O5 -","- C36 H44 Cl Fe N5 O5 -","- C144 H176 Cl4 Fe4 N20 O20 -","4","1","","Mary K. Ellison; Charles E. Schulz; W. Robert Scheidt","Structural and Electronic Characterization of Nitrosyl(Octaethylporphinato)iron(III) Perchlorate Derivatives","Inorganic Chemistry","2000","39","","5102","5110","10.1021/ic000789e","","","0.71073","MoKα","","0.1111","0.0651","","","0.1669","0.2032","","","","","","1.022","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321521","11.5085","0.0004","11.5085","0.0004","9.5177","0.0004","90","","90","","90","","1260.58","0.08","90","1","90","1","","","","","","","","5","I 4/m","-I 4","87","","","","- C5 K6 Mo6 N5 Se8 -","- C5 K6 Mo6 N5 Se8 -","- C10 K12 Mo12 N10 Se16 -","2","0.125","","Carmela Magliocchi; Xiaobing Xie; Timothy Hughbanks","A Cyanide-Bridged Chain of Mo6Se8 Clusters: A Product of Cyanide-Melt Cluster Synthesis","Inorganic Chemistry","2000","39","","5000","5001","10.1021/ic000833q","","","0.71073","MoKα","","0.0411","0.0236","","","0.0432","0.0458","","","","","","0.931","","","","has coordinates,has disorder","179318","2020-10-21","18:00:00",""
"4321522","10.782","0.003","22.056","0.003","17.219","0.003","90","","107.77","0.02","90","","3899.4","1.5","296.2","","296.2","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C26 H44 Cl4 Ir2 Mo2 N2 O3 S4 -","- C26 H44 Cl4 Ir2 Mo2 N2 O3 S4 -","- C104 H176 Cl16 Ir8 Mo8 N8 O12 S16 -","4","1","","Tadao Masumori; Hidetake Seino; Yasushi Mizobe; Masanobu Hidai","The Cubane-Type Mo2Ir2S4 Cluster Containing an Organohydrazido(2-) Ligand on the Mo Site","Inorganic Chemistry","2000","39","","5002","5003","10.1021/ic991441q","","","0.7107","MoKα","","0.0494","0.0494","","","0.0543","0.0543","","","","","","1.99","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321523","14.334","0.004","15.625","0.002","21.365","0.003","90","","91.51","0.02","90","","4783.4","1.6","296.2","","296.2","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C32 H49 Cl8 Ir2 Mo2 N3 O S4 -","- C32 H49 Cl8 Ir2 Mo2 N3 O S4 -","- C128 H196 Cl32 Ir8 Mo8 N12 O4 S16 -","4","1","","Tadao Masumori; Hidetake Seino; Yasushi Mizobe; Masanobu Hidai","The Cubane-Type Mo2Ir2S4 Cluster Containing an Organohydrazido(2-) Ligand on the Mo Site","Inorganic Chemistry","2000","39","","5002","5003","10.1021/ic991441q","","","0.7107","MoKα","","0.0495","0.0495","","","0.0502","0.0502","","","","","","1.406","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321524","12.462","0.0006","16.781","0.0009","17.306","0.0005","79.386","0.003","84.937","0.003","72.513","0.002","3390.7","0.3","173","","173","","","","","","","","","8","P -1","-P 1","2","","","","- C61 H74 Cl2 F12 Fe N6 O12 P2 -","- C61 H64 Cl2 F12 Fe N6 O12 P2 -","- C122 H128 Cl4 F24 Fe2 N12 O24 P4 -","2","1","","Nicolas Belfrekh; Christiane Dietrich-Buchecker; Jean-Pierre Sauvage","Unexpected Synthesis of an 8-Shaped Macrocycle Instead of an Interlocking-Ring System","Inorganic Chemistry","2000","39","","5169","5172","10.1021/ic991502k","","","0.71073","Mo-Kα","","0.163","0.062","","0.127","","0.089","","","2.269","","","1.551","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321525","17.831","0.002","23.98","0.003","9.6048","0.0009","90","","90","","90","","4106.9","0.8","203","2","203","2","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C40 H75 Cl2 N O P2 Ru -","- C40 H75 Cl2 N O P2 Ru -","- C160 H300 Cl8 N4 O4 P8 Ru4 -","4","0.5","","Samantha D. Drouin; Glenn P. A. Yap; Deryn E. Fogg","Hydrogenolysis of a Ruthenium Carbene Complex to Yield Dihydride-Dihydrogen Tautomers: Mechanistic Implications for Tandem ROMP-Hydrogenation Catalysis","Inorganic Chemistry","2000","39","","5412","5414","10.1021/ic000102q","","","0.71073","MoKα","","0.1179","0.067","","","0.1568","0.1799","","","","","","1.056","","","","has coordinates,has disorder","179318","2020-10-21","18:00:00",""
"4321526","10.6192","0.0008","18.3587","0.0014","10.6151","0.0008","90","","109.637","0.001","90","","1949.1","0.3","203","2","203","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- C30 H66 O6 U -","- C30 O6 U -","- C60 O12 U2 -","2","0.25","","Marianne P. Wilkerson; Carol J. Burns; Harry J. Dewey; Jerod M. Martin; David E. Morris; Robert T. Paine; Brian L. Scott","Basicity of Uranyl Oxo Ligands upon Coordination of Alkoxides","Inorganic Chemistry","2000","39","","5277","5285","10.1021/ic000142u","","","0.71073","MoKα","","0.0453","0.0449","","0.1185","0.1178","","","","0.985","0.983","0.983","","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321527","6.1796","0.0004","15.669","0.001","16.169","0.001","90","","95.38","0.001","90","","1558.72","0.17","203","2","203","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C34 H38 O6 U -","- C34 H38 O6 U -","- C68 H76 O12 U2 -","2","0.5","","Marianne P. Wilkerson; Carol J. Burns; Harry J. Dewey; Jerod M. Martin; David E. Morris; Robert T. Paine; Brian L. Scott","Basicity of Uranyl Oxo Ligands upon Coordination of Alkoxides","Inorganic Chemistry","2000","39","","5277","5285","10.1021/ic000142u","","","0.71073","MoKα","","0.0644","0.0363","","0.1252","0.1063","","","","0.881","0.903","0.903","","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321528","17.857","0.0006","17.857","0.0006","11.4489","0.0006","90","","90","","90","","3650.7","0.3","203","2","203","2","","","","","","","","4","I -4","I -4","82","","","","- C56 H120 O16 U4 -","- C56 H120 O16 U4 -","- C112 H240 O32 U8 -","2","0.25","","Marianne P. Wilkerson; Carol J. Burns; Harry J. Dewey; Jerod M. Martin; David E. Morris; Robert T. Paine; Brian L. Scott","Basicity of Uranyl Oxo Ligands upon Coordination of Alkoxides","Inorganic Chemistry","2000","39","","5277","5285","10.1021/ic000142u","","","0.71073","MoKα","","0.023","0.0198","","0.0435","0.0421","","","","0.94","0.935","0.935","","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321529","8.91","0.003","23.466","0.008","19.114","0.008","90","","89.99","0.01","90","","3996","3","298","","298","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C39 H55 N2 O5 P Re S -","- C39 H49 N2 O5 P Re S -","- C156 H196 N8 O20 P4 Re4 S4 -","4","1","","Berthold Nock; Theodosia Maina; Francesco Tisato; Catherine P. Raptopoulou; Aris Terzis; Efstratios Chiotellis","Oxorhenium Phosphinophenolato Complexes with Model Peptide Fragments: Synthesis, Characterization, and Stability Considerations","Inorganic Chemistry","2000","39","","5197","5202","10.1021/ic000154f","","","0.71073","MoKα","","0.0579","0.041","","0.1002","0.0918","","","","1.186","1.223","1.223","","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321530","10.135","0.006","13.266","0.007","15.679","0.008","90","","99.33","0.02","90","","2080","2","298","","298","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H20 N2 O5 P Re -","- C22 H20 N2 O5 P Re -","- C88 H80 N8 O20 P4 Re4 -","4","1","","Berthold Nock; Theodosia Maina; Francesco Tisato; Catherine P. Raptopoulou; Aris Terzis; Efstratios Chiotellis","Oxorhenium Phosphinophenolato Complexes with Model Peptide Fragments: Synthesis, Characterization, and Stability Considerations","Inorganic Chemistry","2000","39","","5197","5202","10.1021/ic000154f","","","0.71073","MoKα","","0.0352","0.0296","","0.0802","0.0763","","","","1.098","1.114","1.114","","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321531","12.208","0.011","37.67","0.022","13.308","0.012","90","","113.03","0.06","90","","5632","8","189","2","189","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C44 H36 F12 N12 O12 S4 Zn2 -","- C44 H36 F12 N12 O12 S4 Zn2 -","- C176 H144 F48 N48 O48 S16 Zn8 -","4","1","","Miguel Parra-Hake; Martin L. Larter; Peter Gantzel; Gerardo Aguirre; Fernando Ortega; Ratnasamy Somanathan; Patrick J. Walsh","Synthesis and Structure of Dimeric [(cis-Py3Im)M]2 Complexes [M = Ni, Cu, Zn; (cis-Py3Im) = cis-2,4,5-Tri(2-pyridyl)imidazoline]","Inorganic Chemistry","2000","39","","5400","5403","10.1021/ic000182y","","","0.71073","MoKα","","0.0763","0.0541","","0.1387","0.1132","","","","1.109","1.116","1.116","","","","","has coordinates,has disorder","179318","2020-10-21","18:00:00",""
"4321532","15.444","0.007","15.72","0.011","23.188","0.011","82.23","0.05","82.72","0.04","66.96","0.05","5116","5","187","2","187","","","","","","","","","6","P -1","-P 1","2","","","","- C38 H36 N10 Ni2 O20.75 S2 -","- C38 H36 N10 Ni2 O20.75 S2 -","- C152 H144 N40 Ni8 O83 S8 -","4","2","","Miguel Parra-Hake; Martin L. Larter; Peter Gantzel; Gerardo Aguirre; Fernando Ortega; Ratnasamy Somanathan; Patrick J. Walsh","Synthesis and Structure of Dimeric [(cis-Py3Im)M]2 Complexes [M = Ni, Cu, Zn; (cis-Py3Im) = cis-2,4,5-Tri(2-pyridyl)imidazoline]","Inorganic Chemistry","2000","39","","5400","5403","10.1021/ic000182y","","","0.71073","MoKα","","0.106","0.0772","","0.2194","0.1887","","","","1.03","1.063","1.063","","","","","has coordinates,has disorder","179318","2020-10-21","18:00:00",""
"4321533","12.392","0.002","25.242","0.002","15.0499","0.0012","90","","95.93","0.009","90","","4682.4","0.9","291","2","291","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C36 H33 Cu2 N10 O21 S3 -","- C36 H33 Cu2 N10 O21 S3 -","- C144 H132 Cu8 N40 O84 S12 -","4","1","","Miguel Parra-Hake; Martin L. Larter; Peter Gantzel; Gerardo Aguirre; Fernando Ortega; Ratnasamy Somanathan; Patrick J. Walsh","Synthesis and Structure of Dimeric [(cis-Py3Im)M]2 Complexes [M = Ni, Cu, Zn; (cis-Py3Im) = cis-2,4,5-Tri(2-pyridyl)imidazoline]","Inorganic Chemistry","2000","39","","5400","5403","10.1021/ic000182y","","","0.71073","MoKα","","0.0807","0.0593","","0.2513","0.1553","","","","1.045","1.043","1.043","","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321534","10.536","0.002","13.038","0.006","26.405","0.004","90","","93.616","0.014","90","","3620","1.9","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H14 Fe N6 O S14 -","- C26 H14 Fe N6 O S14 -","- C104 H56 Fe4 N24 O4 S56 -","4","1","","M. Clemente-León; E. Coronado; J. R. Galán-Mascarós; C. J. Gómez-García; E. Canadell","Hybrid Molecular Materials Based upon the Photochromic Nitroprusside Complex, [Fe(CN)5NO]2-, and Organic π-Electron Donors. Synthesis, Structure, and Properties of the Radical Salt (TTF)7[Fe(CN)5NO]2 (TTF = Tetrathiafulvalene)","Inorganic Chemistry","2000","39","","5394","5397","10.1021/ic0002566","","","0.71069","MoKa","","0.1585","0.0407","","0.1345","0.0913","","","","0.978","1.11","1.11","","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321535","10.4401","0.0005","26.6189","0.0013","25.1173","0.0012","90","","98.458","0.001","90","","6904.3","0.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C66 H55 N2 P5 Ru Se4 -","- C66 H55 N2 P5 Ru Se4 -","- C264 H220 N8 P20 Ru4 Se16 -","4","1","","Qian-Feng Zhang; Hegen Zheng; Wai-Yeung Wong; Wing-Tak Wong; Wa-Hung Leung","Ruthenium(II) Ammine and Hydrazine Complexes with [N(Ph2PQ)2]- (Q = S, Se) Ligands","Inorganic Chemistry","2000","39","","5255","5264","10.1021/ic000291c","","","0.71073","MoKα","","0.0599","0.0353","","","0.1251","0.1368","","","","","","0.903","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321536","13.0385","0.0006","14.1278","0.0006","19.5468","0.0008","90.41","0.001","102.126","0.001","109.579","0.001","3305","0.2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C67 H57 Cl2 N3 P5 Ru Se4 -","- C67 H60 Cl2 N3 P5 Ru Se4 -","- C134 H120 Cl4 N6 P10 Ru2 Se8 -","2","1","","Qian-Feng Zhang; Hegen Zheng; Wai-Yeung Wong; Wing-Tak Wong; Wa-Hung Leung","Ruthenium(II) Ammine and Hydrazine Complexes with [N(Ph2PQ)2]- (Q = S, Se) Ligands","Inorganic Chemistry","2000","39","","5255","5264","10.1021/ic000291c","","","0.71073","MoKα","","0.0657","0.0409","","","0.105","0.1133","","","","","","0.935","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321537","13.3573","0.0007","14.5662","0.0008","19.9542","0.0011","75.082","0.001","89.669","0.001","62.865","0.001","3310.4","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C71 H68 Cl2 N4 P5 Ru S4 -","- C71 H57 Cl2 N4 P5 Ru S4 -","- C142 H114 Cl4 N8 P10 Ru2 S8 -","2","1","","Qian-Feng Zhang; Hegen Zheng; Wai-Yeung Wong; Wing-Tak Wong; Wa-Hung Leung","Ruthenium(II) Ammine and Hydrazine Complexes with [N(Ph2PQ)2]- (Q = S, Se) Ligands","Inorganic Chemistry","2000","39","","5255","5264","10.1021/ic000291c","","","0.71073","MoKα","","0.0723","0.0557","","","0.1815","0.1957","","","","","","0.944","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321538","13.316","0.003","20.094","0.004","25.977","0.005","90","","100.73","0.03","90","","6829","3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C71 H67 N4 P5 Ru S4 -","- C71 H67 N4 P5 Ru S4 -","- C284 H268 N16 P20 Ru4 S16 -","4","1","","Qian-Feng Zhang; Hegen Zheng; Wai-Yeung Wong; Wing-Tak Wong; Wa-Hung Leung","Ruthenium(II) Ammine and Hydrazine Complexes with [N(Ph2PQ)2]- (Q = S, Se) Ligands","Inorganic Chemistry","2000","39","","5255","5264","10.1021/ic000291c","","","0.71073","MoKα","","0.067","0.0504","","","0.1209","0.1358","","","","","","1.145","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321539","9.726","0.003","19.081","0.003","34.639","0.003","90","","90.279","0.008","90","","6428","2","200","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2,6-Bis-[1-ethyl-6-(4-dodecyloxy)benzyloxy-benzimidazol-2-yl]- pyridine-trisnitrato-Lutecium(III) mono-acetonitrile.","","- C63 H84 Lu N9 O13 -","- C63 H84 Lu N9 O13 -","- C252 H336 Lu4 N36 O52 -","4","1","","Homayoun Nozary; Claude Piguet; Jean-Pierre Rivera; Paul Tissot; Gérald Bernardinelli; Nathalie Vuillermet; Jacques Weber; Jean-Claude G. Bünzli","Extended Rodlike Polyaromatic Receptors with Bent Tridentate Units Complexed to Lanthanide Metal Ions","Inorganic Chemistry","2000","39","","5286","5298","10.1021/ic000338u","","","1.54183","CuKα","","","0.062","","","","0.054","","","","","","1.52","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321540","13.964","0.003","14.217","0.003","18.661","0.002","110.6","0.01","102.78","0.02","97.88","0.01","3286.8","1.2","200","","","","","","","","","","","6","P -1","-P 1","2","","Bis{2,6-Bis-[1-ethyl-6-(4-dodecyloxy)benzyloxy-benzimidazol-2-yl]- pyridine-tristrifluoroacetato-Lutecium(III)}","","- C134 H162 F18 Lu2 N10 O20 -","- C134 H162 F18 Lu2 N10 O20 -","- C134 H162 F18 Lu2 N10 O20 -","1","0.5","","Homayoun Nozary; Claude Piguet; Jean-Pierre Rivera; Paul Tissot; Gérald Bernardinelli; Nathalie Vuillermet; Jacques Weber; Jean-Claude G. Bünzli","Extended Rodlike Polyaromatic Receptors with Bent Tridentate Units Complexed to Lanthanide Metal Ions","Inorganic Chemistry","2000","39","","5286","5298","10.1021/ic000338u","","","1.54183","CuKα","","","0.055","","","","0.048","","","","","","1.68","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321541","11.833","0.003","13.363","0.002","26.015","0.002","90","","90","","90","","4113.6","1.3","296","2","296","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C11 H27 Cl3 Co N5 O8 -","- C11 H27 Cl3 Co N5 O8 -","- C88 H216 Cl24 Co8 N40 O64 -","8","1","","Paul V. Bernhardt; Brendan P. Macpherson; Manuel Martinez","Discrete Dinuclear Cyano-Bridged Complexes","Inorganic Chemistry","2000","39","","5203","5208","10.1021/ic000379q","","","0.71073","MoKα","","0.0759","0.0445","","","0.1222","0.1426","","","","","","1.025","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321542","15.58","0.01","19.797","0.004","19.83","0.006","90","","91.62","0.04","90","","6114","5","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C17 H43 Co Fe N11 Na O8 -","- C17 H27 Co Fe N11 Na O8.5 -","- C136 H216 Co8 Fe8 N88 Na8 O68 -","8","2","","Paul V. Bernhardt; Brendan P. Macpherson; Manuel Martinez","Discrete Dinuclear Cyano-Bridged Complexes","Inorganic Chemistry","2000","39","","5203","5208","10.1021/ic000379q","","","0.71073","MoKα","","0.2596","0.0937","","","0.2488","0.3455","","","","","","0.964","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321543","9.969","0.0009","13.316","0.001","10.118","0.0008","90","0.006","90.72","0.006","90","0.006","1343.03","0.19","296","2","296","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C17 H35 Co Fe N11 O4 -","- C17 H27 Co Fe N11 O4.002 -","- C34 H54 Co2 Fe2 N22 O8.004 -","2","0.5","","Paul V. Bernhardt; Brendan P. Macpherson; Manuel Martinez","Discrete Dinuclear Cyano-Bridged Complexes","Inorganic Chemistry","2000","39","","5203","5208","10.1021/ic000379q","","","0.71073","MoKα","","0.1672","0.0671","","","0.1714","0.2248","","","","","","0.993","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321544","9.545","0.001","9.778","0.001","9.865","0.002","60.37","0.01","62.6","0.01","65.82","0.01","690.47","0.19","296","2","296","2","","","","","","","","6","P 1","P 1","1","","","","- C18 H37 Co Fe N11 O4 -","- C18 H33 Co Fe N11 O4 -","- C18 H33 Co Fe N11 O4 -","1","1","","Paul V. Bernhardt; Brendan P. Macpherson; Manuel Martinez","Discrete Dinuclear Cyano-Bridged Complexes","Inorganic Chemistry","2000","39","","5203","5208","10.1021/ic000379q","","","0.71073","MoKα","","0.1512","0.0686","","","0.1677","0.208","","","","","","1.037","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321545","13.2091","0.0007","10.8984","0.0005","9.3291","0.0005","90","","98.178","0.004","90","","1329.34","0.12","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H24 Cu N2 O8 -","- C32 H24 Cu N2 O8 -","- C64 H48 Cu2 N4 O16 -","2","0.5","","Avril R. Williams; Bert D. Alleyne; Lincoln A. Hall; Andrew J. P. White; David J. Williams; Laurence K. Thompson","Synthesis and Structures of Polymeric Mn, Co, Cu, and Zn Complexes of 3-Diphenylamino-4-hydroxycyclobut-3-ene-1,2-dione (Diphenylaminosquarate) and of the Salt [Ni(H2O)6][(C6H5)2NC4O3]2.2H2O","Inorganic Chemistry","2000","39","","5265","5270","10.1021/ic000390q","","","0.71073","MoKα","","0.0586","0.0347","","0.1159","0.0943","","","","1.074","1.086","1.086","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321546","13.2113","0.0009","11.0383","0.0008","18.7484","0.0012","90","","97.753","0.005","90","","2709.1","0.3","150","0.1","150","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H26 Co N2 O9 -","- C32 H26 Co N2 O9 -","- C128 H104 Co4 N8 O36 -","4","1","","Avril R. Williams; Bert D. Alleyne; Lincoln A. Hall; Andrew J. P. White; David J. Williams; Laurence K. Thompson","Synthesis and Structures of Polymeric Mn, Co, Cu, and Zn Complexes of 3-Diphenylamino-4-hydroxycyclobut-3-ene-1,2-dione (Diphenylaminosquarate) and of the Salt [Ni(H2O)6][(C6H5)2NC4O3]2.2H2O","Inorganic Chemistry","2000","39","","5265","5270","10.1021/ic000390q","","","0.71073","MoKα","","0.085","0.0513","","","0.121","0.1363","","","","","","1.02","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321547","12.839","0.003","24.285","0.005","29.587","0.006","90","","90","","90","","9225","3","100","0.5","100","0.5","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C37 H43 Eu F9 N5 O16 S3 -","- C37 H43 Eu F9 N5 O16 S3 -","- C296 H344 Eu8 F72 N40 O128 S24 -","8","1","","P. Gawryszewska; L. Jerzykiewicz; M. Pietraszkiewicz; J. Legendziewicz; J. P. Riehl","Photophysics and Crystal Structure of a Europium(III) Cryptate Incorporating 3,3'-Biisoquinoline-2,2'-dioxide","Inorganic Chemistry","2000","39","","5365","5372","10.1021/ic0004683","","","0.71073","MoKα","","0.037","0.0279","","","0.0536","0.0556","","","","","","1.101","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321548","15.504","0.001","14.662","0.001","17.868","0.001","90","","105.252","0.004","90","","3918.7","0.4","298","","298","","","","","","","","see text","5","C 1 2/c 1","-C 2yc","15","","","","- C42 H48 P2 Pt Si2 -","- C42 H30 P2 Pt Si2 -","- C168 H120 P8 Pt4 Si8 -","4","0.5","","Ola F. Wendt; Robert J. Deeth; Lars I. Elding","Kinetic and Computational Study of Dissociative Substitution and Phosphine Exchange at Tetrahedrally Distorted cis-Pt(SiMePh2)2(PMe2Ph)2","Inorganic Chemistry","2000","39","","5271","5276","10.1021/ic000492g","","","0.71069","MoKα","","","0.0328","","","","0.0403","","","","","","1.807","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321549","6.95","0.001","31.585","0.006","6.226","0.001","90","","95.84","0.03","90","","1359.6","0.4","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","diaqua-(4,4'-biphenyldicarboxylato) Cobalt(II) hydrate","","- C14 H14 Co O7 -","- C14 H14 Co O7 -","- C56 H56 Co4 O28 -","4","0.5","","Long Pan; Nancy Ching; Xiaoying Huang; Jing Li","Reactions and Reactivity of Co-bpdc Coordination Polymers (bpdc = 4,4'-biphenyldicarboxylate)","Inorganic Chemistry","2000","39","","5333","5340","10.1021/ic0004939","","","0.71073","MoKα","","0.0679","0.0409","","","0.088","0.0955","","","","","","1.085","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321550","9.646","0.002","10.352","0.002","17.031","0.003","79.02","0.03","86.88","0.03","77.16","0.03","1627.6","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","dipyridine-diaque-(4,4'-biphenyldicarboxylato) Cobalt(II) dipyridine","","- C34 H32 Co N4 O6 -","- C34 H32 Co N4 O6 -","- C68 H64 Co2 N8 O12 -","2","1","","Long Pan; Nancy Ching; Xiaoying Huang; Jing Li","Reactions and Reactivity of Co-bpdc Coordination Polymers (bpdc = 4,4'-biphenyldicarboxylate)","Inorganic Chemistry","2000","39","","5333","5340","10.1021/ic0004939","","","0.71073","MoKα","","0.1326","0.0646","","","0.086","0.0986","","","","","","1.098","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321551","9.137","0.002","10.48","0.002","12.254","0.002","102.1","0.03","100.8","0.03","99.43","0.03","1101.5","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","dipyridine-(4,4'-biphenyldicarboxylato) Cobalt(II) monohydrate","","- C24 H20 Co N2 O5 -","- C24 H20 Co N2 O5 -","- C48 H40 Co2 N4 O10 -","2","1","","Long Pan; Nancy Ching; Xiaoying Huang; Jing Li","Reactions and Reactivity of Co-bpdc Coordination Polymers (bpdc = 4,4'-biphenyldicarboxylate)","Inorganic Chemistry","2000","39","","5333","5340","10.1021/ic0004939","","","0.71073","MoKα","","0.0909","0.0595","","","0.1116","0.1202","","","","","","1.188","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321552","13.468","0.003","16.652","0.003","14.977","0.003","90","","90","","90","","3358.9","1.2","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","dipyridine-diaqua-(4,4'-biphenyldicarboxylato) Cobalt(II) dipyridine monohydrate","","- C34 H34 Co N4 O7 -","- C34 H34 Co N4 O7 -","- C136 H136 Co4 N16 O28 -","4","0.5","","Long Pan; Nancy Ching; Xiaoying Huang; Jing Li","Reactions and Reactivity of Co-bpdc Coordination Polymers (bpdc = 4,4'-biphenyldicarboxylate)","Inorganic Chemistry","2000","39","","5333","5340","10.1021/ic0004939","","","0.71073","MoKα","","0.1409","0.047","","","0.0843","0.0977","","","","","","1.16","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321553","11.945","0.002","12.599","0.002","24.455","0.004","90","","102.2","0.02","90","","3597.2","1.1","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C38 H48 B Fe N8 O2 -","- C38 H48 B Fe N8 O2 -","- C152 H192 B4 Fe4 N32 O8 -","4","1","","Craig A. Grapperhaus; Bernd Mienert; Eckhard Bill; Thomas Weyhermüller; Karl Wieghardt","Mononuclear (Nitrido)iron(V) and (Oxo)iron(IV) Complexes via Photolysis of [(cyclam-acetato)FeIII(N3)]+ and Ozonolysis of [(cyclam-acetato)FeIII(O3SCF3)]+ in Water/Acetone Mixtures","Inorganic Chemistry","2000","39","","5306","5317","10.1021/ic0005238","","","0.71073","MoKα","","0.0856","0.0465","","0.1102","0.0976","","","","1.052","1.152","1.152","","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321554","16.9286","0.0003","15.9582","0.0001","21.2111","0.0003","90","","111.557","0.001","90","","5329.37","0.13","188","2","188","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","[Cu2(TBAN)(MeCN)2](OTf)2","","","- C46 H46 Cl4 Cu2 F6 N6 O6 S2 -","- C46 H42 Cl4 Cu2 F6 N6 O6 S2 -","- C184 H168 Cl16 Cu8 F24 N24 O24 S8 -","4","0.5","","Chuan He; Stephen J. Lippard","Synthesis and Characterization of Several Dicopper(I) Complexes and a Spin-Delocalized Dicopper(I,II) Mixed-Valence Complex Using a 1,8-Naphthyridine-Based Dinucleating Ligand","Inorganic Chemistry","2000","39","","5225","5231","10.1021/ic0005339","","","0.71073","MoKα","","0.0752","0.0447","","","0.1261","0.1438","","","","","","0.957","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321555","15.49","0.005","15.846","0.005","21.07","0.005","90","0.005","101.369","0.005","90","0.005","5070","3","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","[Cu2(TBAN)(py)2](OTf)2","","","- C50 H46 Cu2 F6 N6 O6 S2 -","- C50 H46 Cu2 F6 N6 O6 S2 -","- C200 H184 Cu8 F24 N24 O24 S8 -","4","0.5","","Chuan He; Stephen J. Lippard","Synthesis and Characterization of Several Dicopper(I) Complexes and a Spin-Delocalized Dicopper(I,II) Mixed-Valence Complex Using a 1,8-Naphthyridine-Based Dinucleating Ligand","Inorganic Chemistry","2000","39","","5225","5231","10.1021/ic0005339","","","0.71069","MoKα","","0.0517","0.0326","","","0.0971","0.1112","","","","","","0.798","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321556","12.8261","0.0005","15.0676","0.0006","16.2679","0.0006","85.814","0.001","83.829","0.001","69.974","0.001","2934.5","0.2","188","2","188","2","","","","","","","","8","P -1","-P 1","2","[Cu2(TBAN)(1-Me-BzIm)2](OTf)2","","","- C57 H54 Cl2 Cu2 F6 N8 O6 S2 -","- C57 H52 Cl2 Cu2 F6 N8 O6 S2 -","- C114 H104 Cl4 Cu4 F12 N16 O12 S4 -","2","1","","Chuan He; Stephen J. Lippard","Synthesis and Characterization of Several Dicopper(I) Complexes and a Spin-Delocalized Dicopper(I,II) Mixed-Valence Complex Using a 1,8-Naphthyridine-Based Dinucleating Ligand","Inorganic Chemistry","2000","39","","5225","5231","10.1021/ic0005339","","","0.71073","MoKα","","0.0682","0.0533","","","0.1615","0.1692","","","","","","1.289","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321557","11.8651","0.0002","12.5037","0.0002","20.9961","0.0004","72.875","0.001","88.507","0.001","68.779","0.001","2763.61","0.09","188","2","188","2","","","","","","","","7","P -1","-P 1","2","[Cu2(TBAN)(1-Me-Im)2](OTf)2","","","- C52 H58 Cu2 F6 N8 O7 S2 -","- C52 H48 Cu2 F6 N8 O7 S2 -","- C104 H96 Cu4 F12 N16 O14 S4 -","2","1","","Chuan He; Stephen J. Lippard","Synthesis and Characterization of Several Dicopper(I) Complexes and a Spin-Delocalized Dicopper(I,II) Mixed-Valence Complex Using a 1,8-Naphthyridine-Based Dinucleating Ligand","Inorganic Chemistry","2000","39","","5225","5231","10.1021/ic0005339","","","0.71073","MoKα","","0.0638","0.0443","","","0.1259","0.1358","","","","","","0.837","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321558","41.2217","0.001","13.9946","0.0004","20.7004","0.0006","90","","102.335","0.001","90","","11666","0.6","188","2","188","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","[Cu2(TBAN)(Ph3CCOO)](OTf)","","","- C68 H60 Cu2 F3 N4 O5 S -","- C68 H51 Cu2 F3 N4 O5 S -","- C544 H408 Cu16 F24 N32 O40 S8 -","8","1","","Chuan He; Stephen J. Lippard","Synthesis and Characterization of Several Dicopper(I) Complexes and a Spin-Delocalized Dicopper(I,II) Mixed-Valence Complex Using a 1,8-Naphthyridine-Based Dinucleating Ligand","Inorganic Chemistry","2000","39","","5225","5231","10.1021/ic0005339","","","0.71073","MoKα","","0.1031","0.0571","","","0.1558","0.1779","","","","","","1.078","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321559","22.5642","0.0002","22.3852","0.0004","23.5102","0.0004","90","","95.53","0.001","90","","11819.8","0.3","188","2","188","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","[Cu2(TBAN)(Ph3CCOO)(OTf)](OTf)","","","- C60.5 H52 Cl Cu2 F6 N4 O8 S2 -","- C60.5 H51 Cl Cu2 F6 N4 O8 S2 -","- C484 H408 Cl8 Cu16 F48 N32 O64 S16 -","8","2","","Chuan He; Stephen J. Lippard","Synthesis and Characterization of Several Dicopper(I) Complexes and a Spin-Delocalized Dicopper(I,II) Mixed-Valence Complex Using a 1,8-Naphthyridine-Based Dinucleating Ligand","Inorganic Chemistry","2000","39","","5225","5231","10.1021/ic0005339","","","0.71073","MoKα","","0.1512","0.0743","","","0.1751","0.1982","","","","","","1.077","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321560","7.884","0.002","13.966","0.004","14.18","0.005","77.765","0.008","86.868","0.009","73.96","0.02","1466.5","0.8","173","2","173","2","","","","","","","synthesized","5","P -1","-P 1","2","","Tris(trans-dichloro-bis(4-tert-butylpyridine))-tri-chromium (II)","","- C54 H78 Cl6 Cr3 N6 -","- C54 H78 Cl6 Cr3 N6 -","- C54 H78 Cl6 Cr3 N6 -","1","0.5","","F. Albert Cotton; Evgeny V. Dikarev; Jiande Gu; Santiago Herrero; Barbara Modec","Alkylpyridine Complexes of Tungsten(II) and Chromium(II). First Rotational Isomers of W2X4L4 Molecules with D2 hand D2 Symmetries","Inorganic Chemistry","2000","39","","5407","5411","10.1021/ic000555v","","","0.71073","MoKα","","0.0775","0.056","","0.1393","0.1212","","","","1.057","1.049","1.049","","","","","has coordinates,has disorder","179318","2020-10-21","18:00:00",""
"4321561","8.455","0.002","10.004","0.001","13.412","0.002","68.53","0.02","72.74","0.01","85.9","0.01","1007.3","0.3","213","2","213","2","","","","","","","synthesized","5","P -1","-P 1","2","","Bis(trans-dichloro-bis(4-tert-butylpyridine))-di-tungsten (II), D2h isomer","","- C36 H52 Cl4 N4 W2 -","- C36 H52 Cl4 N4 W2 -","- C36 H52 Cl4 N4 W2 -","1","0.5","","F. Albert Cotton; Evgeny V. Dikarev; Jiande Gu; Santiago Herrero; Barbara Modec","Alkylpyridine Complexes of Tungsten(II) and Chromium(II). First Rotational Isomers of W2X4L4 Molecules with D2 hand D2 Symmetries","Inorganic Chemistry","2000","39","","5407","5411","10.1021/ic000555v","","","0.71073","MoKα","","0.0376","0.0367","","0.0949","0.0932","","","","1.059","1.056","1.056","","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321562","8.556","0.001","11.809","0.002","12.696","0.003","107.88","0.03","105.68","0.01","99.16","0.02","1133.6","0.5","213","2","213","2","","","","","","","synthesized","5","P -1","-P 1","2","","Bis(trans-dichloro-bis(4-tert-butylpyridine))-di-tungsten (II), D2h isomer, toluene solvate","","- C43 H60 Cl4 N4 W2 -","- C43 H52 Cl4 N4 W2 -","- C43 H52 Cl4 N4 W2 -","1","0.5","","F. Albert Cotton; Evgeny V. Dikarev; Jiande Gu; Santiago Herrero; Barbara Modec","Alkylpyridine Complexes of Tungsten(II) and Chromium(II). First Rotational Isomers of W2X4L4 Molecules with D2 hand D2 Symmetries","Inorganic Chemistry","2000","39","","5407","5411","10.1021/ic000555v","","","0.71073","MoKα","","0.0424","0.0372","","0.0891","0.0845","","","","1.057","1.045","1.045","","","","","has coordinates,has disorder","179318","2020-10-21","18:00:00",""
"4321563","15.264","0.003","15.155","0.003","22.186","0.004","90","","105.01","0.02","90","","4957.1","1.7","213","2","213","2","","","","","","","synthesized","5","P 1 21/n 1","-P 2yn","14","","Bis(trans-dichloro-bis(4-tert-butylpyridine))-di-tungsten (II), D2 isomer, 4-tert-butylpyridine solvate","","- C45 H65 Cl4 N5 W2 -","- C45 H65 Cl4 N5 W2 -","- C180 H260 Cl16 N20 W8 -","4","1","","F. Albert Cotton; Evgeny V. Dikarev; Jiande Gu; Santiago Herrero; Barbara Modec","Alkylpyridine Complexes of Tungsten(II) and Chromium(II). First Rotational Isomers of W2X4L4 Molecules with D2 hand D2 Symmetries","Inorganic Chemistry","2000","39","","5407","5411","10.1021/ic000555v","","","0.71073","MoKα","","0.1353","0.0904","","0.2325","0.1935","","","","1.085","1.082","1.082","","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321564","32.97","0.005","10.227","0.001","28.962","0.002","90","","103.21","0.01","90","","9507.1","1.9","213","2","213","2","","","","","","","synthesized","6","C 1 2/c 1","-C 2yc","15","","Bis(trans-dichloro-bis(4-tert-butylpyridine))-di-tungsten (II), D2 isomer, acetone solvate","","- C39 H58 Cl4 N4 O W2 -","- C39 H58 Cl4 N4 O W2 -","- C312 H464 Cl32 N32 O8 W16 -","8","1","","F. Albert Cotton; Evgeny V. Dikarev; Jiande Gu; Santiago Herrero; Barbara Modec","Alkylpyridine Complexes of Tungsten(II) and Chromium(II). First Rotational Isomers of W2X4L4 Molecules with D2 hand D2 Symmetries","Inorganic Chemistry","2000","39","","5407","5411","10.1021/ic000555v","","","0.71073","MoKα","","0.0532","0.0457","","0.1235","0.1143","","","","1.134","1.125","1.125","","","","","has coordinates,has disorder","179318","2020-10-21","18:00:00",""
"4321565","16.628","0.001","16.628","0.001","22.78","0.001","90","","90","","90","","6298.5","0.6","293","2","293","2","","","","","","","","6","P 41 21 2","P 4abw 2nw","92","","","","- C30.5 H18 Fe N6 O0.5 S2 -","- C30.5 H16 Fe N6 O0.5 S2 -","- C244 H128 Fe8 N48 O4 S16 -","8","1","","Nicolás Moliner; Carmen Muñoz; Sylvie Létard; Xavier Solans; Nieves Menéndez; Antoine Goujon; François Varret; José Antonio Real","Spin Crossover Bistability in Three Mutually Perpendicular Interpenetrated (4,4) Nets","Inorganic Chemistry","2000","39","","5390","5393","10.1021/ic0005588","","","0.71069","MoKα","","0.0926","0.0634","","","0.1904","0.204","","","","","","1.162","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321566","9.866","0.0003","9.866","0.0003","20.8427","0.0007","90","","90","","120","","1756.98","0.1","293","2","293","2","","","","","","","","4","P -3 c 1","-P 3 2""c","165","","","","- C8 H18 N2 Se2 -","- C8 H18 N2 Se2 -","- C48 H108 N12 Se12 -","6","0.5","","Tiina Maaninen; Tristram Chivers; Risto Laitinen; Gabriele Schatte; Maija Nissinen","Selenium Imides: 77Se NMR Investigations of the SeCl2-tBuNH2 Reaction and X-ray Structures of Se3(NtBu)3, tBuNSe(μ-NtBu)2SO2, and tBuNSe(μ-NtBu)2SeO","Inorganic Chemistry","2000","39","","5341","5347","10.1021/ic000598b","","","0.71073","MoKα","","0.0452","0.0381","","","0.0899","0.103","","","","","","0.322","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321567","18.669","0.004","12.329","0.002","16.463","0.003","90","","115.56","0.03","90","","3418.4","1.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H27 N3 O2 S Se -","- C12 H27 N3 O2 S Se -","- C96 H216 N24 O16 S8 Se8 -","8","2","","Tiina Maaninen; Tristram Chivers; Risto Laitinen; Gabriele Schatte; Maija Nissinen","Selenium Imides: 77Se NMR Investigations of the SeCl2-tBuNH2 Reaction and X-ray Structures of Se3(NtBu)3, tBuNSe(μ-NtBu)2SO2, and tBuNSe(μ-NtBu)2SeO","Inorganic Chemistry","2000","39","","5341","5347","10.1021/ic000598b","","","0.71073","MoKα","","0.0703","0.0416","","","0.0805","0.0902","","","","","","1.014","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4321568","6.372","0.001","9.926","0.002","14.034","0.003","99.32","0.003","95.764","0.003","103.876","0.003","841.3","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H27 N3 O Se2 -","- C12 H27 N3 O Se2 -","- C24 H54 N6 O2 Se4 -","2","1","","Tiina Maaninen; Tristram Chivers; Risto Laitinen; Gabriele Schatte; Maija Nissinen","Selenium Imides: 77Se NMR Investigations of the SeCl2-tBuNH2 Reaction and X-ray Structures of Se3(NtBu)3, tBuNSe(μ-NtBu)2SO2, and tBuNSe(μ-NtBu)2SeO","Inorganic Chemistry","2000","39","","5341","5347","10.1021/ic000598b","","","0.71073","MoKα","","0.0464","0.0447","","","0.1214","0.1228","","","","","","0.99","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4321569","11.802","0.006","7.323","0.003","7.018","0.004","90","","102.34","0.04","90","","592.5","0.5","293","2","293","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C5 H6 F5 N O4 U2 -","- C4 H6 F5 N2 O4 U2 -","- C8 H12 F10 N4 O8 U4 -","2","0.25","","Catherine E. Talley; Amanda C. Bean; Thomas E. Albrecht-Schmitt","Hydrothermal Syntheses of Layered Uranium Oxyfluorides: Illustrations of Dimensional Reduction","Inorganic Chemistry","2000","39","","5174","5175","10.1021/ic000668e","","","0.71073","MoKα","","0.0418","0.0399","","0.0958","0.0935","","","","1.12","1.121","1.121","","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321570","17.32","0.01","12.034","0.005","12.172","0.005","90","","90","","90","","2537","2","293","2","293","2","","","","","","","","6","P n n m","-P 2 2n","58","","","","- C3 H5 F5 N2 O5.75 U2 -","- C3 H5 F5 N2 O5.75 U2 -","- C24 H40 F40 N16 O46 U16 -","8","1","","Catherine E. Talley; Amanda C. Bean; Thomas E. Albrecht-Schmitt","Hydrothermal Syntheses of Layered Uranium Oxyfluorides: Illustrations of Dimensional Reduction","Inorganic Chemistry","2000","39","","5174","5175","10.1021/ic000668e","","","0.71073","MoKα","","0.0872","0.0494","","0.1296","0.11","","","","1.053","1.129","1.129","","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321571","12.347","0.004","20.884","0.004","12.62","0.007","90","","119.02","0.04","90","","2846","2","293","2","293","2","","","","","","","","7","P 1 21 1","P 2yb","4","(K-crypt)2[InBi3]","","","- C38 H72 Bi3 In K2 N6 O12 -","- C38 H72 Bi3 In K2 N6 O12 -","- C76 H144 Bi6 In2 K4 N12 O24 -","2","1","","Li Xu; Slavi C. Sevov","Heteroatomic Deltahedral Clusters of Main-Group Elements: Synthesis and Structure of the Zintl Ions [In4Bi5]3-, [InBi3]2-, and [GaBi3]2-","Inorganic Chemistry","2000","39","","5383","5389","10.1021/ic000925f","","","0.71073","MoKα","","0.107","0.0605","","","0.1444","0.1697","","","","","","1.014","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321572","23.572","0.006","15.042","0.004","24.071","0.004","90","","106","0.03","90","","8204","4","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","(Na-crypt)3[In4Bi5]","","","- C54 H108 Bi5 In4 N6 Na3 O18 -","- C54 H108 Bi5 In4 N6 Na3 O18 -","- C216 H432 Bi20 In16 N24 Na12 O72 -","4","1","","Li Xu; Slavi C. Sevov","Heteroatomic Deltahedral Clusters of Main-Group Elements: Synthesis and Structure of the Zintl Ions [In4Bi5]3-, [InBi3]2-, and [GaBi3]2-","Inorganic Chemistry","2000","39","","5383","5389","10.1021/ic000925f","","","0.71073","MoKα","","0.1921","0.1029","","","0.2313","0.2644","","","","","","1.38","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321573","28.532","0.002","23.707","0.002","28.021","0.003","90","","93.274","0.004","90","","18923","3","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","(K-crypt)6[In4Bi5][In4Bi5]","","","- C114.5 H232 Bi10 In8 K6 N15 O36 -","- C114.5 H216 Bi10 In8 K6 N15 O36 -","- C458 H864 Bi40 In32 K24 N60 O144 -","4","1","","Li Xu; Slavi C. Sevov","Heteroatomic Deltahedral Clusters of Main-Group Elements: Synthesis and Structure of the Zintl Ions [In4Bi5]3-, [InBi3]2-, and [GaBi3]2-","Inorganic Chemistry","2000","39","","5383","5389","10.1021/ic000925f","","","0.71073","MoKα","","0.4478","0.1128","","","0.2628","0.3377","","","","","","0.973","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321574","10.7423","0.0002","14.0357","0.0001","16.9346","0.0002","84.054","0.001","87.095","0.001","84.517","0.001","2525.82","0.06","293","2","293","2","","","","","","","The compound Mo~3~(SnCl~3~)OS~3~(S~2~P(OC~2~H~5~)~3~(C~5~H~5~N)~3~ was synthesized from the reaction of molybdenum cluster Mo~3~OS~3~(S~2~P(OC~2~H~5~)~4~H~2~O with SnCl~2~(H~2~O)~2~, (C~6~H~5~)~3~PNP(C~6~H~5~)~3~Cl and pyridine.","9","P -1","-P 1","2","","","","- C27 H45 Cl3 Mo3 N3 O7 P3 S9 Sn -","- C27 H45 Cl3 Mo3 N3 O7 P3 S9 Sn -","- C54 H90 Cl6 Mo6 N6 O14 P6 S18 Sn2 -","2","1","","Rong-Min Yu; Shao-Fang Lu; Jian-Quan Huang; Xiao-Ying Huang; Qiang-Jin Wu; Da-Xu Wu","Synthesis and Characterization of Three Tetranuclear Clusters Containing a [Mo3OS3Sn]6+ Cubane-like Core","Inorganic Chemistry","2000","39","","5348","5353","10.1021/ic990750d","","","0.71073","MoKα","","0.052","0.0377","","0.1034","0.0932","","","","1.04","1.052","1.052","","","","","has coordinates","258736","2020-11-05","08:57:04",""
"4321575","12.9529","0.0001","15.6324","0.0002","19.6355","0.0001","92.083","0.001","97.908","0.001","110.337","0.001","3677.41","0.06","293","2","293","2","","","","","","","The compound (C~6~H~5~)~3~PNP(C~6~H~5~)~3~[Mo~3~(SnCl~3~)OS~3~(dtp)~3~(OAc)(py)] was synthesized from the reaction of trinuclear cluster [Mo~3~OS~3~(dtp)~3~(OAc)(py)] with SnCl~2~ (H~2~O)~2~, (C~6~H~5~)~3~PNP(C~6~H~5~)~3~Cl and pyridine.","9","P -1","-P 1","2","","","","- C55 H67 Cl3 Mo3 N2 O9 P5 S9 Sn -","- C55 H67 Cl3 Mo3 N2 O9 P5 S9 Sn -","- C110 H134 Cl6 Mo6 N4 O18 P10 S18 Sn2 -","2","1","","Rong-Min Yu; Shao-Fang Lu; Jian-Quan Huang; Xiao-Ying Huang; Qiang-Jin Wu; Da-Xu Wu","Synthesis and Characterization of Three Tetranuclear Clusters Containing a [Mo3OS3Sn]6+ Cubane-like Core","Inorganic Chemistry","2000","39","","5348","5353","10.1021/ic990750d","","","0.71073","MoKα","","0.044","0.0339","","0.0831","0.077","","","","1.031","1.048","1.048","","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321576","14.0852","0.0005","15.1324","0.0005","23.2691","0.0007","90","","97.371","0.001","90","","4918.7","0.3","293","2","293","2","","","","","","","The compound ((C2H5)4N)Mo3(SnCl3)OS3(S2P(OC2H5)2)2(OOCCH3)2(C5H5N) was synthesized from the reaction of trimolybdenum cluster Mo3OS3(S2P(OC2H5)2)2(OOCCH3)2(C5H5N) with SnCl2 in the presences of Et4NCl and pyridine.","9","P 1 21/n 1","-P 2yn","14","","","","- C25 H51 Cl3 Mo3 N2 O9 P2 S7 Sn -","- C25 H51 Cl3 Mo3 N2 O9 P2 S7 Sn -","- C100 H204 Cl12 Mo12 N8 O36 P8 S28 Sn4 -","4","1","","Rong-Min Yu; Shao-Fang Lu; Jian-Quan Huang; Xiao-Ying Huang; Qiang-Jin Wu; Da-Xu Wu","Synthesis and Characterization of Three Tetranuclear Clusters Containing a [Mo3OS3Sn]6+ Cubane-like Core","Inorganic Chemistry","2000","39","","5348","5353","10.1021/ic990750d","","","0.71073","MoKα","","0.0787","0.0487","","0.1362","0.1199","","","","1.004","1.061","1.061","","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321577","15.034","0.0005","15.5009","0.0005","21.9604","0.0007","74.805","0.001","85.733","0.001","78.553","0.001","4839.2","0.3","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C90 H76 Au F6 O0.5 P6 Pt2 S2 -","- C90 H76 Au F6 O0.5 P6 Pt2 S2 -","- C180 H152 Au2 F12 O P12 Pt4 S4 -","2","1","","Zhaohui Li; Zhi-Heng Loh; K. F. Mok; T. S. Andy Hor","Structural, Dynamic, and Theoretical Studies of [AunPt2(PPh3)4(μ-S)2-n(μ3-S)nL][PF6] [n = 1, L = PPh3; n = 2, L = Ph2PCH2PPh2, (C5H4PPh2)2Fe]","Inorganic Chemistry","2000","39","","5299","5305","10.1021/ic991416k","","","0.71073","MoKα","","0.0718","0.05","","0.1742","0.1601","","","","1.046","1.132","1.132","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321578","32.0538","0.0004","16.0822","0.0003","18.9388","0.0003","90","","90","","90","","9762.9","0.3","293","2","293","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C97 H82 Au2 F12 P8 Pt2 S2 -","- C97 H82 Au2 F12 P8 Pt2 S2 -","- C388 H328 Au8 F48 P32 Pt8 S8 -","4","1","","Zhaohui Li; Zhi-Heng Loh; K. F. Mok; T. S. Andy Hor","Structural, Dynamic, and Theoretical Studies of [AunPt2(PPh3)4(μ-S)2-n(μ3-S)nL][PF6] [n = 1, L = PPh3; n = 2, L = Ph2PCH2PPh2, (C5H4PPh2)2Fe]","Inorganic Chemistry","2000","39","","5299","5305","10.1021/ic991416k","","","0.71073","MoKα","","0.0493","0.0347","","0.0974","0.0843","","","","1.036","1.051","1.051","","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321579","31.95","0.002","16.0157","0.0008","18.846","0.0009","90","","90","","90","","9643.5","0.9","293","2","293","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C97 H82 Au2 F12 P8 Pt2 S2 -","- C97 H82 Au2 F12 P8 Pt2 S2 -","- C388 H328 Au8 F48 P32 Pt8 S8 -","4","1","","Zhaohui Li; Zhi-Heng Loh; K. F. Mok; T. S. Andy Hor","Structural, Dynamic, and Theoretical Studies of [AunPt2(PPh3)4(μ-S)2-n(μ3-S)nL][PF6] [n = 1, L = PPh3; n = 2, L = Ph2PCH2PPh2, (C5H4PPh2)2Fe]","Inorganic Chemistry","2000","39","","5299","5305","10.1021/ic991416k","","","0.71073","MoKα","","0.0763","0.0478","","0.1403","0.1196","","","","1.033","1.06","1.06","","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321580","13.8668","0.0002","51.7754","0.0004","15.966","0.0002","90","","113.786","0.001","90","","10489.3","0.2","293","2","293","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C106.5 H89 Au2 Cl F12 Fe P8 Pt2 S2 -","- C106.5 H89 Au2 Cl F12 Fe P8 Pt2 S2 -","- C426 H356 Au8 Cl4 F48 Fe4 P32 Pt8 S8 -","4","1","","Zhaohui Li; Zhi-Heng Loh; K. F. Mok; T. S. Andy Hor","Structural, Dynamic, and Theoretical Studies of [AunPt2(PPh3)4(μ-S)2-n(μ3-S)nL][PF6] [n = 1, L = PPh3; n = 2, L = Ph2PCH2PPh2, (C5H4PPh2)2Fe]","Inorganic Chemistry","2000","39","","5299","5305","10.1021/ic991416k","","","0.71073","MoKα","","0.0859","0.0649","","","0.1297","0.1372","","","","","","1.204","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321581","14.146","0.005","14.146","0.005","65.69","0.005","90","","90","","120","","11384","6","200","8","200","8","","","","","","","","7","R -3 c :H","-R 3 2""c","167","Hexa-Iron(III)-inclusion-cluster","(Na(12-MC(Fe(III)N(COO)-3)2(my-O)3)(ClO4)14(H2O)","","- C42 H88 Cl Fe6 N6 Na O51 -","- C42 H60 Cl Fe6 N6 Na O51 -","- C252 H360 Cl6 Fe36 N36 Na6 O306 -","6","0.166667","","Thorsten Schneppensieper; Günter Liehr; Rudi van Eldik; Jürgen Ensling; Philipp Gütlich","A New Cylindrical, Six-Membered Iron(III) Inclusion Cluster Consisting of Three Oxo-Bridged Diiron Subunits Linked by Carboxylate Bridges","Inorganic Chemistry","2000","39","","5565","5568","10.1021/ic000108f","","","0.71069","MoKα","","0.051","0.0388","","","0.1349","0.1455","","","","","","1.245","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321582","9.83","0.002","9.516","0.001","10.696","0.001","90","","106.994","0.01","90","","956.8","0.2","293.2","","","","","","","","","","","2","P 1 21 1","P 2yb","4","","","","- C26 H20 -","- C26 H20 -","- C52 H40 -","2","1","","Ichiro Ino; Liang Ping Wu; Megumu Munakata; Takayoshi Kuroda-Sowa; Masahiko Maekawa; Yusaku Suenaga; Ryusuke Sakai","Bridged Silver(I) Complexes of the Polycyclic Aromatic Compounds Tetraphenylethylene and 1,1,4,4-Tetraphenyl-1,3-butadiene","Inorganic Chemistry","2000","39","","5430","5436","10.1021/ic000263u","","","0.7107","MoKα","","","0.0472","","","","0.15","","","","","","1.007","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4321583","10.11","0.001","10.851","0.002","9.82","0.002","103.64","0.01","94.95","0.01","99.31","0.01","1024.4","0.3","296.2","","","","","","","","","","","2","P -1","-P 1","2","","","","- C28 H22 -","- C28 H22 -","- C56 H44 -","2","1","","Ichiro Ino; Liang Ping Wu; Megumu Munakata; Takayoshi Kuroda-Sowa; Masahiko Maekawa; Yusaku Suenaga; Ryusuke Sakai","Bridged Silver(I) Complexes of the Polycyclic Aromatic Compounds Tetraphenylethylene and 1,1,4,4-Tetraphenyl-1,3-butadiene","Inorganic Chemistry","2000","39","","5430","5436","10.1021/ic000263u","","","0.7107","MoKα","","","0.0442","","","","0.1204","","","","","","0.994","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4321584","12.345","0.003","9.253","0.003","25.376","0.001","90","","98.719","0.001","90","","2865.2","1.2","295.2","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H30 Ag Cl O4 -","- C34 H30 Ag Cl O4 -","- C136 H120 Ag4 Cl4 O16 -","4","1","","Ichiro Ino; Liang Ping Wu; Megumu Munakata; Takayoshi Kuroda-Sowa; Masahiko Maekawa; Yusaku Suenaga; Ryusuke Sakai","Bridged Silver(I) Complexes of the Polycyclic Aromatic Compounds Tetraphenylethylene and 1,1,4,4-Tetraphenyl-1,3-butadiene","Inorganic Chemistry","2000","39","","5430","5436","10.1021/ic000263u","","","0.7107","MoKα","","","0.0674","","","","0.2183","","","","","","1.117","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321585","18.7791","0.0006","9.322","0.002","14.8669","0.0003","90","","90","","90","","2602.6","0.6","295.2","","","","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C26 H20 Ag2 Cl2 O8 -","- C26 H20 Ag2 Cl2 O8 -","- C104 H80 Ag8 Cl8 O32 -","4","0.5","","Ichiro Ino; Liang Ping Wu; Megumu Munakata; Takayoshi Kuroda-Sowa; Masahiko Maekawa; Yusaku Suenaga; Ryusuke Sakai","Bridged Silver(I) Complexes of the Polycyclic Aromatic Compounds Tetraphenylethylene and 1,1,4,4-Tetraphenyl-1,3-butadiene","Inorganic Chemistry","2000","39","","5430","5436","10.1021/ic000263u","","","0.7107","MoKα","","","0.0586","","","","0.1896","","","","","","1.065","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321586","20.527","0.005","10.028","0.001","18.905","0.001","90","","94.257","0.001","90","","3880.8","1","295.2","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C30 H20 Ag4 F12 O12 S4 -","- C30 H20 Ag4 F12 O12 S4 -","- C120 H80 Ag16 F48 O48 S16 -","4","0.5","","Ichiro Ino; Liang Ping Wu; Megumu Munakata; Takayoshi Kuroda-Sowa; Masahiko Maekawa; Yusaku Suenaga; Ryusuke Sakai","Bridged Silver(I) Complexes of the Polycyclic Aromatic Compounds Tetraphenylethylene and 1,1,4,4-Tetraphenyl-1,3-butadiene","Inorganic Chemistry","2000","39","","5430","5436","10.1021/ic000263u","","","0.7107","MoKα","","","0.0651","","","","0.1971","","","","","","1.061","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321587","8.22","0.002","8.9164","0.0009","10.396","0.002","108.185","0.002","93.824","0.002","112.033","0.005","656.3","0.2","295.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C28 H22 Ag2 Cl2 O8 -","- C28 H22 Ag2 Cl2 O8 -","- C28 H22 Ag2 Cl2 O8 -","1","0.5","","Ichiro Ino; Liang Ping Wu; Megumu Munakata; Takayoshi Kuroda-Sowa; Masahiko Maekawa; Yusaku Suenaga; Ryusuke Sakai","Bridged Silver(I) Complexes of the Polycyclic Aromatic Compounds Tetraphenylethylene and 1,1,4,4-Tetraphenyl-1,3-butadiene","Inorganic Chemistry","2000","39","","5430","5436","10.1021/ic000263u","","","0.7107","MoKα","","","0.035","","","","0.1162","","","","","","1.161","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321588","19.534","0.002","5.0005","0.0007","30.962","0.001","90","","91.861","0.001","90","","3022.8","0.5","123.2","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C30 H22 Ag2 F6 O6 S2 -","- C30 H22 Ag2 F6 O6 S2 -","- C120 H88 Ag8 F24 O24 S8 -","4","0.5","","Ichiro Ino; Liang Ping Wu; Megumu Munakata; Takayoshi Kuroda-Sowa; Masahiko Maekawa; Yusaku Suenaga; Ryusuke Sakai","Bridged Silver(I) Complexes of the Polycyclic Aromatic Compounds Tetraphenylethylene and 1,1,4,4-Tetraphenyl-1,3-butadiene","Inorganic Chemistry","2000","39","","5430","5436","10.1021/ic000263u","","","0.7107","MoKα","","","0.036","","","","0.1027","","","","","","1.308","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321589","22.945","0.001","15.283","0.0007","12.6787","0.0006","90","","90","","90","","4446","0.4","203","2","203","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C26 H70 N3 Na O4 Si6 U -","- C26 H70 N3 Na O4 Si6 U -","- C104 H280 N12 Na4 O16 Si24 U4 -","4","1","","Carol J. Burns; David L. Clark; Robert J. Donohoe; Paul B. Duval; Brian L. Scott; C. Drew Tait","A trigonal Bipyramidal Uranyl Amido Complex: Synthesis and Structural Characterization of [Na(THF)~2~][UO~2~(N(SiMe~3~)~2~)~3~]","Inorganic Chemistry","2000","39","","5464","5468","10.1021/ic0003168","","","0.71073","MoKα","","0.0524","0.0309","","","0.0524","0.0573","","","","","","0.939","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321590","8.3975","0.0004","11.0237","0.0005","12.4105","0.0006","98.674","0.001","105.354","0.001","110.962","0.001","995.33","0.08","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H18 Au N2 P S -","- C22 H18 Au N2 P S -","- C44 H36 Au2 N4 P2 S2 -","2","1","","Leijun Hao; M. Adnan Mansour; Rene J. Lachicotte; Henry J. Gysling; Richard Eisenberg","A Gold(I) Mononuclear Complex and Its Association into Binuclear and Cluster Compounds by Hydrogen Bonding or Metal Ion Coordination","Inorganic Chemistry","2000","39","","5520","5529","10.1021/ic000396f","","","0.71073","MoKα","","0.0389","0.0366","","0.0917","0.0904","","","","1.038","1.063","1.063","","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321591","14.0284","0.0003","14.1093","0.0003","15.7027","0.0002","97.187","0.001","96.531","0.001","117.142","0.001","2692.21","0.09","193","2","193","2","","","","","","","","9","P -1","-P 1","2","","","","- C45 H42 Au2 Cl2 F12 N4 O2 P4 S2 -","- C44.5 H39 Au2 Cl F12 N4 O1.5 P4 S2 -","- C89 H78 Au4 Cl2 F24 N8 O3 P8 S4 -","2","1","","Leijun Hao; M. Adnan Mansour; Rene J. Lachicotte; Henry J. Gysling; Richard Eisenberg","A Gold(I) Mononuclear Complex and Its Association into Binuclear and Cluster Compounds by Hydrogen Bonding or Metal Ion Coordination","Inorganic Chemistry","2000","39","","5520","5529","10.1021/ic000396f","","","0.71073","MoKα","","0.102","0.0772","","0.1633","0.1534","","","","1.165","1.261","1.261","","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321592","19.6388","0.0006","16.3788","0.0004","17.2294","0.0005","90","","91.48","","90","","5540.2","0.3","193","2","193","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C50 H40 Au2 Cl2 Cu2 F12 N4 P4 S2 -","- C50 H40 Au2 Cl2 Cu2 F12 N4 P4 S2 -","- C200 H160 Au8 Cl8 Cu8 F48 N16 P16 S8 -","4","1","","Leijun Hao; M. Adnan Mansour; Rene J. Lachicotte; Henry J. Gysling; Richard Eisenberg","A Gold(I) Mononuclear Complex and Its Association into Binuclear and Cluster Compounds by Hydrogen Bonding or Metal Ion Coordination","Inorganic Chemistry","2000","39","","5520","5529","10.1021/ic000396f","","","0.71073","MoKα","","0.0539","0.0399","","0.0897","0.0838","","","","1.037","1.07","1.07","","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321593","14.3815","0.0005","23.3874","0.0007","21.6404","0.0006","90","","98.017","0.001","90","","7207.5","0.4","213","2","213","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C72 H60 Cl12 P3 Re3 -","- C72 H60 Cl12 P3 Re3 -","- C288 H240 Cl48 P12 Re12 -","4","1","","Daniel Neuman; Patrina Paraskevopoulou; Nikos Psaroudakis; Konstantinos Mertis; Richard J. Staples; Pericles Stavropoulos","Structural and Functional Characteristics of Rhenium Clusters Derived from Redox Chemistry of the Triangular [ReIII3(μ-Cl)3] Core Unit","Inorganic Chemistry","2000","39","","5530","5537","10.1021/ic000449t","","","0.71073","MoKα","","0.0455","0.0359","","","0.0689","0.0748","","","","","","1.116","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321594","10.3204","0.0002","13.4754","0.0002","21.1067","0.0005","99.774","0.001","94.195","0.001","112.321","0.001","2645.31","0.09","213","2","213","2","","","","","","","","6","P -1","-P 1","2","","","","- C48 H46 Cl10 O3 P2 Re3 -","- C48 H46 Cl10 O3 P2 Re3 -","- C96 H92 Cl20 O6 P4 Re6 -","2","1","","Daniel Neuman; Patrina Paraskevopoulou; Nikos Psaroudakis; Konstantinos Mertis; Richard J. Staples; Pericles Stavropoulos","Structural and Functional Characteristics of Rhenium Clusters Derived from Redox Chemistry of the Triangular [ReIII3(μ-Cl)3] Core Unit","Inorganic Chemistry","2000","39","","5530","5537","10.1021/ic000449t","","","0.71073","MoKα","","0.0492","0.0306","","","0.0589","0.0612","","","","","","1.037","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321595","10.2287","0.0001","11.4907","0.0001","12.7126","0.0001","84.034","0.001","71.295","0.001","68.471","0.001","1316.36","0.02","213","2","213","2","","","","","","","","7","P -1","-P 1","2","","","","- C27 H26 Cl8 N2 O P2 Re2 -","- C52 H46 Cl8 N2 P2 Re2 -","- C52 H46 Cl8 N2 P2 Re2 -","1","0.5","","Daniel Neuman; Patrina Paraskevopoulou; Nikos Psaroudakis; Konstantinos Mertis; Richard J. Staples; Pericles Stavropoulos","Structural and Functional Characteristics of Rhenium Clusters Derived from Redox Chemistry of the Triangular [ReIII3(μ-Cl)3] Core Unit","Inorganic Chemistry","2000","39","","5530","5537","10.1021/ic000449t","","","0.71073","MoKα","","0.0537","0.0512","","","0.1345","0.137","","","","","","1.036","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321596","16.1","0.002","19.139","0.004","18.307","0.005","90","","92.03","0.01","90","","5638","2","213","2","213","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C49 H43 Cl12 O P2 Re3 -","- C49 H43 Cl12 O P2 Re3 -","- C196 H172 Cl48 O4 P8 Re12 -","4","1","","Daniel Neuman; Patrina Paraskevopoulou; Nikos Psaroudakis; Konstantinos Mertis; Richard J. Staples; Pericles Stavropoulos","Structural and Functional Characteristics of Rhenium Clusters Derived from Redox Chemistry of the Triangular [ReIII3(μ-Cl)3] Core Unit","Inorganic Chemistry","2000","39","","5530","5537","10.1021/ic000449t","","","0.71073","MoKα","","0.0787","0.0401","","","0.0672","0.0798","","","","","","1.069","","","","has coordinates,has disorder","179318","2020-10-21","18:00:00",""
"4321597","14.481","0.001","15.623","0.001","18.033","0.001","100.282","0.002","108.082","0.002","108.964","0.002","3486.2","0.4","213","2","213","2","","","","","","","","5","P -1","-P 1","2","","","","- C106 H100 Cl42 P4 Re6 -","- C106 H100 Cl42 P4 Re6 -","- C106 H100 Cl42 P4 Re6 -","1","0.5","","Daniel Neuman; Patrina Paraskevopoulou; Nikos Psaroudakis; Konstantinos Mertis; Richard J. Staples; Pericles Stavropoulos","Structural and Functional Characteristics of Rhenium Clusters Derived from Redox Chemistry of the Triangular [ReIII3(μ-Cl)3] Core Unit","Inorganic Chemistry","2000","39","","5530","5537","10.1021/ic000449t","","","0.71073","MoKα","","0.0521","0.0411","","","0.1039","0.1096","","","","","","1.005","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321598","10.1074","0.0002","23.2153","0.0001","23.3849","0.0005","90","","90.719","0.001","90","","5486.75","0.16","213","2","213","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C52 H46.5 Cl9.5 N2 O0.5 P2 Re3 -","- C52 H46.5 Cl9.5 N2 O0.5 P2 Re3 -","- C208 H186 Cl38 N8 O2 P8 Re12 -","4","1","","Daniel Neuman; Patrina Paraskevopoulou; Nikos Psaroudakis; Konstantinos Mertis; Richard J. Staples; Pericles Stavropoulos","Structural and Functional Characteristics of Rhenium Clusters Derived from Redox Chemistry of the Triangular [ReIII3(μ-Cl)3] Core Unit","Inorganic Chemistry","2000","39","","5530","5537","10.1021/ic000449t","","","0.71073","MoKα","","0.0581","0.0455","","","0.1057","0.1117","","","","","","1.174","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4321599","22.5845","0.0003","9.2498","0.0001","27.0072","0.0002","90","","103.79","0.001","90","","5479.24","0.1","213","2","213","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C52 H47 Cl10 N2 O P2 Re3 -","- C52 H47 Cl10 N2 O P2 Re3 -","- C208 H188 Cl40 N8 O4 P8 Re12 -","4","1","","Daniel Neuman; Patrina Paraskevopoulou; Nikos Psaroudakis; Konstantinos Mertis; Richard J. Staples; Pericles Stavropoulos","Structural and Functional Characteristics of Rhenium Clusters Derived from Redox Chemistry of the Triangular [ReIII3(μ-Cl)3] Core Unit","Inorganic Chemistry","2000","39","","5530","5537","10.1021/ic000449t","","","0.71073","MoKα","","0.0763","0.0362","","","0.0482","0.053","","","","","","1.092","","","","has coordinates","179318","2020-10-21","18:00:00",""
"4321600","17.262","0.003","17.262","0.003","14.229","0.003","90","","90","","90","","4239.9","1.4","293","2","293","2","","","","","","","","5","I -4","I -4","82","","","","- C24 H20 O4 P Re -","- C24 H20 O4 P Re -","- C192 H160 O32 P8 Re8 -","8","1","","Daniel Neuman; Patrina Paraskevopoulou; Nikos Psaroudakis; Konstantinos Mertis; Richard J. Staples; Pericles Stavropoulos","Structural and Functional Characteristics of Rhenium Clusters Derived from Redox Chemistry of the Triangular [ReIII3(μ-Cl)3] Core Unit","Inorganic Chemistry","2000","39","","5530","5537","10.1021/ic000449t","","","0.71073","MoKα","","0.0611","0.0302","","","0.0604","0.0641","","","","","","1.123","","","","has coordinates,has disorder","179319","2020-10-21","18:00:00",""
"4321601","10.214","0.001","12.944","0.001","22.069","0.002","92.289","0.002","93.086","0.002","107.646","0.002","2771.6","0.4","213","2","213","2","","","","","","","","6","P -1","-P 1","2","","","","- C50 H48 Cl11 O2 P2 Re3 -","- C50 H48 Cl11 O2 P2 Re3 -","- C100 H96 Cl22 O4 P4 Re6 -","2","1","","Daniel Neuman; Patrina Paraskevopoulou; Nikos Psaroudakis; Konstantinos Mertis; Richard J. Staples; Pericles Stavropoulos","Structural and Functional Characteristics of Rhenium Clusters Derived from Redox Chemistry of the Triangular [ReIII3(μ-Cl)3] Core Unit","Inorganic Chemistry","2000","39","","5530","5537","10.1021/ic000449t","","","0.71073","MoKα","","0.1038","0.061","","","0.1737","0.2519","","","","","","1.035","","","","has coordinates,has disorder","179319","2020-10-21","18:00:00",""
"4321602","12.9031","0.0015","15.6057","0.0018","19.498","0.002","90","","104.763","0.002","90","","3796.5","0.7","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H40 B2 N16 O4 Zn -","- C22 H26 B2 N14 O2 Zn -","- C88 H104 B8 N56 O8 Zn4 -","4","0.5","","Arnold L. Rheingold; Christopher D. Incarvito; Swiatoslaw Trofimenko","Dihydrobis(4-cyanopyrazol-1-yl)borate, [Bp4CN], a Functionalized Heteroscorpionate Ligand with Cross-Linking Potential","Inorganic Chemistry","2000","39","","5569","5571","10.1021/ic000482f","","","0.71073","MoKα","","0.0735","0.0672","","","0.19","0.197","","","","","","1.549","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321603","33.801","0.006","10.9292","0.0018","20.488","0.003","90","","103.545","0.003","90","","7358","2","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C32 H45 B2 Co N12 -","- C32 H45 B2 Co N12 -","- C256 H360 B16 Co8 N96 -","8","1","","Arnold L. Rheingold; Christopher D. Incarvito; Swiatoslaw Trofimenko","Dihydrobis(4-cyanopyrazol-1-yl)borate, [Bp4CN], a Functionalized Heteroscorpionate Ligand with Cross-Linking Potential","Inorganic Chemistry","2000","39","","5569","5571","10.1021/ic000482f","","","0.71073","MoKα","","0.0998","0.0716","","","0.1825","0.2092","","","","","","1.091","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321604","16.606","0.011","7.615","0.005","14.99","0.009","90","","114.7","0.04","90","","1722","2","243","2","243","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H18 B N6 Rh -","- C16 H18 B N6 Rh -","- C64 H72 B4 N24 Rh4 -","4","1","","Arnold L. Rheingold; Christopher D. Incarvito; Swiatoslaw Trofimenko","Dihydrobis(4-cyanopyrazol-1-yl)borate, [Bp4CN], a Functionalized Heteroscorpionate Ligand with Cross-Linking Potential","Inorganic Chemistry","2000","39","","5569","5571","10.1021/ic000482f","","","0.71073","MoKα","","0.0514","0.0423","","","0.1278","0.1484","","","","","","1.224","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321605","32.1821","0.0013","9.5744","0.0004","24.7577","0.001","90","","106.9","0.001","90","","7299","0.5","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","Bert*Sn(t-Bu)","","","- C40 H58 Sn -","- C40 H57.654 Sn -","- C320 H461.232 Sn8 -","8","1","","Barrett E. Eichler; Philip P. Power","Characterization of the Sterically Encumbered Terphenyl-Substituted Species 2,6-Trip2H3C6S̈n-Sn(Me)2C6H3-2,6-Trip2, an Unsymmetric, Group 14 Element, Methylmethylene, Valence Isomer of an Alkene, Its Related Lithium Derivative 2,6-Trip2H3C6(Me)2Sn-Sn(Li)(Me)C6H3-2,6-Trip2, and the Monomer Sn(t-Bu)C6H3-2,6-Trip2 (Trip = C6H2-2,4,6-i-Pr3)","Inorganic Chemistry","2000","39","","5444","5449","10.1021/ic0005137","","","0.71073","MoKα","","0.0695","0.0385","","","0.0774","0.0856","","","","","","0.908","","","","has coordinates,has disorder","179319","2020-10-21","18:00:00",""
"4321606","14.4163","0.0006","15.9717","0.0007","19.0328","0.0008","67.083","0.001","74.633","0.001","72.654","0.001","3797.2","0.3","90","2","90","2","","","","","","","","4","P -1","-P 1","2","Bert*Me2Sn-Sn(Li)Bert*Me.0.5hexane","","","- C78 H114 Li Sn2 -","- C78 H114 Li Sn2 -","- C156 H228 Li2 Sn4 -","2","1","","Barrett E. Eichler; Philip P. Power","Characterization of the Sterically Encumbered Terphenyl-Substituted Species 2,6-Trip2H3C6S̈n-Sn(Me)2C6H3-2,6-Trip2, an Unsymmetric, Group 14 Element, Methylmethylene, Valence Isomer of an Alkene, Its Related Lithium Derivative 2,6-Trip2H3C6(Me)2Sn-Sn(Li)(Me)C6H3-2,6-Trip2, and the Monomer Sn(t-Bu)C6H3-2,6-Trip2 (Trip = C6H2-2,4,6-i-Pr3)","Inorganic Chemistry","2000","39","","5444","5449","10.1021/ic0005137","","","0.71073","MoKα","","0.1149","0.0509","","","0.1139","0.1337","","","","","","0.847","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321607","16.8704","0.0005","19.2696","0.0006","21.485","0.0006","90","","99.6","0.001","90","","6886.7","0.4","90","2","90","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","Bert*SnMe2-SnBert*.0.5hexane","","","- C77 H111 Sn2 -","- C77 H111 Sn2 -","- C308 H444 Sn8 -","4","1","","Barrett E. Eichler; Philip P. Power","Characterization of the Sterically Encumbered Terphenyl-Substituted Species 2,6-Trip2H3C6S̈n-Sn(Me)2C6H3-2,6-Trip2, an Unsymmetric, Group 14 Element, Methylmethylene, Valence Isomer of an Alkene, Its Related Lithium Derivative 2,6-Trip2H3C6(Me)2Sn-Sn(Li)(Me)C6H3-2,6-Trip2, and the Monomer Sn(t-Bu)C6H3-2,6-Trip2 (Trip = C6H2-2,4,6-i-Pr3)","Inorganic Chemistry","2000","39","","5444","5449","10.1021/ic0005137","","","0.71073","MoKα","","0.0699","0.0383","","","0.0858","0.0957","","","","","","0.898","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321608","13.9375","0.0014","20.6604","0.0018","16.6684","0.0019","90","","110.619","0.012","90","","4492.3","0.9","160","2","160","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C61 H88 N14 Ni8 O25.5 S4 -","- C61 H88 N14 Ni8 O25.5 S4 -","- C122 H176 N28 Ni16 O51 S8 -","2","1","","Juan M. Clemente-Juan; Benoît Chansou; Bruno Donnadieu; Jean-Pierre Tuchagues","Synthesis, Structure, and Magnetic Properties of the Low-Symmetry Tetranuclear Cubane-like Nickel Complex [Ni4(pypentO)(pym)(μ3-OH)2(μ-Oac)2(NCS)2(OH2)]","Inorganic Chemistry","2000","39","","5515","5519","10.1021/ic0005442","","","0.71073","MoKα","","0.0491","0.0434","","","0.1127","0.1161","","","","","","1.021","","","","has coordinates","201169","2020-10-21","18:00:00",""
"4321609","13.212","0.002","9.136","0.001","15.587","0.002","90","","114.61","0.01","90","","1710.5","0.4","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C30 H34 Cu F6 N4 O8 -","- C30 H34 Cu F6 N4 O8 -","- C60 H68 Cu2 F12 N8 O16 -","2","0.5","","André Cogne; Jean Laugier; Dominique Luneau; Paul Rey","Novel Square Planar Copper(II) Complexes with Imino or Nitronyl Nitroxide Radicals Exhibiting Large Ferro- and Antiferromagnetic Interactions","Inorganic Chemistry","2000","39","","5510","5514","10.1021/ic0005590","","","0.7106","MoKα","","0.0394","0.0394","","","0.1085","0.1085","","","","","","0.938","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321610","11.059","0.002","15.289","0.001","10.694","0.002","90","","114.2","0.01","90","","1649.3","0.5","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C30 H34 Cu F6 N4 O6 -","- C30 H34 Cu F6 N4 O6 -","- C60 H68 Cu2 F12 N8 O12 -","2","0.5","","André Cogne; Jean Laugier; Dominique Luneau; Paul Rey","Novel Square Planar Copper(II) Complexes with Imino or Nitronyl Nitroxide Radicals Exhibiting Large Ferro- and Antiferromagnetic Interactions","Inorganic Chemistry","2000","39","","5510","5514","10.1021/ic0005590","","","0.7106","MoKα","","0.0583","0.0583","","","0.128","0.128","","","","","","1.057","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321611","15.3104","0.0013","6.1035","0.0003","18.0152","0.0013","90","","113.348","0.009","90","","1545.6","0.2","200","3","200","3","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Te(N3)2(C6F5)2","","","- C12 F10 N6 Te -","- C12 F10 N6 Te -","- C48 F40 N24 Te4 -","4","1","","Thomas M. Klapötke; Burkhard Krumm; Peter Mayer; Oliver P. Ruscitti","First Synthesis and Structures of Aryltellurium(IV) Diazides","Inorganic Chemistry","2000","39","","5426","5427","10.1021/ic000810b","","","0.71073","MoKα","","0.0361","0.0204","","","0.0417","0.0444","","","","","","0.892","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321612","7.5801","0.0004","14.9046","0.0009","23.0845","0.0014","90","","90","","90","","2608","0.3","150","3","150","3","","","","","","","","4","P b c a","-P 2ac 2ab","61","Te(N3)2(C6H5)2","","","- C12 H10 N6 Te -","- C12 H10 N6 Te -","- C96 H80 N48 Te8 -","8","1","","Thomas M. Klapötke; Burkhard Krumm; Peter Mayer; Oliver P. Ruscitti","First Synthesis and Structures of Aryltellurium(IV) Diazides","Inorganic Chemistry","2000","39","","5426","5427","10.1021/ic000810b","","","0.71073","MoKα","","0.0319","0.0209","","","0.0429","0.0447","","","","","","0.917","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321613","16.929","0.001","22.7847","0.0009","14.5877","0.0005","95.559","0.003","103.133","0.005","70.95","0.006","5178","0.5","296.2","","296.2","","","","","","","","","4","P -1","-P 1","2","","","","- C96 H72 N8 Pd2 -","- C96 H72 N8 Pd2 -","- C192 H144 N16 Pd4 -","2","1","","Hiroyuki Furuta; Naoko Kubo; Hiromitsu Maeda; Tomoya Ishizuka; Atsuhiro Osuka; Hideki Nanami; Takuji Ogawa","N-Confused Double-Decker Porphyrins","Inorganic Chemistry","2000","39","","5424","5425","10.1021/ic0010048","","","0.7107","MoKα","","0.1041","0.104","","0.152","","0.152","","","2.636","","","2.64","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321614","11.2933","0.0006","12.173","0.0007","13.6504","0.0008","105.33","0.001","102.406","0.001","102.151","0.001","1694.88","0.17","173","2","173","2","","","","","","","","6","P -1","-P 1","2","K2CuMesitylPorphyrin","","","- C70 H82 Cu K2 N4 O14 -","- C70 H74 Cu K2 N4 O14 -","- C70 H74 Cu K2 N4 O14 -","1","0.5","","Michael Harmjanz; Michael J. Scott","Facile Synthesis of Stacked, Heteronuclear Porphyrin Arrays with Varied Architectures","Inorganic Chemistry","2000","39","","5428","5429","10.1021/ic0010656","","","0.71073","MoKα","","0.0524","0.0485","","","0.1319","0.1371","","","","","","1.086","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321615","13.298","0.004","14.363","0.004","22.526","0.006","81.372","0.006","76.735","0.005","75.879","0.005","4041","2","173","2","173","2","","","","","","","","6","P -1","-P 1","2","[CuMesitylporphyrin]2- [Mn(HOMe)6]2+","","","- C76.25 H107 Cu Mn N4 O20.25 -","- C76.25 H100 Cu Mn N4 O20.25 -","- C152.5 H200 Cu2 Mn2 N8 O40.5 -","2","1","","Michael Harmjanz; Michael J. Scott","Facile Synthesis of Stacked, Heteronuclear Porphyrin Arrays with Varied Architectures","Inorganic Chemistry","2000","39","","5428","5429","10.1021/ic0010656","","","0.71073","MoKα","","0.2144","0.0923","","","0.2043","0.2694","","","","","","0.98","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321616","10.9439","0.0009","14.1435","0.0011","14.3367","0.0011","95.221","0.002","94.625","0.002","108.933","0.001","2076","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","[CuMethoxyporphyrin]2- [Mn(HOMe)6]2+","","","- C72.5 H86 Cu Mn N4 O22.5 -","- C72.5 H86 Cu Mn N4 O22.5 -","- C72.5 H86 Cu Mn N4 O22.5 -","1","0.5","","Michael Harmjanz; Michael J. Scott","Facile Synthesis of Stacked, Heteronuclear Porphyrin Arrays with Varied Architectures","Inorganic Chemistry","2000","39","","5428","5429","10.1021/ic0010656","","","0.71073","MoKα","","0.1201","0.0735","","","0.194","0.2289","","","","","","1.029","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321617","9.284","0.0006","19.097","0.002","12.781","0.0007","90","","99.091","0.004","90","","2237.6","0.3","170","","170","","","","","","","","H2L-1 + [Ti(NBu-t)Cl2(py(3] in benzene","8","P 1 21/n 1","-P 2yn","14","","[Ti{i-Pr2(CH2CH2CH2N)[9]aneN3}Cl(OTf)]","","- C16 H32 Cl F3 N4 O3 S Ti -","- C16 H32 Cl F3 N4 O3 S Ti -","- C64 H128 Cl4 F12 N16 O12 S4 Ti4 -","4","1","","Nigel A. H. Male; Michael E. G. Skinner; Sergei Y. Bylikin; Paul J. Wilson; Philip Mountford; Martin Schröder","Macrocycle-Supported Titanium Complexes with Chelating Imido Ligands: Analogues of ansa-Metallocenes","Inorganic Chemistry","2000","39","","5483","5491","10.1021/ic9910357","","","0.71069","MoKα","","","0.0526","","","0.0359","","","","","1.17","1.17","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4321618","6.972","0.001","15.678","0.002","19.032","0.002","90","","90","","90","","2080.3","0.5","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C23 H19 Mn N2 O4 Sn -","- C23 H19 Mn N2 O4 Sn -","- C92 H76 Mn4 N8 O16 Sn4 -","4","1","","Dominique Agustin; Ghassoub Rima; Heinz Gornitzka; Jacques Barrau","(Schiff Base) Divalent Group 14 Element Species: Manganese and Iron Complexes (Salen)MMn(CO)2(η5-C5H5) (M14= Ge, Sn, Pb) and (Salen)SnFe(CO)4","Inorganic Chemistry","2000","39","","5492","5495","10.1021/ic9915045","","","0.71073","MoKα","","0.03","0.0288","","","0.0733","0.0738","","","","","","1.037","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321619","8.465","0.002","9.795","0.003","13.213","0.004","105.55","0.03","105.15","0.03","100.84","0.03","978.7","0.6","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H14 Fe N2 O6 Sn -","- C20 H14 Fe N2 O6 Sn -","- C40 H28 Fe2 N4 O12 Sn2 -","2","1","","Dominique Agustin; Ghassoub Rima; Heinz Gornitzka; Jacques Barrau","(Schiff Base) Divalent Group 14 Element Species: Manganese and Iron Complexes (Salen)MMn(CO)2(η5-C5H5) (M14= Ge, Sn, Pb) and (Salen)SnFe(CO)4","Inorganic Chemistry","2000","39","","5492","5495","10.1021/ic9915045","","","0.71073","MoKα","","0.0619","0.0552","","","0.1414","0.1457","","","","","","1.074","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321620","9.75","0.001","11.413","0.002","15.657","0.003","90","","90","","90","","1742.3","0.5","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C12 H23 N2 O6 Re S2 -","- C12 H23 N2 O6 Re S2 -","- C48 H92 N8 O24 Re4 S8 -","4","1","","Lory Hansen; Shun Hirota; Xiaolong Xu; Andrew T. Taylor; Luigi G. Marzilli","Nature of Cysteine-Based Re(V)O(N2S2) Radiopharmaceuticals at Physiological pH Ascertained by Investigation of a New Complex with a MesoN2S2 Ligand Having Carboxyl Groups Anti to the Oxo Group","Inorganic Chemistry","2000","39","","5731","5740","10.1021/ic000183q","","","0.71073","MoKα","","0.0369","0.0365","","0.0956","0.0951","","","","1.112","1.119","1.119","","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321621","13.728","0.008","13.655","0.001","18.077","0.006","90","","111.11","0.04","90","","3161","2","293","","293","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H50 Cl5 Co N8 O9 -","- C18 H50 Cl5 Co N8 O9 -","- C72 H200 Cl20 Co4 N32 O36 -","4","1","","Paul S. Donnelly; Jack M. Harrowfield; Brian W. Skelton; Allan H. White","Carboxymethylation of Cage Amines: Control of Alkylation by Metal Ion Coordination","Inorganic Chemistry","2000","39","","5817","5830","10.1021/ic000346a","","","0.71073","MoKα","","0.046","0.04","","0.045","","0.045","","","1.413","","","1.413","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4321622","17.937","0.002","10.278","0.003","10.058","0.004","115.99","0.03","103.4","0.02","92.05","0.01","1601.2","0.9","293","","293","","","","","","","","","7","P -1","-P 1","2","","","","- C18 H50 Cl Co N8 O17 S2 -","- C18 H50 Cl Co N8 O17 S2 -","- C36 H100 Cl2 Co2 N16 O34 S4 -","2","1","","Paul S. Donnelly; Jack M. Harrowfield; Brian W. Skelton; Allan H. White","Carboxymethylation of Cage Amines: Control of Alkylation by Metal Ion Coordination","Inorganic Chemistry","2000","39","","5817","5830","10.1021/ic000346a","","","0.71073","MoKα","","0.077","0.049","","0.056","","0.05","","","1.771","","","1.771","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4321623","8.742","0.001","12.73","0.002","14.034","0.002","76.294","0.002","79.011","0.002","70.788","0.002","1422","0.3","153","","153","","","","","","","","","6","P -1","-P 1","2","","","","- C18 H47 Cl3 Co N8 O8.5 -","- C18 H36 Cl3 Co N8 O8.5 -","- C36 H72 Cl6 Co2 N16 O17 -","2","1","","Paul S. Donnelly; Jack M. Harrowfield; Brian W. Skelton; Allan H. White","Carboxymethylation of Cage Amines: Control of Alkylation by Metal Ion Coordination","Inorganic Chemistry","2000","39","","5817","5830","10.1021/ic000346a","","","0.71073","MoKα","","0.098","0.082","","0.093","","0.086","","","1.875","","","1.916","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4321624","15.258","0.001","13.223","0.001","17.333","0.002","90","","114.785","0.001","90","","3174.9","0.5","293","","293","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H51 Cl Co N8 O15.5 -","- C18 H42 Cl Co N8 O15.5 -","- C72 H168 Cl4 Co4 N32 O62 -","4","1","","Paul S. Donnelly; Jack M. Harrowfield; Brian W. Skelton; Allan H. White","Carboxymethylation of Cage Amines: Control of Alkylation by Metal Ion Coordination","Inorganic Chemistry","2000","39","","5817","5830","10.1021/ic000346a","","","0.71073","MoKα","","0.059","0.048","","0.067","","0.066","","","2.175","","","2.385","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4321625","8.565","0.007","28.488","0.014","10.798","0.005","90","","91.84","0.06","90","","2633","3","293","","293","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H35 Cl Co N11 O13 -","- C16 H35 Cl Co N11 O13 -","- C64 H140 Cl4 Co4 N44 O52 -","4","1","","Paul S. Donnelly; Jack M. Harrowfield; Brian W. Skelton; Allan H. White","Carboxymethylation of Cage Amines: Control of Alkylation by Metal Ion Coordination","Inorganic Chemistry","2000","39","","5817","5830","10.1021/ic000346a","","","0.71073","MoKα","","0.054","0.049","","0.055","","0.054","","","1.943","","","2.02","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4321626","11.06","0.007","13.996","0.006","21.517","0.013","90","","102.14","0.05","90","","3256","3","293","","293","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C16 H47 Cl Co N8 O18.5 S4 -","- C16 H38 Cl Co N8 O18.5 S4 -","- C64 H152 Cl4 Co4 N32 O74 S16 -","4","1","","Paul S. Donnelly; Jack M. Harrowfield; Brian W. Skelton; Allan H. White","Carboxymethylation of Cage Amines: Control of Alkylation by Metal Ion Coordination","Inorganic Chemistry","2000","39","","5817","5830","10.1021/ic000346a","","","0.71073","MoKα","","0.098","0.072","","0.083","","0.079","","","1.593","","","2.07","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4321627","13.413","0.003","17.21","0.004","21.561","0.005","66.628","0.003","83.144","0.004","89.451","0.004","4532.1","1.8","150","","150","","","","","","","","","6","P -1","-P 1","2","","","","- C42 H134 Cl15 Co3 N24 O41 -","- C42 H132 Cl15 Co3 N24 O41 -","- C84 H264 Cl30 Co6 N48 O82 -","2","1","","Paul S. Donnelly; Jack M. Harrowfield; Brian W. Skelton; Allan H. White","Carboxymethylation of Cage Amines: Control of Alkylation by Metal Ion Coordination","Inorganic Chemistry","2000","39","","5817","5830","10.1021/ic000346a","","","0.71073","MoKα","","0.073","0.044","","0.052","","0.047","","","1.143","","","1.266","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4321628","15.529","0.003","11.075","0.005","20.422","0.003","90","","98.12","0.01","90","","3477","1.8","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H48 Cu N11 O19.5 -","- C22 H37 Cu N11 O19.5 -","- C88 H148 Cu4 N44 O78 -","4","1","","Paul S. Donnelly; Jack M. Harrowfield; Brian W. Skelton; Allan H. White","Carboxymethylation of Cage Amines: Control of Alkylation by Metal Ion Coordination","Inorganic Chemistry","2000","39","","5817","5830","10.1021/ic000346a","","","0.71073","MoKα","","0.078","0.058","","0.071","","0.071","","","1.714","","","1.714","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4321629","20.135","0.001","19.269","0.001","19.774","0.001","90","","97.742","0.001","90","","7602","0.7","293","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H47 Cl4 Cu N8 O25.5 -","- C22 H47 Cl4 Cu N8 O25.5 -","- C176 H376 Cl32 Cu8 N64 O204 -","8","2","","Paul S. Donnelly; Jack M. Harrowfield; Brian W. Skelton; Allan H. White","Carboxymethylation of Cage Amines: Control of Alkylation by Metal Ion Coordination","Inorganic Chemistry","2000","39","","5817","5830","10.1021/ic000346a","","","0.71073","MoKα","","0.096","0.055","","0.082","","0.057","","","4.462","","","3.954","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4321630","13.087","0.003","12.561","0.002","10.499","0.003","73.69","0.02","80.19","0.03","78.71","0.02","1612.1","0.7","293","","293","","","","","","","","","6","P -1","-P 1","2","","","","- C40 H96 Cl2 Cu2 N20 O31 -","- C40 H74 Cl2 Cu2 N20 O31 -","- C40 H74 Cl2 Cu2 N20 O31 -","1","0.5","","Paul S. Donnelly; Jack M. Harrowfield; Brian W. Skelton; Allan H. White","Carboxymethylation of Cage Amines: Control of Alkylation by Metal Ion Coordination","Inorganic Chemistry","2000","39","","5817","5830","10.1021/ic000346a","","","0.71073","MoKα","","0.07","0.058","","0.064","","0.064","","","1.614","","","1.675","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4321631","10.197","0.004","14.556","0.005","19.288","0.007","90","","100.81","0.007","90","","2812.1","1.8","293","","293","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H42 Cl2 Cu N8 O7.888 -","- C20 H42 Cl2 Cu N8 O7.888 -","- C80 H168 Cl8 Cu4 N32 O31.552 -","4","1","","Paul S. Donnelly; Jack M. Harrowfield; Brian W. Skelton; Allan H. White","Carboxymethylation of Cage Amines: Control of Alkylation by Metal Ion Coordination","Inorganic Chemistry","2000","39","","5817","5830","10.1021/ic000346a","","","0.71073","MoKα","","0.194","0.051","","0.063","","0.042","","","0.842","","","0.976","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4321632","43.505","0.004","10.441","0.001","13.711","0.001","90","","90","","90","","6228","0.9","293","","293","","","","","","","","","5","F d d 2","F 2 -2d","43","","","","- C18 H44 Cu N12 O18 -","- C18 H44 Cu N12 O18 -","- C144 H352 Cu8 N96 O144 -","8","0.5","","Paul S. Donnelly; Jack M. Harrowfield; Brian W. Skelton; Allan H. White","Carboxymethylation of Cage Amines: Control of Alkylation by Metal Ion Coordination","Inorganic Chemistry","2000","39","","5817","5830","10.1021/ic000346a","","","0.71073","MoKα","","0.085","0.05","","0.055","","0.048","","","1.553","","","1.702","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4321633","7.431","0.003","7.431","0.003","9.003","0.004","90","","90","","120","","430.5","0.3","293","2","293","2","","","","","","","synthetic","4","P 63 m c","P 6c -2c","186","","","","- As2 Cl2 Hg6 S8 -","- As2 Cl2 Hg6 S8 -","- As2 Cl2 Hg6 S8 -","1","0.0833333","","Johannes Beck; Sylvia Hedderich; Klaus Köllisch","Hg3AsE4X (E = S, Se; X = Cl, Br, I), a Family of Isotypic Compounds with an Acentric, Layered Structure","Inorganic Chemistry","2000","39","","5847","5850","10.1021/ic0003527","","","0.71073","MoKα","","0.0386","0.037","","0.0985","0.098","","","","1.079","1.118","1.118","","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321634","7.43","0.003","7.43","0.003","9.364","0.004","90","","90","","120","","447.7","0.3","293","2","293","2","","","","","","","synthetic","4","P 63 m c","P 6c -2c","186","","","","- As2 Br2 Hg6 S8 -","- As2 Br2 Hg6 S8 -","- As2 Br2 Hg6 S8 -","1","0.0833333","","Johannes Beck; Sylvia Hedderich; Klaus Köllisch","Hg3AsE4X (E = S, Se; X = Cl, Br, I), a Family of Isotypic Compounds with an Acentric, Layered Structure","Inorganic Chemistry","2000","39","","5847","5850","10.1021/ic0003527","","","0.71073","MoKα","","0.0314","0.0304","","0.0954","0.0948","","","","1.176","1.196","1.196","","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321635","7.707","0.008","7.707","","9.468","0.011","90","","90","","120","","487","0.8","293","2","293","2","","","","","","","synthetic","4","P 63 m c","P 6c -2c","186","","","","- As Br Hg3 Se4 -","- As Br Hg3 Se4 -","- As2 Br2 Hg6 Se8 -","2","0.166667","","Johannes Beck; Sylvia Hedderich; Klaus Köllisch","Hg3AsE4X (E = S, Se; X = Cl, Br, I), a Family of Isotypic Compounds with an Acentric, Layered Structure","Inorganic Chemistry","2000","39","","5847","5850","10.1021/ic0003527","","","0.71073","MoKα","","0.0433","0.0414","","0.1141","0.1094","","","","1.086","1.06","1.06","","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321636","7.6902","0.0007","7.6902","0.0007","9.9675","0.001","90","","90","","120","","510.5","0.08","293","2","293","2","","","","","","","synthetic","4","P 63 m c","P 6c -2c","186","","","","- As Hg3 I Se4 -","- As Hg3 I Se4 -","- As2 Hg6 I2 Se8 -","2","0.166667","","Johannes Beck; Sylvia Hedderich; Klaus Köllisch","Hg3AsE4X (E = S, Se; X = Cl, Br, I), a Family of Isotypic Compounds with an Acentric, Layered Structure","Inorganic Chemistry","2000","39","","5847","5850","10.1021/ic0003527","","","0.71073","MoKα","","0.0327","0.0317","","0.1052","0.1046","","","","1.435","1.45","1.45","","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321637","10.207","0.002","13.402","0.003","16.351","0.003","90.64","0.03","96.46","0.03","97.43","0.03","2203.1","0.8","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H37 Ag B11 Br5 Cl6 -","- C28 H36 Ag B11 Br5 Cl6 -","- C56 H72 Ag2 B22 Br10 Cl12 -","2","1","","Chi-Wing Tsang; Qingchuan Yang; Eric Tung-Po Sze; Thomas C. W. Mak; Dominic T. W. Chan; Zuowei Xie","Weakly Coordinating Nature of a Carborane Cage Bearing Different Halogen Atoms. Synthesis and Structural Characterization of Icosahedral Mixed Halocarborane Anions, 1-H-CB11Y5X6- (X, Y = Cl, Br, I)","Inorganic Chemistry","2000","39","","5851","5858","10.1021/ic000354r","","","0.71073","MoKα","","0.1268","0.0782","","","0.1572","0.1821","","","","","","1.111","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321638","16.709","0.007","12.168","0.006","18.138","0.013","90","","90.17","0.04","90","","3688","4","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C19 H25 Ag B11 Br6 Cl5 -","- C19 H25 Ag B11 Br6 Cl5 -","- C76 H100 Ag4 B44 Br24 Cl20 -","4","1","","Chi-Wing Tsang; Qingchuan Yang; Eric Tung-Po Sze; Thomas C. W. Mak; Dominic T. W. Chan; Zuowei Xie","Weakly Coordinating Nature of a Carborane Cage Bearing Different Halogen Atoms. Synthesis and Structural Characterization of Icosahedral Mixed Halocarborane Anions, 1-H-CB11Y5X6- (X, Y = Cl, Br, I)","Inorganic Chemistry","2000","39","","5851","5858","10.1021/ic000354r","","","0.71073","MoKα","","0.1727","0.0538","","","0.1234","0.1591","","","","","","0.907","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321639","12.86","0.0015","21.361","0.002","12.233","0.0016","90","","89.964","0.003","90","","3360.4","0.7","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H16 Ag B11 Br11 N -","- C12 H15 Ag B11 Br11 N -","- C48 H60 Ag4 B44 Br44 N4 -","4","1","","Chi-Wing Tsang; Qingchuan Yang; Eric Tung-Po Sze; Thomas C. W. Mak; Dominic T. W. Chan; Zuowei Xie","Weakly Coordinating Nature of a Carborane Cage Bearing Different Halogen Atoms. Synthesis and Structural Characterization of Icosahedral Mixed Halocarborane Anions, 1-H-CB11Y5X6- (X, Y = Cl, Br, I)","Inorganic Chemistry","2000","39","","5851","5858","10.1021/ic000354r","","","0.71073","MoKα","","0.123","0.078","","","0.1164","0.1306","","","","","","1.209","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321640","9.3794","0.0005","11.6817","0.0006","18.0382","0.0009","100.155","0.001","102.772","0.001","100.957","0.001","1842.5","0.17","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H26 Ag B11 Cl11 -","- C21 H26 Ag B11 Cl11 -","- C42 H52 Ag2 B22 Cl22 -","2","1","","Chi-Wing Tsang; Qingchuan Yang; Eric Tung-Po Sze; Thomas C. W. Mak; Dominic T. W. Chan; Zuowei Xie","Weakly Coordinating Nature of a Carborane Cage Bearing Different Halogen Atoms. Synthesis and Structural Characterization of Icosahedral Mixed Halocarborane Anions, 1-H-CB11Y5X6- (X, Y = Cl, Br, I)","Inorganic Chemistry","2000","39","","5851","5858","10.1021/ic000354r","","","0.71073","MoKα","","0.0499","0.0377","","","0.0959","0.1032","","","","","","1.048","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321641","12.4887","0.0014","12.4887","0.0014","12.4887","0.0014","90","","90","","90","","1947.8","0.4","296","2","296","2","","","","","","","","5","P a -3","-P 2ac 2ab 3","205","","","","- C2 H3 Ag B11 Cl11 -","- Ag B12.24 Cl11.28 -","- Ag4 B48.96 Cl45.12 -","4","0.166667","","Chi-Wing Tsang; Qingchuan Yang; Eric Tung-Po Sze; Thomas C. W. Mak; Dominic T. W. Chan; Zuowei Xie","Weakly Coordinating Nature of a Carborane Cage Bearing Different Halogen Atoms. Synthesis and Structural Characterization of Icosahedral Mixed Halocarborane Anions, 1-H-CB11Y5X6- (X, Y = Cl, Br, I)","Inorganic Chemistry","2000","39","","5851","5858","10.1021/ic000354r","","","0.71073","MoKα","","0.0776","0.0638","","","0.1699","0.1824","","","","","","1.095","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321642","19.736","0.016","11.319","0.004","13.804","0.005","90","","90","","90","","3084","3","296","2","296","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C5 H9 B11 Br5 Cs I6 O -","- C5 H9 B11 Br5 Cs I6 O -","- C20 H36 B44 Br20 Cs4 I24 O4 -","4","1","","Chi-Wing Tsang; Qingchuan Yang; Eric Tung-Po Sze; Thomas C. W. Mak; Dominic T. W. Chan; Zuowei Xie","Weakly Coordinating Nature of a Carborane Cage Bearing Different Halogen Atoms. Synthesis and Structural Characterization of Icosahedral Mixed Halocarborane Anions, 1-H-CB11Y5X6- (X, Y = Cl, Br, I)","Inorganic Chemistry","2000","39","","5851","5858","10.1021/ic000354r","","","0.71073","MoKα","","0.0614","0.0389","","","0.0859","0.0941","","","","","","1.023","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321643","12.236","0.002","16.843","0.003","18.064","0.004","62.98","0.03","81.45","0.03","80.92","0.03","3262.4","1.4","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C7 H23 B11 Br6 Cl6 N2 O -","- C7 H23 B11 Br6 Cl6 N2 O -","- C28 H92 B44 Br24 Cl24 N8 O4 -","4","2","","Chi-Wing Tsang; Qingchuan Yang; Eric Tung-Po Sze; Thomas C. W. Mak; Dominic T. W. Chan; Zuowei Xie","Weakly Coordinating Nature of a Carborane Cage Bearing Different Halogen Atoms. Synthesis and Structural Characterization of Icosahedral Mixed Halocarborane Anions, 1-H-CB11Y5X6- (X, Y = Cl, Br, I)","Inorganic Chemistry","2000","39","","5851","5858","10.1021/ic000354r","","","0.71073","MoKα","","0.157","0.0558","","","0.1483","0.1839","","","","","","0.963","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321644","9.41","0.004","11.047","0.006","15.875","0.008","92.16","0.03","101.64","0.03","98.21","0.03","1596","1.4","273.2","","273.2","","","","","","","","","6","P -1","-P 1","2","","","","- C21 H41 Cr2 N6 Na O18 -","- C21 H29 Cr2 N6 Na O18 -","- C42 H58 Cr4 N12 Na2 O36 -","2","1","","Narumi Sakagami-Yoshida; Masahiro Teramoto; Ayako Hioki; Akira Fuyuhiro; Sumio Kaizaki","Anomalous Stereochemistry of Pyrazolato-3,5-dicarboxylato-Bridged Dinuclear Chromate(III) Complexes Containing Ethylenediamine-N,N'-dicarboxylates with Entrapped Unstable Conformations: X-ray Structure of Na[Cr~2~(eddp)~2~(μ-pzdc)]6H~2~O","Inorganic Chemistry","2000","39","","5717","5724","10.1021/ic000361f","","","0.7107","MoKα","","","0.0722","","","0.0636","","","","","","","1.391","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321645","18.6643","0.0019","6.9289","0.0008","6.5958","0.0009","90","","104.917","0.009","90","","824.24","0.17","298","2","298","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C2 H12 F6 Fe O12 S2 -","- C2 H12 F6 Fe O12 S2 -","- C4 H24 F12 Fe2 O24 S4 -","2","0.25","","Karl S. Hagen","Iron(II) Triflate Salts as Convenient Substitutes for Perchlorate Salts: Crystal Structures of [Fe(H2O)6](CF3SO3)2 and Fe(MeCN)4(CF3SO3)2","Inorganic Chemistry","2000","39","","5867","5869","10.1021/ic000444w","","","0.71073","MoKα","","0.0492","0.0395","","","0.104","0.1106","","","","","","1.047","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321646","6.7333","0.001","8.5229","0.0012","8.948","0.0013","84.858","0.013","86.042","0.012","80.12","0.012","503.1","0.13","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C10 H12 F6 Fe N4 O6 S2 -","- C10 H12 F6 Fe N4 O6 S2 -","- C10 H12 F6 Fe N4 O6 S2 -","1","0.5","","Karl S. Hagen","Iron(II) Triflate Salts as Convenient Substitutes for Perchlorate Salts: Crystal Structures of [Fe(H2O)6](CF3SO3)2 and Fe(MeCN)4(CF3SO3)2","Inorganic Chemistry","2000","39","","5867","5869","10.1021/ic000444w","","","0.71073","MoKα","","0.0311","0.0285","","","0.0745","0.0764","","","","","","1.041","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321647","9.837","0.002","11.168","0.004","15.462","0.004","86.36","0.02","89.46","0.02","85.86","0.02","1690.8","0.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H20 N O3 P -","- C18 H20 N O3 P -","- C72 H80 N4 O12 P4 -","4","2","","A. Chandrasekaran; Roberta O. Day; Robert R. Holmes","Synthesis and Structure of Cyclic Phosphate, Phosphoramidate, Phosphonates, and Phosphonium Salts. Phosphatrane Formation1","Inorganic Chemistry","2000","39","","5683","5689","10.1021/ic000467a","","","0.71073","MoKα","","0.0802","0.0377","","0.1262","0.0989","","","","1.047","1.096","1.096","","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321648","30.412","0.007","13.246","0.003","14.628","0.003","90","","89.69","0.02","90","","5893","2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C33 H36 N O5 P -","- C33 H36 N O5 P -","- C264 H288 N8 O40 P8 -","8","1","","A. Chandrasekaran; Roberta O. Day; Robert R. Holmes","Synthesis and Structure of Cyclic Phosphate, Phosphoramidate, Phosphonates, and Phosphonium Salts. Phosphatrane Formation1","Inorganic Chemistry","2000","39","","5683","5689","10.1021/ic000467a","","","0.71073","MoKα","","0.1004","0.0472","","0.1421","0.1087","","","","1.018","1.072","1.072","","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4321649","14.174","0.004","14.377","0.004","19.005","0.005","96.27","0.02","94.06","0.02","106","0.02","3679.8","1.8","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C35 H41 Cl2 I N O4 P -","- C36.25 Cl1.375 I N O4 P -","- C145 Cl5.5 I4 N4 O16 P4 -","4","2","","A. Chandrasekaran; Roberta O. Day; Robert R. Holmes","Synthesis and Structure of Cyclic Phosphate, Phosphoramidate, Phosphonates, and Phosphonium Salts. Phosphatrane Formation1","Inorganic Chemistry","2000","39","","5683","5689","10.1021/ic000467a","","","0.71073","MoKα","","0.2103","0.1558","","0.457","0.4294","","","","3.576","4.095","4.095","","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321650","14.515","0.005","20.625","0.006","24.177","0.008","90","","93.44","0.03","90","","7225","4","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C30.5 H36.5 Cl2 I3 N O3.25 P -","- C30.5 H33 Cl2 I3 N O3.25 P -","- C244 H264 Cl16 I24 N8 O26 P8 -","8","2","","A. Chandrasekaran; Roberta O. Day; Robert R. Holmes","Synthesis and Structure of Cyclic Phosphate, Phosphoramidate, Phosphonates, and Phosphonium Salts. Phosphatrane Formation1","Inorganic Chemistry","2000","39","","5683","5689","10.1021/ic000467a","","","0.71073","MoKα","","0.1758","0.0911","","0.4028","0.2585","","","","1.084","1.211","1.211","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321651","9.935","0.002","26.418","0.007","10.365","0.003","90","","109.46","0.02","90","","2565","1.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H34 N O4 P -","- C28 H34 N O4 P -","- C112 H136 N4 O16 P4 -","4","1","","A. Chandrasekaran; Roberta O. Day; Robert R. Holmes","Synthesis and Structure of Cyclic Phosphate, Phosphoramidate, Phosphonates, and Phosphonium Salts. Phosphatrane Formation1","Inorganic Chemistry","2000","39","","5683","5689","10.1021/ic000467a","","","0.71073","MoKα","","0.0941","0.051","","0.2988","0.1398","","","","1.064","1.09","1.09","","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4321652","14.998","0.004","8.487","0.002","25.352","0.006","90","","102.55","0.02","90","","3149.9","1.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C31 H42 N O4 P Si -","- C31 H42 N O4 P Si -","- C124 H168 N4 O16 P4 Si4 -","4","1","","A. Chandrasekaran; Roberta O. Day; Robert R. Holmes","Synthesis and Structure of Cyclic Phosphate, Phosphoramidate, Phosphonates, and Phosphonium Salts. Phosphatrane Formation1","Inorganic Chemistry","2000","39","","5683","5689","10.1021/ic000467a","","","0.71073","MoKα","","0.0754","0.0421","","0.1394","0.1126","","","","1.031","1.07","1.07","","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4321653","11.311","0.002","19.135","0.002","15.443","0.002","90","","90","","90","","3342.4","0.8","293","2","293","2","","","","","","","","9","P n a 21","P 2c -2n","33","","","","- C22 H39 B Cl3 N8 O2 P2 Re Si -","- C22 H39 B Cl3 N8 O2 P2 Re Si -","- C88 H156 B4 Cl12 N32 O8 P8 Re4 Si4 -","4","1","","António Paulo; Ângela Domingos; Raquel Garcia; Isabel Santos","Cationic Re(V) Oxo Complexes with Poly(pyrazolyl)borates: Synthesis, Characterization, and Stability","Inorganic Chemistry","2000","39","","5669","5674","10.1021/ic000481n","","","0.71069","MoKα","","0.0645","0.046","","0.1242","0.1022","","","","1.103","1.047","1.047","","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321654","8.7179","0.0011","12.5724","0.0008","17.75","0.002","70.454","0.007","77.935","0.009","77.129","0.008","1768.1","0.3","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C26 H39 B Cl N10 O3 Re Si -","- C26 H31 B Cl N10 O3 Re Si -","- C52 H62 B2 Cl2 N20 O6 Re2 Si2 -","2","1","","António Paulo; Ângela Domingos; Raquel Garcia; Isabel Santos","Cationic Re(V) Oxo Complexes with Poly(pyrazolyl)borates: Synthesis, Characterization, and Stability","Inorganic Chemistry","2000","39","","5669","5674","10.1021/ic000481n","","","0.71073","MoKα","","0.0577","0.0425","","0.1197","0.1011","","","","1.089","1.096","1.096","","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321655","16.356","0.002","20.384","0.003","17.36","0.003","90","","106.971","0.012","90","","5535.8","1.5","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C19 H27 B Cl N10 O2 Re Si -","- C19 H27 B Cl N10 O2 Re Si -","- C152 H216 B8 Cl8 N80 O16 Re8 Si8 -","8","2","","António Paulo; Ângela Domingos; Raquel Garcia; Isabel Santos","Cationic Re(V) Oxo Complexes with Poly(pyrazolyl)borates: Synthesis, Characterization, and Stability","Inorganic Chemistry","2000","39","","5669","5674","10.1021/ic000481n","","","0.71073","MoKα","","0.2158","0.0852","","0.1594","0.0972","","","","1.079","1.201","1.201","","","","","has coordinates,has disorder","179319","2020-10-21","18:00:00",""
"4321656","8.366","0.003","15.549","0.003","20.283","0.002","90","","98.73","0.02","90","","2607.9","1.1","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H29 Cu F12 N5 P2 -","- C18 H29 Cu F12 N5 P2 -","- C72 H116 Cu4 F48 N20 P8 -","4","1","","Hassan Keypour; Sadegh Salehzadeh; Robin G. Pritchard; R. V. Parish","Synthesis and Crystal Structure Determination of Some Asymmetrical and Symmetrical CR-Type Macrocyclic Schiff Base Complexes, with a Single Pendant Coordinating 2-Aminoethyl Arm","Inorganic Chemistry","2000","39","","5787","5790","10.1021/ic000511m","","","1.54178","CuKα","","0.18","0.0621","","","0.1615","0.214","","","","","","1.025","","","","has coordinates,has disorder","179319","2020-10-21","18:00:00",""
"4321657","7.8764","0.001","15.361","0.002","19.37","0.002","90","","100.33","0.01","90","","2305.6","0.5","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C17 H27 Cl2 Cu N5 O8 -","- C17 H27 Cl2 Cu N5 O8 -","- C68 H108 Cl8 Cu4 N20 O32 -","4","1","","Hassan Keypour; Sadegh Salehzadeh; Robin G. Pritchard; R. V. Parish","Synthesis and Crystal Structure Determination of Some Asymmetrical and Symmetrical CR-Type Macrocyclic Schiff Base Complexes, with a Single Pendant Coordinating 2-Aminoethyl Arm","Inorganic Chemistry","2000","39","","5787","5790","10.1021/ic000511m","","","1.54178","CuKα","","0.1474","0.0537","","","0.1397","0.1859","","","","","","0.996","","","","has coordinates,has disorder","179319","2020-10-21","18:00:00",""
"4321658","7.9871","0.001","18.882","0.003","15.185","0.003","90","","96.4","0.02","90","","2275.8","0.6","203","2","203","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C17 H27 Cl2 Cu N5 O8 -","- C17 H27 Cl2 Cu N5 O8 -","- C68 H108 Cl8 Cu4 N20 O32 -","4","1","","Hassan Keypour; Sadegh Salehzadeh; Robin G. Pritchard; R. V. Parish","Synthesis and Crystal Structure Determination of Some Asymmetrical and Symmetrical CR-Type Macrocyclic Schiff Base Complexes, with a Single Pendant Coordinating 2-Aminoethyl Arm","Inorganic Chemistry","2000","39","","5787","5790","10.1021/ic000511m","","","0.71073","MoKα","","0.1426","0.0773","","","0.1635","0.1944","","","","","","0.998","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321659","10.097","0.006","15.74","0.002","18.151","0.005","90","","105.74","0.03","90","","2776.5","1.9","233","","233","","","","","","","","see paper","6","P 1 21/c 1","-P 2ybc","14","Compound 6","","","- C26 H46 B2 Mg N2 O2 -","- C26 H46 B2 Mg N2 O2 -","- C104 H184 B8 Mg4 N8 O8 -","4","1","","Xiaolai Zheng; Ulli Englert; Gerhard E. Herberich; Jörg Rosenplänter","Syntheses and Structures of Mg(C5H5BMe)2, Mg(3,5-Me2C5H3BNMe2)2, the 2,2'-Bipyridine Adduct Mg(C5H5BMe)2(bipy), and the N-Bonded Aminoboratabenzene Species Mg(3,5-Me2C5H3BNMe2)2(THF)21","Inorganic Chemistry","2000","39","","5579","5585","10.1021/ic000575x","","","0.71073","Mo-Kα","","","0.093","","","0.069","","","","","1.369","1.369","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321660","6.7311","0.0007","8.363","0.002","11.622","0.002","90","","103.8","0.01","90","","635.3","0.2","203","","203","","","","","","","","see_paper","4","P 1 21/c 1","-P 2ybc","14","Compound 1","","","- C12 H16 B2 Mg -","- C12 H16 B2 Mg -","- C24 H32 B4 Mg2 -","2","0.5","","Xiaolai Zheng; Ulli Englert; Gerhard E. Herberich; Jörg Rosenplänter","Syntheses and Structures of Mg(C5H5BMe)2, Mg(3,5-Me2C5H3BNMe2)2, the 2,2'-Bipyridine Adduct Mg(C5H5BMe)2(bipy), and the N-Bonded Aminoboratabenzene Species Mg(3,5-Me2C5H3BNMe2)2(THF)21","Inorganic Chemistry","2000","39","","5579","5585","10.1021/ic000575x","","","0.71073","Mo-Kα","","","0.051","","","0.051","","","","","1.082","1.082","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321661","8.065","0.002","10.884","0.003","11.606","0.003","90","","101.81","0.02","90","","997.2","0.5","193","","193","","","","","","","","see paper","5","P 1 21/n 1","-P 2yn","14","Compound 2","","","- C18 H30 B2 Mg N2 -","- C18 H30 B2 Mg N2 -","- C36 H60 B4 Mg2 N4 -","2","0.5","","Xiaolai Zheng; Ulli Englert; Gerhard E. Herberich; Jörg Rosenplänter","Syntheses and Structures of Mg(C5H5BMe)2, Mg(3,5-Me2C5H3BNMe2)2, the 2,2'-Bipyridine Adduct Mg(C5H5BMe)2(bipy), and the N-Bonded Aminoboratabenzene Species Mg(3,5-Me2C5H3BNMe2)2(THF)21","Inorganic Chemistry","2000","39","","5579","5585","10.1021/ic000575x","","","1.54184","Cu-Kα","","","0.059","","","0.058","","","","","1.009","1.009","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321662","10.4664","0.0009","13.776","0.002","14.236","0.002","90","","98.962","0.009","90","","2027.6","0.4","228","","228","","","","","","","","see paper","5","P 1 21/n 1","-P 2yn","14","Compound 5","","","- C22 H24 B2 Mg N2 -","- C28 H32 B3 Mg N2 -","- C112 H128 B12 Mg4 N8 -","4","1","","Xiaolai Zheng; Ulli Englert; Gerhard E. Herberich; Jörg Rosenplänter","Syntheses and Structures of Mg(C5H5BMe)2, Mg(3,5-Me2C5H3BNMe2)2, the 2,2'-Bipyridine Adduct Mg(C5H5BMe)2(bipy), and the N-Bonded Aminoboratabenzene Species Mg(3,5-Me2C5H3BNMe2)2(THF)21","Inorganic Chemistry","2000","39","","5579","5585","10.1021/ic000575x","","","1.54184","Cu-Kα","","","0.064","","","0.068","","","","","1.413","1.413","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321663","12.264","0.003","9.2147","0.0018","15.339","0.003","90","","90.5","0.03","90","","1733.4","0.6","90","2","90","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C6 H20 F6 N8 O6 Ru Si -","- C6 H20 F6 N8 O6 Ru Si -","- C24 H80 F24 N32 O24 Ru4 Si4 -","4","1","","Christopher Kim; Irina Novozhilova; M. Scott Goodman; Kimberly A. Bagley; Philip Coppens","On the Photochemical Behavior of the [Ru(NH3)4(NO)nicotinamide]3+ Cation and the Relative Stability of Light-Induced Metastable Isonitrosyl Isomers of Ru Complexes","Inorganic Chemistry","2000","39","","5791","5795","10.1021/ic000583d","","","0.71073","MoKα","","0.0289","0.0254","","","0.0619","0.0638","","","","","","1.007","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321664","13.9735","0.001","11.9079","0.0004","8.4183","0.0005","90","","90","","90","","1400.76","0.14","293","2","293","2","","","","","","","synthesis by authors","5","C m c 21","C 2c -2","36","","","","- C10 H17 Cl4 Mo O -","- C10 H17 Cl4 Mo O -","- C40 H68 Cl16 Mo4 O4 -","4","0.5","","P. Schollhammer; F. Y. Pétillon; J. Talarmin; K. W. Muir; H. K. Fun; K. Chinnakali","Halogenation and Alkylation at a MoIII2(μ-S) Site. Crystal Structure of the Metal-Sulfenyl Halide Complex [Mo2(η5-C5Me5)2(μ-SMe)2(μ-SI)(CO)2]I5","Inorganic Chemistry","2000","39","","5879","5882","10.1021/ic000591u","","","0.71073","MoKα","","0.0422","0.0334","","0.0837","0.0788","","","","1.003","0.995","0.995","","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321665","17.7079","0.0003","14.4213","0.0002","14.5978","0.0002","90","","90","","90","","3727.85","0.1","293","2","293","2","","","","","","","synthesis by authors","6","P n n m","-P 2 2n","58","","","","- C24 H36 I6 Mo2 O2 S3 -","- C24 H36 I6 Mo2 O2 S3 -","- C96 H144 I24 Mo8 O8 S12 -","4","0.5","","P. Schollhammer; F. Y. Pétillon; J. Talarmin; K. W. Muir; H. K. Fun; K. Chinnakali","Halogenation and Alkylation at a MoIII2(μ-S) Site. Crystal Structure of the Metal-Sulfenyl Halide Complex [Mo2(η5-C5Me5)2(μ-SMe)2(μ-SI)(CO)2]I5","Inorganic Chemistry","2000","39","","5879","5882","10.1021/ic000591u","","","0.71073","MoKα","","0.0831","0.052","","0.1378","0.1141","","","","1.062","1.097","1.097","","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321666","8.824","0.001","16.674","0.001","16.836","0.001","104.453","0.001","92.752","0.001","90.983","0.001","2394.9","0.3","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C59 H44 Cl2 Co N4 O8 -","- C59 H44 Cl2 Co N4 O8 -","- C118 H88 Cl4 Co2 N8 O16 -","2","1","","Paul G. Jene; James A. Ibers","Syntheses and Structural Characterization of the (OCnOPor) Capped Porphyrins: Co(OC2OPor).CH2Cl2, Co(OC2OPor)(NO)out.0.46CHCl3, Co(OC3OPor).CHCl3, and Co(OC3OPor)(MeIm).3C7H8","Inorganic Chemistry","2000","39","","5796","5802","10.1021/ic0006753","","","0.71073","MoKα","","0.0463","0.041","","","0.111","0.113","","","","","","1.89","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321667","9.019","0.001","16.588","0.002","16.909","0.002","103.923","0.002","92.082","0.002","93.583","0.002","2447.1","0.5","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C58.47 H42.47 Cl1.4 Co N5 O9 -","- C58.464 H42.464 Cl1.392 Co N5 O9 -","- C116.928 H84.928 Cl2.784 Co2 N10 O18 -","2","1","","Paul G. Jene; James A. Ibers","Syntheses and Structural Characterization of the (OCnOPor) Capped Porphyrins: Co(OC2OPor).CH2Cl2, Co(OC2OPor)(NO)out.0.46CHCl3, Co(OC3OPor).CHCl3, and Co(OC3OPor)(MeIm).3C7H8","Inorganic Chemistry","2000","39","","5796","5802","10.1021/ic0006753","","","0.71073","MoKα","","0.1152","0.082","","","0.183","0.196","","","","","","1.38","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321668","13.484","0.003","14.404","0.003","14.57","0.003","105.508","0.003","100.678","0.003","93.509","0.004","2661.2","1","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C63 H51 Cl3 Co N4 O8 -","- C63 H51 Cl3 Co N4 O8 -","- C126 H102 Cl6 Co2 N8 O16 -","2","1","","Paul G. Jene; James A. Ibers","Syntheses and Structural Characterization of the (OCnOPor) Capped Porphyrins: Co(OC2OPor).CH2Cl2, Co(OC2OPor)(NO)out.0.46CHCl3, Co(OC3OPor).CHCl3, and Co(OC3OPor)(MeIm).3C7H8","Inorganic Chemistry","2000","39","","5796","5802","10.1021/ic0006753","","","0.71073","MoKα","","0.1584","0.069","","","0.127","0.145","","","","","","1.14","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321669","16.49","0.001","22.324","0.002","17.257","0.001","90","","92.437","0.001","90","","6346.9","0.8","153","2","153","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C87 H80 Co N6 O8 -","- C73 H64 Co N6 O8 -","- C292 H256 Co4 N24 O32 -","4","1","","Paul G. Jene; James A. Ibers","Syntheses and Structural Characterization of the (OCnOPor) Capped Porphyrins: Co(OC2OPor).CH2Cl2, Co(OC2OPor)(NO)out.0.46CHCl3, Co(OC3OPor).CHCl3, and Co(OC3OPor)(MeIm).3C7H8","Inorganic Chemistry","2000","39","","5796","5802","10.1021/ic0006753","","","0.71073","MoKα","","0.1215","0.082","","","0.151","0.16","","","","","","1.71","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321670","7.997","0.001","10.297","0.002","18.55","0.002","105.46","0.01","93.23","0.01","97.25","0.01","1454","0.4","301.2","","301.2","","","","","","","","","7","P -1","-P 1","2","","","","- C26 H22 Cl2 N2 O4 S2 Zn2 -","- C26 H22 Cl2 N2 O4 S2 Zn2 -","- C52 H44 Cl4 N4 O8 S4 Zn4 -","2","1","","Vivian Wing-Wah Yam; Yung-Lin Pui; Kung-Kai Cheung","Synthesis, Emission, and Electrochemical Properties of Luminescent Dinuclear Zinc(II) Chalcogenolate Complexes. Dynamic 1H NMR Studies and X-ray Crystal Structure of [(bpy)Zn2(SC6H4-Cl-p)(μ-SC6H4-Cl-p)(μ-OAc)2]","Inorganic Chemistry","2000","39","","5741","5746","10.1021/ic000688g","","","0.7107","MoKalpha","","","0.0326","","","0.0463","","","","","1.683","1.683","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321671","8.57","0.005","9.135","0.005","11.871","0.005","67.555","0.005","88.81","0.005","63.899","0.005","759.1","0.7","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H14 F12 N4 O8 Rh2 -","- C24 H14 F12 N4 O8 Rh2 -","- C24 H14 F12 N4 O8 Rh2 -","1","0.5","","Hitoshi Miyasaka; Cristian S. Campos-Fernández; José Ramón Galán-Mascarós; Kim R. Dunbar","One-Dimensional Assemblies of Dirhodium Units Bridged by N,N'-Dicyanoquinonediimine Ligands","Inorganic Chemistry","2000","39","","5870","5873","10.1021/ic0007097","","","0.71069","MoKα","","0.1161","0.0558","","","0.1312","0.1646","","","","","","0.991","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321672","8.534","0.002","8.427","0.002","22.693","0.005","90","","96.92","0.03","90","","1620.1","0.7","90","2","90","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C27 H14 F12 N4 O8 Rh2 -","- C27 H11 F12 N4 O8 Rh2 -","- C54 H22 F24 N8 O16 Rh4 -","2","0.5","","Hitoshi Miyasaka; Cristian S. Campos-Fernández; José Ramón Galán-Mascarós; Kim R. Dunbar","One-Dimensional Assemblies of Dirhodium Units Bridged by N,N'-Dicyanoquinonediimine Ligands","Inorganic Chemistry","2000","39","","5870","5873","10.1021/ic0007097","","","0.71069","MoKα","","0.0345","0.0288","","","0.0711","0.0742","","","","","","1.015","","","","has coordinates,has disorder","179319","2020-10-21","18:00:00",""
"4321673","10.507","0.002","12.596","0.001","15.339","0.002","81.21","0.01","80.64","0.01","81.52","0.01","1963.8","0.5","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","Trans(C,N7),trans(S,S),trans(P,N7)-(eta1-phenyl)bis (N7,S6-purine-6-thione)(triphenylphosphine)rhodium(III)- trans(C,N7),trans(S,S),trans(P,N7)-(eta1-phenyl) (N7,S6-purine-6-thione)(N7,S6-purine-6-thione(-H1)) (triphenylphosphine)rhodium(III) trichloride hydrogenchloride solvate hexahydrate","","- C68 H68 Cl4 N16 O6 P2 Rh2 S4 -","- C68 H55 Cl4 N16 O6 P2 Rh2 S4 -","- C68 H55 Cl4 N16 O6 P2 Rh2 S4 -","1","0.5","","Renzo Cini; Maddalena Corsini; Alessandro Cavaglioni","Supramolecular Aggregates of Complex Cations via Unusual Purine-Purine Base Pairing in a New Organorhodium(III) Compound Containing the Antileukemic Drug Purine-6-thione. Synthesis, X-ray Structure of trans(C,N7), trans(S,S), trans(P,N7)-[Rh(C6H5)(H1,H9- H2tp)2(PPh3)][Rh(C6H5)(H1,H9-H2tp)(H9- Htp)(PPh3)]Cl3.HCl.6H2O, and Density Functional Analysis of the {H2tp...Htp}-Base Pair","Inorganic Chemistry","2000","39","","5874","5878","10.1021/ic000814g","","","0.71073","MoKα","","0.0841","0.0496","","","0.1097","0.1239","","","","","","1.031","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321674","14.986","0.002","13.396","0.002","16.351","0.002","90","","108.12","0.01","90","","3119.7","0.8","213.2","","213.2","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- As2 F12 S8 -","- As2 F12 S8 -","- As16 F96 S64 -","8","2","","T. Stanley Cameron; Robert J. Deeth; Isabelle Dionne; Hongbin Du; H. Donald B. Jenkins; Ingo Krossing; Jack Passmore; Helen K. Roobottom","Bonding, Structure, and Energetics of Gaseous E82+ and of Solid E8(AsF6)2 (E = S, Se)","Inorganic Chemistry","2000","39","","5614","5631","10.1021/ic990760e","","","0.7107","MoKα","","0.0292","0.029","","0.03","","0.03","","","1.386","","","1.39","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321675","14.1418","0.0014","16.9976","0.0017","18.2308","0.0018","90","","108.337","0.002","90","","4159.7","0.7","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C13 H34 Fe O P4 S -","- C13 H34 Fe O P4 S -","- C104 H272 Fe8 O8 P32 S8 -","8","2","","Leslie D. Field; Eric T. Lawrenz; Warren J. Shaw; Peter Turner","Insertion of CO2, CS2, and COS into Iron(II)-Hydride Bonds","Inorganic Chemistry","2000","39","","5632","5638","10.1021/ic991399z","","","0.71073","MoKα","","0.0744","0.0458","","","0.0982","0.1118","","","","","","1.089","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321676","17.385","0.004","18.104","0.005","20.073","0.005","68.2","0.01","78.21","0.01","70.81","0.01","5516","2","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C86 H32 F72 O Pb5 S8 -","- C86 H32 F72 O Pb5 S8 -","- C172 H64 F144 O2 Pb10 S16 -","2","1","","Frank T. Edelmann; Jan-Karel F. Buijink; Sally A. Brooker; Regine Herbst-Irmer; Ulrike Kilimann; Frank M. Bohnen","Formation and Structure of the Oxygen-Centered Lead Thiolate Cluster Pb5O(SRF)8.2C7H8 [RF= 2,4,6-Tris(trifluoromethyl)phenyl]","Inorganic Chemistry","2000","39","","6134","6135","10.1021/ic000219e","","","0.71073","MoKα","","0.0848","0.0453","","","0.0802","0.0957","","","","","","1.063","","","","has coordinates,has disorder","179319","2020-10-21","18:00:00",""
"4321677","9.572","0.003","5.802","0.003","9.563","0.005","90","","111.62","0.03","90","","493.7","0.4","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","alpha-Tricalcium nitrido dialuminate","","","- Al2 Ca3 N4 -","- Al2 Ca3 N4 -","- Al8 Ca12 N16 -","4","1","","M. Ludwig; J. Jäger; R. Niewa; R. Kniep","Crystal Structures of Two Polymorphs of Ca3[Al2N4]","Inorganic Chemistry","2000","39","","5909","5911","10.1021/ic0002869","","","0.71073","MoKα","","0.0841","0.0835","","","0.2048","0.205","","","","","","1.418","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321678","5.826","0.003","10.691","0.004","15.854","0.005","90","","90","","90","","987.5","0.7","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","beta-Tricalcium nitrido dialuminate","","","- Al2 Ca3 N4 -","- Al2 Ca3 N4 -","- Al16 Ca24 N32 -","8","2","","M. Ludwig; J. Jäger; R. Niewa; R. Kniep","Crystal Structures of Two Polymorphs of Ca3[Al2N4]","Inorganic Chemistry","2000","39","","5909","5911","10.1021/ic0002869","","","0.71073","MoKα","","0.1412","0.0783","","","0.1677","0.221","","","","","","1.228","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321679","10.606","0.002","8.26","0.002","5.517","0.001","90","","92.1","0.1","90","","483","0.17","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","gamma-Tricalcium nitrido dialuminate","","","- Al2 Ca3 N4 -","- Al4 Ca6 N8 -","- Al8 Ca12 N16 -","2","0.25","","M. Ludwig; J. Jäger; R. Niewa; R. Kniep","Crystal Structures of Two Polymorphs of Ca3[Al2N4]","Inorganic Chemistry","2000","39","","5909","5911","10.1021/ic0002869","","","0.71073","MoKα","","0.082","0.0677","","","0.1465","0.1594","","","","","","1.279","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321680","10.345","0.002","11.306","0.001","18.083","0.002","90","","98.93","0.02","90","","2089.4","0.5","293","2","293","2","","","","","","","?","7","P 1 21/n 1","-P 2yn","14","","(SP-4-3)-chloro(trans-cyclohexane-1,2-diamine-N,N')(dimethylsulfoxyde-S) platinum(II) trichloro(dimethylsulfoxyde-S)platinate","","- C10 H26 Cl4 N2 O2 Pt2 S2 -","- C10 H26 Cl4 N2 O2 Pt2 S2 -","- C40 H104 Cl16 N8 O8 Pt8 S8 -","4","1","","Sandrine Ongeri; David J. Aitken; Henri-Philippe Husson; Jiří Kozelka; Bernard Viossat","Effect of Ring Size on Coordination Properties of trans-1,2-Cycloalkanediamine Ligands: Synthesis of Dinuclear Platinum(II) Complexes as Potential DNA Cross-Linkers","Inorganic Chemistry","2000","39","","6131","6133","10.1021/ic000334p","","","0.71073","MoKα","","","0.0382","","","0.0395","","","","","1.011","1.011","","","","","has coordinates","190534","2020-10-21","18:00:00",""
"4321681","8.443","0.002","14.278","0.001","7.4451","0.0012","90.561","0.009","97.64","0.02","104.25","0.009","861.3","0.3","294.2","","294.2","","","","","","","","","5","P -1","-P 1","2","","","","- C18 H14 Hg N4 S2 -","- C18 H14 Hg N4 S2 -","- C36 H28 Hg2 N8 S4 -","2","1","","Christian Brückner; Stephen J. Rettig; David Dolphin","2-Pyrrolylthiones as Monoanionic Bidentate N,S-Chelators: Synthesis and Molecular Structure of 2-Pyrrolylthionato Complexes of Nickel(II), Cobalt(III), and Mercury(II)","Inorganic Chemistry","2000","39","","6100","6106","10.1021/ic0004636","","","0.7107","MoKα","","","0.0416","","","","0.0404","","","","","","2.395","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321682","18.4666","0.0011","18.4666","0.0011","26.404","0.002","90","","90","","120","","7797.8","0.9","294.2","","294.2","","","","","","","","","6","R -3 :H","-R 3","148","","","","- C18 H14.57 N4 Ni O0.28 S2 -","- C18 H14 N4 Ni O0.0943333 S2 -","- C324 H252 N72 Ni18 O1.698 S36 -","18","1","","Christian Brückner; Stephen J. Rettig; David Dolphin","2-Pyrrolylthiones as Monoanionic Bidentate N,S-Chelators: Synthesis and Molecular Structure of 2-Pyrrolylthionato Complexes of Nickel(II), Cobalt(III), and Mercury(II)","Inorganic Chemistry","2000","39","","6100","6106","10.1021/ic0004636","","","1.5418","CuKα","","","0.032","","","","0.033","","","","","","1.78","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321683","9.5691","0.0014","23.152","0.0012","13.6589","0.0011","90","","100.882","0.008","90","","2971.6","0.5","294.2","","294.2","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C30 H27 Co N6 O S3 -","- C30 H27 Co N6 O S3 -","- C120 H108 Co4 N24 O4 S12 -","4","1","","Christian Brückner; Stephen J. Rettig; David Dolphin","2-Pyrrolylthiones as Monoanionic Bidentate N,S-Chelators: Synthesis and Molecular Structure of 2-Pyrrolylthionato Complexes of Nickel(II), Cobalt(III), and Mercury(II)","Inorganic Chemistry","2000","39","","6100","6106","10.1021/ic0004636","","","0.7107","MoKα","","","0.043","","","","0.038","","","","","","2.42","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321684","9.8242","0.0016","11.9736","0.0019","14.633","0.002","86.206","0.019","75.954","0.019","77.966","0.019","1632.9","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","neodymium butyrate monohydrate","neodymium butanoate monohydrate","","- C24 H42 Nd2 O14 -","- C24 H42 Nd2 O14 -","- C48 H84 Nd4 O28 -","2","1","","Koen Binnemans; Liesbet Jongen; Claudia Bromant; Dirk Hinz; Gerd Meyer","Structure and Mesomorphism of Neodymium(III) Alkanoates","Inorganic Chemistry","2000","39","","5938","5945","10.1021/ic000470u","","","0.71073","MoKα","","0.1063","0.0879","","","0.2494","0.2626","","","","","","1.046","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321685","10.891","0.002","12.417","0.003","12.432","0.003","81.996","0.003","88.815","0.003","73.583","0.002","1596.7","0.6","170","2","170","2","","","","","","","","5","P -1","-P 1","2","","","","- C24.5 H47 N3 O11 Ti3 -","- C24.498 H44 N3 O11 Ti3 -","- C48.996 H88 N6 O22 Ti6 -","2","1","","Tim Kemmitt; Najeh I. Al-Salim; Graeme J. Gainsford","Isolation and Structural Characterization of Triethanolaminotitanatranes: X-ray Structures of Partial Hydrolysis Condensates","Inorganic Chemistry","2000","39","","6067","6071","10.1021/ic000510u","","","0.71073","MoKα","","0.0516","0.0457","","","0.1201","0.1229","","","","","","1.142","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4321686","9.4237","0.0007","19.9219","0.0015","20.352","0.0015","90","","101.28","0.001","90","","3747","0.5","158","2","158","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C31 H58 N4 O13 Ti3 -","- C30.856 H56.784 N4 O13 Ti3 -","- C123.424 H227.136 N16 O52 Ti12 -","4","1","","Tim Kemmitt; Najeh I. Al-Salim; Graeme J. Gainsford","Isolation and Structural Characterization of Triethanolaminotitanatranes: X-ray Structures of Partial Hydrolysis Condensates","Inorganic Chemistry","2000","39","","6067","6071","10.1021/ic000510u","","","0.71073","MoKα","","0.073","0.0461","","","0.1148","0.1287","","","","","","1.029","","","","has coordinates,has disorder","179319","2020-10-21","18:00:00",""
"4321687","13.2057","0.0001","14.4476","0.0002","15.6376","0.0001","93.51","","99.043","0.001","115.036","0.001","2642.24","0.05","173","2","173","2","","","","","","","","5","P -1","-P 1","2","L2Fe(TMEDA)0.5(toluene)","","","- C59.5 H70 Fe N2 O4 -","- C56 H66 Fe N2 O4 -","- C112 H132 Fe2 N4 O8 -","2","1","","John R. Hagadorn; Lawrence Que,; William B. Tolman","N-Donor Effects on Carboxylate Binding in Mononuclear Iron(II) Complexes of a Sterically Hindered Benzoate Ligand","Inorganic Chemistry","2000","39","","6086","6090","10.1021/ic000531o","","","0.71073","MoKα","","0.0717","0.051","","","0.1072","0.117","","","","","","1.028","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321688","21.3773","0.0002","10.8573","0.0002","25.6947","0.0003","90","","114.143","0.001","90","","5442.07","0.14","173","2","173","2","","","","","","","John R. Hagadorn","5","C 1 2/c 1","-C 2yc","15","L2Fe(2,5Lut)2","","","- C64 H68 Fe N2 O4 -","- C64 H68 Fe N2 O4 -","- C256 H272 Fe4 N8 O16 -","4","0.5","","John R. Hagadorn; Lawrence Que,; William B. Tolman","N-Donor Effects on Carboxylate Binding in Mononuclear Iron(II) Complexes of a Sterically Hindered Benzoate Ligand","Inorganic Chemistry","2000","39","","6086","6090","10.1021/ic000531o","","","0.71073","MoKα","","0.0829","0.057","","0.1158","0.106","","","","1.133","1.193","1.193","","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321689","12.357","0.0002","15.0741","0.0002","16.1688","0.0003","100.307","0.001","112.464","0.001","95.45","","2693.77","0.08","173","2","173","2","","","","","","","John R. Hagadorn","6","P -1","-P 1","2","(Mes2ArCO2)2FePy2(CH2Cl2)","","","- C61 H62 Cl2 Fe N2 O4 -","- C61 H62 Cl2 Fe N2 O4 -","- C122 H124 Cl4 Fe2 N4 O8 -","2","1","","John R. Hagadorn; Lawrence Que,; William B. Tolman","N-Donor Effects on Carboxylate Binding in Mononuclear Iron(II) Complexes of a Sterically Hindered Benzoate Ligand","Inorganic Chemistry","2000","39","","6086","6090","10.1021/ic000531o","","","0.71073","MoKα","","0.0769","0.0516","","0.1159","0.104","","","","1.038","1.083","1.083","","","","","has coordinates","198632","2020-10-21","18:00:00",""
"4321690","30.5837","0.0005","10.4653","0.0002","22.0172","0.0003","90","","119.05","","90","","6160.45","0.18","173","2","173","2","","","","","","","John R. Hagadorn","6","C 1 2/c 1","-C 2yc","15","L2Fe(2,6Lut)2(CH2Cl2)2","","","- C66 H72 Cl4 Fe N2 O4 -","- C66 H72 Cl4 Fe N2 O4 -","- C264 H288 Cl16 Fe4 N8 O16 -","4","0.5","","John R. Hagadorn; Lawrence Que,; William B. Tolman","N-Donor Effects on Carboxylate Binding in Mononuclear Iron(II) Complexes of a Sterically Hindered Benzoate Ligand","Inorganic Chemistry","2000","39","","6086","6090","10.1021/ic000531o","","","0.71073","MoKα","","0.0867","0.064","","0.1626","0.1497","","","","1.061","1.12","1.12","","","","","has coordinates,has disorder","179319","2020-10-21","18:00:00",""
"4321691","13.8569","0.0001","48.6803","0.0004","18.2735","0.0002","90","","104.75","0.001","90","","11920.3","0.19","173","2","173","2","","","","","","","John R. Hagadorn","5","P 1 21/n 1","-P 2yn","14","L2Fe(2Pic)2","","","- C62 H64 Fe N2 O4 -","- C62 H64 Fe N2 O4 -","- C496 H512 Fe8 N16 O32 -","8","2","","John R. Hagadorn; Lawrence Que,; William B. Tolman","N-Donor Effects on Carboxylate Binding in Mononuclear Iron(II) Complexes of a Sterically Hindered Benzoate Ligand","Inorganic Chemistry","2000","39","","6086","6090","10.1021/ic000531o","","","0.71073","MoKα","","0.1716","0.0892","","0.186","0.1591","","","","1.023","1.23","1.23","","","","","has coordinates,has disorder","198632","2020-10-21","18:00:00",""
"4321692","3.637","0.002","3.674","0.002","11.85","0.005","93.34","0.05","96.77","0.05","90.24","0.05","156.96","0.14","293","2","293","2","","","","","","","","3","P -1","-P 1","2","Tetragadolinium Triboride Tetracarbide","Tetragadolinium Triboride Tetracarbide","","- C2 B1.5 Gd2 -","- C2 B1.5 Gd2 -","- C4 B3 Gd4 -","2","1","","Christophe Jardin; Oliver Oeckler; Hansjürgen Mattausch; Arndt Simon; Jean-François Halet; Jean-Yves Saillard; Josef Bauer","Synthesis, Characterization, and Structural and Theoretical Analysis of Gd4B3C4: A Novel Rare Earth Metal Borocarbide Containing Two Different Boron-Carbon Arrangements","Inorganic Chemistry","2000","39","","5895","5900","10.1021/ic000585y","","","0.71073","MoKα","","0.0528","0.04","","","0.1073","0.1111","","","","","","1.156","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321693","5.205","0.002","6.166","0.002","9.873","0.004","90","","93.58","0.03","90","","316.2","0.2","213","2","213","2","","","","","","","synthesized","4","P 1 21/m 1","-P 2yb","11","","Catena(bis(μ3-acetato,O,O,O')-di-copper(I))","","- C4 H6 Cu2 O4 -","- C4 H6 Cu2 O4 -","- C8 H12 Cu4 O8 -","2","0.5","","F. Albert Cotton; Evgeny V. Dikarev; Marina A. Petrukhina","Syntheses and Crystal Structures of ""Unligated"" Copper(I) and Copper(II) Trifluoroacetates","Inorganic Chemistry","2000","39","","6072","6079","10.1021/ic000663h","","","0.71073","MoKα","","0.0473","0.0455","","0.1372","0.1346","","","","1.274","1.286","1.286","","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321694","9.7937","0.0006","15.322","0.001","12.002","0.001","90","","106.493","0.009","90","","1726.9","0.2","213","2","213","2","","","","","","","synthesized","4","P 1 21/c 1","-P 2ybc","14","","Catena(tetrakis(μ3-trifluoroacetato,O,O,O')-tera-copper(I))","","- C8 Cu4 F12 O8 -","- C8 Cu4 F11.904 O8 -","- C32 Cu16 F47.616 O32 -","4","1","","F. Albert Cotton; Evgeny V. Dikarev; Marina A. Petrukhina","Syntheses and Crystal Structures of ""Unligated"" Copper(I) and Copper(II) Trifluoroacetates","Inorganic Chemistry","2000","39","","6072","6079","10.1021/ic000663h","","","0.71073","MoKα","","0.0642","0.0574","","0.1649","0.1557","","","","1.084","1.09","1.09","","","","","has coordinates,has disorder","179319","2020-10-21","18:00:00",""
"4321695","16.911","0.001","10.5063","0.0009","9.0357","0.0006","90","","90","","90","","1605.4","0.2","213","2","213","2","","","","","","","synthesized","4","P c c a","-P 2a 2ac","54","","Catena(bis(μ3-trifluoroacetato,O,O,O')-bis(/m2-trifluoroacetato,O,O')- -di-copper(II))","","- C8 Cu2 F12 O8 -","- C8 Cu2 F11.904 O8 -","- C32 Cu8 F47.616 O32 -","4","0.5","","F. Albert Cotton; Evgeny V. Dikarev; Marina A. Petrukhina","Syntheses and Crystal Structures of ""Unligated"" Copper(I) and Copper(II) Trifluoroacetates","Inorganic Chemistry","2000","39","","6072","6079","10.1021/ic000663h","","","0.71073","MoKα","","0.0681","0.0616","","0.1524","0.1458","","","","1.109","1.125","1.125","","","","","has coordinates,has disorder","179319","2020-10-21","18:00:00",""
"4321696","14.0054","0.0019","14.7581","0.0013","11.3549","0.0013","96.273","0.009","97.648","0.011","72.946","0.009","2217.7","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H52 Cu2 Gd N9 O20 -","- C32 H52 Cu2 Gd N9 O20 -","- C64 H104 Cu4 Gd2 N18 O40 -","2","1","","Jean-Pierre Costes; Françoise Dahan; Arnaud Dupuis","Is Ferromagnetism an Intrinsic Property of the CuII/GdIII Couple? 2. Structures and Magnetic Properties of Novel Trinuclear Complexes with μ-Phenolato-μ-oximato (Cu-Ln-Cu) Cores (Ln = La, Ce, Gd)","Inorganic Chemistry","2000","39","","5994","6000","10.1021/ic000666u","","","0.71073","MoKα","","0.0295","0.0243","","","0.0643","0.0672","","","","","","1.003","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321697","11.2255","0.0018","16.927","0.003","11.0096","0.0018","108.67","0.02","110.482","0.013","92.35","0.019","1828.8","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H38 Ce Cu2 N9 O13 -","- C30 H38 Ce Cu2 N9 O13 -","- C60 H76 Ce2 Cu4 N18 O26 -","2","1","","Jean-Pierre Costes; Françoise Dahan; Arnaud Dupuis","Is Ferromagnetism an Intrinsic Property of the CuII/GdIII Couple? 2. Structures and Magnetic Properties of Novel Trinuclear Complexes with μ-Phenolato-μ-oximato (Cu-Ln-Cu) Cores (Ln = La, Ce, Gd)","Inorganic Chemistry","2000","39","","5994","6000","10.1021/ic000666u","","","0.71073","MoKα","","0.0369","0.0293","","","0.0596","0.0643","","","","","","1.067","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321698","10.1935","0.0005","18.307","0.0009","12.5987","0.0006","90","","96.299","0.001","90","","2336.9","0.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C23 H25 B N8 O Re -","- C23 H25 B N8 O Re -","- C92 H100 B4 N32 O4 Re4 -","4","1","","T. Brent Gunnoe; Scott H. Meiere; Michal Sabat; W. Dean Harman","{TpRe(bpy)}: A Novel Pentaaminerhenium System That Stabilizes Both High and Low Oxidation States (Tp = Hydridotris(pyrazolyl)borate; bpy = 2,2'-Bipyridyl)","Inorganic Chemistry","2000","39","","6127","6130","10.1021/ic000707m","","","0.71073","MoKα","","0.0347","0.03","","","0.0602","0.061","","","","","","1.042","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321699","11.1953","0.0006","13.3364","0.0007","16.9539","0.0009","90","","96.763","0.001","90","","2513.7","0.2","193","","193","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C52 H48 Cl2 F12 P6 Re -","- C52 H48 Cl2 F12 P6 Re -","- C104 H96 Cl4 F24 P12 Re2 -","2","0.5","","Annette L. Suing; Charlotte R. Dewan; Peter S. White; H. Holden Thorp","Ethanol Oxidation by Imidorhenium(V) Complexes: Formation of Amidorhenium(III) Complexes","Inorganic Chemistry","2000","39","","6080","6085","10.1021/ic0007299","","","0.71073","MolybdenumKα","","0.048","0.04","","0.066","0.065","","","","","2.64","2.64","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321700","11.34","0.003","13.134","0.004","13.3796","0.0025","102.37","0.02","107.688","0.017","114.408","0.02","1590.8","0.9","193","","193","","","","","","","","","8","P 1","P 1","1","","","","- C61 H58 Cl F12 N2 O P6 Re -","- C61 H58 Cl F24 N2 O P6 Re -","- C61 H58 Cl F24 N2 O P6 Re -","1","1","","Annette L. Suing; Charlotte R. Dewan; Peter S. White; H. Holden Thorp","Ethanol Oxidation by Imidorhenium(V) Complexes: Formation of Amidorhenium(III) Complexes","Inorganic Chemistry","2000","39","","6080","6085","10.1021/ic0007299","","","0.71073","MolybdenumKα","","0.039","0.039","","0.056","0.056","","","","","2.13","2.13","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321701","11.9403","0.0006","14.6673","0.0008","17.2664","0.0009","92.019","0.001","97.379","0.001","90.134","0.001","2996.9","0.3","193","","193","","","","","","","","","7","P -1","-P 1","2","","","","- C58 H52 Cl2 F12 N P6 Re -","- C58 H52 Cl2 F24 N P6 Re -","- C116 H104 Cl4 F48 N2 P12 Re2 -","2","1","","Annette L. Suing; Charlotte R. Dewan; Peter S. White; H. Holden Thorp","Ethanol Oxidation by Imidorhenium(V) Complexes: Formation of Amidorhenium(III) Complexes","Inorganic Chemistry","2000","39","","6080","6085","10.1021/ic0007299","","","0.71073","MolybdenumKα","","0.06","0.043","","0.11","0.05","","","","","2.09","2.09","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321702","22.3075","0.001","23.1272","0.001","23.3584","0.001","90","","90","","90","","12050.8","0.9","193","","193","","","","","","","","","7","P c a b","-P 2bc 2ac","61","","","","- C59 H55 Cl3 F12 N P6 Re -","- C59 H55 Cl3 F12 N P6 Re -","- C472 H440 Cl24 F96 N8 P48 Re8 -","8","1","","Annette L. Suing; Charlotte R. Dewan; Peter S. White; H. Holden Thorp","Ethanol Oxidation by Imidorhenium(V) Complexes: Formation of Amidorhenium(III) Complexes","Inorganic Chemistry","2000","39","","6080","6085","10.1021/ic0007299","","","0.71073","MolybdenumKα","","0.083","0.057","","0.047","0.044","","","","","2.77","2.77","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321703","24.2381","0.0011","13.4504","0.0006","17.466","0.008","90","","97.069","0.001","90","","5651","3","193","","193","","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C59.09 H54.18 Cl4 F6 N1.27 P5 Re -","- C59 H54 Cl4 F6 N P5 Re -","- C236 H216 Cl16 F24 N4 P20 Re4 -","4","1","","Annette L. Suing; Charlotte R. Dewan; Peter S. White; H. Holden Thorp","Ethanol Oxidation by Imidorhenium(V) Complexes: Formation of Amidorhenium(III) Complexes","Inorganic Chemistry","2000","39","","6080","6085","10.1021/ic0007299","","","0.71073","MolybdenumKα","","0.057","0.051","","0.078","0.071","","","","","4.49","4.49","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321704","12.4567","0.0009","12.4567","0.0009","51.533","0.003","90","","90","","120","","6925","0.8","293","2","293","2","","","","","","","","3","R -3 m :H","-R 3 2""","166","Cs17.40Na60.60Sn138","","","- Cs17.4 Na60.6 Sn138 -","- Cs17.394 Na60.606 Sn138 -","- Cs17.394 Na60.606 Sn138 -","1","0.0277778","","Svilen Bobev; Slavi C. Sevov","Synthesis and Characterization of A3Na10Sn23 (A = Cs, Rb, K) with a New Clathrate-Like Structure and of the Chiral Clathrate Rb5Na3Sn25","Inorganic Chemistry","2000","39","","5930","5937","10.1021/ic0007714","","","0.71073","MoKα","","0.0441","0.0364","","","0.0846","0.0881","","","","","","1.068","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321705","12.4653","0.0011","12.4653","0.0011","51.085","0.003","90","","90","","120","","6874.3","0.9","293","2","293","2","","","","","","","","3","R -3 m :H","-R 3 2""","166","Rb19.07Na58.93Sn138","","","- Na58.93 Rb19.07 Sn138 -","- Na58.914 Rb19.086 Sn138 -","- Na58.914 Rb19.086 Sn138 -","1","0.0277778","","Svilen Bobev; Slavi C. Sevov","Synthesis and Characterization of A3Na10Sn23 (A = Cs, Rb, K) with a New Clathrate-Like Structure and of the Chiral Clathrate Rb5Na3Sn25","Inorganic Chemistry","2000","39","","5930","5937","10.1021/ic0007714","","","0.71073","MoKα","","0.0478","0.0361","","","0.0795","0.0873","","","","","","1.093","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321706","12.456","0.002","12.456","0.002","50.559","0.004","90","","90","","120","","6793.4","1.6","293","2","293","2","","","","","","","","3","R -3 m :H","-R 3 2""","166","K21.30Na56.70Sn138","","","- K21.3 Na56.7 Sn138 -","- K21.36 Na56.64 Sn138 -","- K21.36 Na56.64 Sn138 -","1","0.0277778","","Svilen Bobev; Slavi C. Sevov","Synthesis and Characterization of A3Na10Sn23 (A = Cs, Rb, K) with a New Clathrate-Like Structure and of the Chiral Clathrate Rb5Na3Sn25","Inorganic Chemistry","2000","39","","5930","5937","10.1021/ic0007714","","","0.71073","MoKα","","0.1263","0.0667","","","0.138","0.1612","","","","","","1.016","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321707","16.4127","0.0007","16.4127","0.0007","16.4127","0.0007","90","","90","","90","","4421.2","0.3","293","2","293","2","","","","","","","","3","P 41 3 2","P 4bd 2ab 3","213","Rb20Na12Sn100","","","- Na12 Rb20 Sn100 -","- Na12 Rb20 Sn100 -","- Na12 Rb20 Sn100 -","1","0.0416667","","Svilen Bobev; Slavi C. Sevov","Synthesis and Characterization of A3Na10Sn23 (A = Cs, Rb, K) with a New Clathrate-Like Structure and of the Chiral Clathrate Rb5Na3Sn25","Inorganic Chemistry","2000","39","","5930","5937","10.1021/ic0007714","","","0.71073","MoKα","","0.0324","0.0271","","","0.0612","0.0627","","","","","","1.059","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321708","11.818","0.005","33.978","0.006","12.163","0.004","90","","109.24","0.02","90","","4611","3","296.2","","296.2","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C36 H50 F6 N2 O6.5 P4 S2 W -","- C36 H50 F6 N2 O6.5 P4 S2 W -","- C144 H200 F24 N8 O26 P16 S8 W4 -","4","1","","Yoshiaki Nishibayashi; Shin Takemoto; Shotaro Iwai; Masanobu Hidai","Formation of Ammonia in the Reactions of a Tungsten Dinitrogen with Ruthenium Dihydrogen Complexes under Mild Reaction Conditions1","Inorganic Chemistry","2000","39","","5946","5957","10.1021/ic000799f","","","0.7107","MoKα","","0.0386","0.0386","","","0.0331","0.0331","","","","","","1.678","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321709","4.17","0.0003","26.3485","0.0017","23.6092","0.0015","90","","90","","90","","2594","0.3","153","2","153","2","","","","","","","","4","C m c 21","C 2c -2","36","","","","- Cl Cr Tb8 Te13 -","- Cl Cr Tb8 Te13 -","- Cl4 Cr4 Tb32 Te52 -","4","0.5","","Olivier Tougait; James A. Ibers","New Series CrLn8Te13Cl (Ln = Sm, Gd, Tb): Pseudo-Misfit-Layer Compounds","Inorganic Chemistry","2000","39","","6136","6138","10.1021/ic000817t","","","0.71073","MoKα","","0.0271","0.0261","","","0.0641","0.0646","","","","","","1.209","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321710","4.2281","0.0007","26.575","0.004","23.829","0.004","90","","90","","90","","2677.5","0.7","153","2","153","2","","","","","","","","4","C m c 21","C 2c -2","36","","","","- Cl Cr Sm8 Te13 -","- Cl Cr Sm8 Te13 -","- Cl4 Cr4 Sm32 Te52 -","4","0.5","","Olivier Tougait; James A. Ibers","New Series CrLn8Te13Cl (Ln = Sm, Gd, Tb): Pseudo-Misfit-Layer Compounds","Inorganic Chemistry","2000","39","","6136","6138","10.1021/ic000817t","","","0.71073","MoKα","","0.0303","0.026","","","0.0599","0.0623","","","","","","1.001","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321711","4.1923","0.0005","26.464","0.003","23.73","0.003","90","","90","","90","","2632.7","0.5","153","2","153","2","","","","","","","","4","C m c 21","C 2c -2","36","","","","- Cl Cr Gd8 Te13 -","- Cl Cr Gd8 Te13 -","- Cl4 Cr4 Gd32 Te52 -","4","0.5","","Olivier Tougait; James A. Ibers","New Series CrLn8Te13Cl (Ln = Sm, Gd, Tb): Pseudo-Misfit-Layer Compounds","Inorganic Chemistry","2000","39","","6136","6138","10.1021/ic000817t","","","0.71073","MoKα","","0.0243","0.0237","","","0.0588","0.0591","","","","","","1.05","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321712","7.3318","0.0001","10.158","0.0001","14.8414","0.0003","90","","94.972","0.001","90","","1101.18","0.03","193","2","193","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","98277","","","- C28 H24 I P -","- C28 H24 I P -","- C56 H48 I2 P2 -","2","0.5","","Erik D. Brady; Timothy P. Hanusa; Maren Pink; Victor G. Young","The First Noncoordinated Phosphonium Diylide, [Me2P(C13H8)2]-, and Its Ylidic and Cationic Counterparts: Synthesis, Structural Characterization, and Interaction with the Heavy Group 2 Metals","Inorganic Chemistry","2000","39","","6028","6037","10.1021/ic000838n","","","0.71073","MoKα","","0.0256","0.0207","","","0.0539","0.0556","","","","","","1.013","","","","has coordinates","198632","2020-10-21","18:00:00",""
"4321713","13.0619","0.0007","22.6419","0.0013","17.9082","0.001","90","","110.658","0.001","90","","4955.7","0.5","173","2","173","2","","","","","","","Prof. T. Hanusa - Vanderbilt University","6","P 1 21/n 1","-P 2yn","14","99331a","","","- C52 H70 Ca I O6 P -","- C52 H70 Ca I O6 P -","- C208 H280 Ca4 I4 O24 P4 -","4","1","","Erik D. Brady; Timothy P. Hanusa; Maren Pink; Victor G. Young","The First Noncoordinated Phosphonium Diylide, [Me2P(C13H8)2]-, and Its Ylidic and Cationic Counterparts: Synthesis, Structural Characterization, and Interaction with the Heavy Group 2 Metals","Inorganic Chemistry","2000","39","","6028","6037","10.1021/ic000838n","","","0.71073","MoKα","","0.0747","0.0408","","0.1152","0.1033","","","","1.04","1.165","1.165","","","","","has coordinates,has disorder","179320","2020-10-21","18:00:00",""
"4321714","9.733","0.0007","17.8237","0.0012","12.3659","0.0008","90","","110.621","0.001","90","","2007.8","0.2","173","2","173","2","","","","","","","Prof. T. Hanusa - Vanderbilt","3","P 1 21/c 1","-P 2ybc","14","00032a","","","- C28 H23 P -","- C28 H23 P -","- C112 H92 P4 -","4","1","","Erik D. Brady; Timothy P. Hanusa; Maren Pink; Victor G. Young","The First Noncoordinated Phosphonium Diylide, [Me2P(C13H8)2]-, and Its Ylidic and Cationic Counterparts: Synthesis, Structural Characterization, and Interaction with the Heavy Group 2 Metals","Inorganic Chemistry","2000","39","","6028","6037","10.1021/ic000838n","","","0.71073","MoKα","","0.0714","0.0442","","0.1132","0.1041","","","","0.994","1.116","1.116","","","","","has coordinates","258736","2020-11-05","08:57:04",""
"4321715","12.5781","0.0012","17.7408","0.0017","24.44","0.002","90","","98.24","0.002","90","","5397.4","0.9","158","2","158","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C56 H69 B N8 O4 Zn -","- C56 H69 B N8 O4 Zn -","- C224 H276 B4 N32 O16 Zn4 -","4","1","","David A. Shultz; Scot H. Bodnar; Kira E. Vostrikova; Jeff W. Kampf","Synthesis and Structure of a Complex Having a Quartet Ground State with Three Entirely Different Spin Carriers: Nitronyl Nitroxide, o-Semiquinone, and CuII","Inorganic Chemistry","2000","39","","6091","6093","10.1021/ic0009122","","","0.71073","MoKα","","0.1283","0.0952","","","0.177","0.1907","","","","","","1.149","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4327610","10.3006","0.0012","9.6465","0.0008","18.479","0.002","90","","102.98","0.02","90","","1789.2","0.4","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C21 H23 Fe N O2 -","- C21 H23 Fe N O2 -","- C84 H92 Fe4 N4 O8 -","4","2","","Alexandra Hess; Jan Sehnert; Thomas Weyhermüller; Nils Metzler-Nolte","Chiral Ferrocene Amines Derived from Amino Acids and Peptides: Synthesis, Solution and X-ray Crystal Structures and Electrochemical Investigations","Inorganic Chemistry","2000","39","","5437","5443","10.1021/ic000089+","","","0.71073","MoKα","","0.0771","0.0599","","0.1648","0.1519","","","","1.062","1.108","1.108","","","","","has coordinates","179379","2020-10-21","18:00:00",""
"4327611","12.288","0.0001","12.288","0.0001","23.3681","0.0002","90","","90","","120","","3055.74","0.04","213","2","213","2","","","","","","","","5","P -3 1 c","-P 3 2c","163","","","","- C31 H65 Cl4 Fe3 O18 -","- C31 H61.96 Cl3.99 Fe3 O17.98 -","- C62 H123.92 Cl7.98 Fe6 O35.96 -","2","0.166667","","Remle Çelenligil-Çetin; Richard J. Staples; Pericles Stavropoulos","Synthesis, Characterization, and Reactivity of Ferrous and Ferric Oxo/Peroxo Pivalate Complexes in Relation to Gif-Type Oxygenation of Substrates","Inorganic Chemistry","2000","39","","5838","5846","10.1021/ic000261+","","","0.71073","MoKα","","0.1339","0.0803","","","0.2203","0.2423","","","","","","1.021","","","","has coordinates,has disorder","179379","2020-10-21","18:00:00",""
"4327612","9.0876","0.0003","17.2861","0.0006","19.05","0.0007","90","","99.866","0.001","90","","2948.29","0.18","213","2","213","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C30 H38 Fe N4 O4 -","- C30 H38 Fe N4 O4 -","- C120 H152 Fe4 N16 O16 -","4","0.5","","Remle Çelenligil-Çetin; Richard J. Staples; Pericles Stavropoulos","Synthesis, Characterization, and Reactivity of Ferrous and Ferric Oxo/Peroxo Pivalate Complexes in Relation to Gif-Type Oxygenation of Substrates","Inorganic Chemistry","2000","39","","5838","5846","10.1021/ic000261+","","","0.71073","MoKα","","0.0975","0.0562","","","0.1228","0.1492","","","","","","1.078","","","","has coordinates","179379","2020-10-21","18:00:00",""
"4327613","13.039","0.003","13.667","0.003","15.403","0.003","112.605","0.008","111.824","0.009","90.78","0.01","2312.8","0.9","213","2","213","2","","","","","","","","4","P -1","-P 1","2","","","","- C70 H128 Fe6 O32 -","- C70 H128 Fe6 O32 -","- C70 H128 Fe6 O32 -","1","0.5","","Remle Çelenligil-Çetin; Richard J. Staples; Pericles Stavropoulos","Synthesis, Characterization, and Reactivity of Ferrous and Ferric Oxo/Peroxo Pivalate Complexes in Relation to Gif-Type Oxygenation of Substrates","Inorganic Chemistry","2000","39","","5838","5846","10.1021/ic000261+","","","0.71073","MoKα","","0.1055","0.0723","","","0.2016","0.2556","","","","","","1.031","","","","has coordinates","179379","2020-10-21","18:00:00",""
"4327614","21.9379","0.0005","18.7231","0.0007","23.721","0.001","90","","99.235","0.004","90","","9617","0.6","213","2","213","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C71.5 H121 Fe6 N2 O28.5 -","- C71.5 H121 Fe6 N2 O28.5 -","- C286 H484 Fe24 N8 O114 -","4","1","","Remle Çelenligil-Çetin; Richard J. Staples; Pericles Stavropoulos","Synthesis, Characterization, and Reactivity of Ferrous and Ferric Oxo/Peroxo Pivalate Complexes in Relation to Gif-Type Oxygenation of Substrates","Inorganic Chemistry","2000","39","","5838","5846","10.1021/ic000261+","","","0.71073","MoKα","","0.1783","0.0844","","","0.2057","0.2426","","","","","","1.171","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4327615","13.1278","0.0005","13.1794","0.0005","25.0769","0.0006","75.731","0.002","87.745","0.002","61.218","0.001","3669.3","0.2","213","2","213","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H40 F30 Fe6 O33 -","- C38 H40 F30 Fe6 O33 -","- C76 H80 F60 Fe12 O66 -","2","1","","Remle Çelenligil-Çetin; Richard J. Staples; Pericles Stavropoulos","Synthesis, Characterization, and Reactivity of Ferrous and Ferric Oxo/Peroxo Pivalate Complexes in Relation to Gif-Type Oxygenation of Substrates","Inorganic Chemistry","2000","39","","5838","5846","10.1021/ic000261+","","","0.71073","MoKα","","0.2325","0.1015","","","0.2435","0.3251","","","","","","1.018","","","","has coordinates,has disorder","179379","2020-10-21","18:00:00",""
"4327616","19.43","0.001","19.062","0.003","19.859","0.004","90","","91.06","0.01","90","","7354","1.9","213","2","213","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C55 H99 Fe4 N Na2 O23 -","- C55 H99 Fe4 N Na2 O23 -","- C220 H396 Fe16 N4 Na8 O92 -","4","1","","Remle Çelenligil-Çetin; Richard J. Staples; Pericles Stavropoulos","Synthesis, Characterization, and Reactivity of Ferrous and Ferric Oxo/Peroxo Pivalate Complexes in Relation to Gif-Type Oxygenation of Substrates","Inorganic Chemistry","2000","39","","5838","5846","10.1021/ic000261+","","","0.71073","MoKα","","0.0802","0.043","","","0.1188","0.1553","","","","","","1.034","","","","has coordinates","179379","2020-10-21","18:00:00",""
"4327617","22.51","0.006","14.196","0.005","30.117","0.007","90","","104.15","0.01","90","","9332","5","213","2","213","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C64 H116 Cl8 Fe4 Na2 O26 -","- C64 H116 Cl8 Fe4 Na2 O26 -","- C256 H464 Cl32 Fe16 Na8 O104 -","4","0.5","","Remle Çelenligil-Çetin; Richard J. Staples; Pericles Stavropoulos","Synthesis, Characterization, and Reactivity of Ferrous and Ferric Oxo/Peroxo Pivalate Complexes in Relation to Gif-Type Oxygenation of Substrates","Inorganic Chemistry","2000","39","","5838","5846","10.1021/ic000261+","","","0.71073","MoKα","","0.1383","0.0844","","","0.1686","0.2149","","","","","","1.247","","","","has coordinates","179379","2020-10-21","18:00:00",""
"4327618","18.035","0.004","18.404","0.003","22.445","0.003","90","","94.093","0.009","90","","7431","2","213","2","213","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C60 H100 Cl0 Fe4 N4 O18 -","- C60 H100 Fe4 N4 O18 -","- C240 H400 Fe16 N16 O72 -","4","1","","Remle Çelenligil-Çetin; Richard J. Staples; Pericles Stavropoulos","Synthesis, Characterization, and Reactivity of Ferrous and Ferric Oxo/Peroxo Pivalate Complexes in Relation to Gif-Type Oxygenation of Substrates","Inorganic Chemistry","2000","39","","5838","5846","10.1021/ic000261+","","","0.71073","MoKα","","0.1405","0.0854","","","0.2214","0.2463","","","","","","1.113","","","","has coordinates","179379","2020-10-21","18:00:00",""
"4327619","16.3537","0.0002","23.0716","0.0002","26.5332","0.0003","90","","101.27","0.001","90","","9818.09","0.19","213","2","213","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C76 H130 Fe6 N2 O28 -","- C76 H130 Fe6 N2 O28 -","- C304 H520 Fe24 N8 O112 -","4","1","","Remle Çelenligil-Çetin; Richard J. Staples; Pericles Stavropoulos","Synthesis, Characterization, and Reactivity of Ferrous and Ferric Oxo/Peroxo Pivalate Complexes in Relation to Gif-Type Oxygenation of Substrates","Inorganic Chemistry","2000","39","","5838","5846","10.1021/ic000261+","","","0.71073","MoKα","","0.0771","0.0461","","","0.118","0.1357","","","","","","1.032","","","","has coordinates","179379","2020-10-21","18:00:00",""
"4327620","18.983","0.002","11.1727","0.0013","19.768","0.002","90","","110.603","0.005","90","","3924.5","0.7","193","2","193","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C28 H60 Li2 N8 O2 P2 Si2 -","- C28 H60 Li2 N8 O2 P2 Si2 -","- C112 H240 Li8 N32 O8 P8 Si8 -","4","0.5","","Christian H. Galka; Dominique J. M. Trösch; Ina Rüdenauer; Lutz H. Gade; Ian Scowen; Mary McPartlin","Synthesis and Structural Characterization of Metalated 1,8-Bis(silylamino)naphthalene Derivatives","Inorganic Chemistry","2000","39","","4615","4620","10.1021/ic000296+","","","0.71073","MoKα","","0.0579","0.0429","","","0.1054","0.1169","","","","","","1.035","","","","has coordinates","179379","2020-10-21","18:00:00",""
"4327621","11.645","0.003","12.173","0.003","15.959","0.004","97.03","0.014","95.118","0.014","90.331","0.015","2236","1","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C42.5 H68 Li2 N5 Si2 -","- C42.5 H68 Li2 N5 Si2 -","- C85 H136 Li4 N10 Si4 -","2","1","","Christian H. Galka; Dominique J. M. Trösch; Ina Rüdenauer; Lutz H. Gade; Ian Scowen; Mary McPartlin","Synthesis and Structural Characterization of Metalated 1,8-Bis(silylamino)naphthalene Derivatives","Inorganic Chemistry","2000","39","","4615","4620","10.1021/ic000296+","","","0.71073","MoKα","","0.1006","0.0709","","","0.1878","0.2114","","","","","","1.076","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4327622","11.6817","0.0011","11.7292","0.0015","22.157","0.003","90","","94.625","0.007","90","","3026","0.6","299","2","299","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C24 H40 Br Li Mg N2 O2 Si2 -","- C24 H40 Br Li Mg N2 O2 Si2 -","- C96 H160 Br4 Li4 Mg4 N8 O8 Si8 -","4","1","","Christian H. Galka; Dominique J. M. Trösch; Ina Rüdenauer; Lutz H. Gade; Ian Scowen; Mary McPartlin","Synthesis and Structural Characterization of Metalated 1,8-Bis(silylamino)naphthalene Derivatives","Inorganic Chemistry","2000","39","","4615","4620","10.1021/ic000296+","","","0.71073","MoKα","","0.1737","0.0698","","","0.1291","0.1538","","","","","","0.926","","","","has coordinates,has disorder","179379","2020-10-21","18:00:00",""
"4327623","9.55","0.003","12.35","0.003","13.411","0.002","105.17","0.02","101.96","0.02","109.87","0.02","1357.1","0.7","293","","293","","","","","","","","","6","P -1","-P 1","2","","","","- C21 H23 Fe3 N O10 Se -","- C21 H23 Fe3 N O10 Se -","- C42 H46 Fe6 N2 O20 Se2 -","2","1","","Minghuey Shieh; Horng-Sun Chen; Hsin-Hung Chi; Chuen-Her Ueng","Synthesis of an Se-Bridged Triiron Acyl Cluster Complex and the Fischer-Type Carbene Complex Derived from It: Isolation of Rotational Isomers","Inorganic Chemistry","2000","39","","5561","5564","10.1021/ic000301+","","","0.7093","MolybdenumKα","","0.078","0.038","","0.033","0.032","","","","","2.31","2.31","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4327624","9.552","0.003","16.221","0.002","12.574","0.003","90","","104.91","0.02","90","","1882.7","0.8","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H6 Fe3 O10 Se -","- C14 H6 Fe3 O10 Se -","- C56 H24 Fe12 O40 Se4 -","4","1","","Minghuey Shieh; Horng-Sun Chen; Hsin-Hung Chi; Chuen-Her Ueng","Synthesis of an Se-Bridged Triiron Acyl Cluster Complex and the Fischer-Type Carbene Complex Derived from It: Isolation of Rotational Isomers","Inorganic Chemistry","2000","39","","5561","5564","10.1021/ic000301+","","","0.7093","MolybdenumKα","","0.07","0.026","","0.022","0.02","","","","","1.53","1.53","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4327625","9.365","0.003","16.258","0.002","13.035","0.005","90","","106.21","0.03","90","","1905.8","1","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H6 Fe3 O10 Se -","- C14 H6 Fe3 O10 Se -","- C56 H24 Fe12 O40 Se4 -","4","1","","Minghuey Shieh; Horng-Sun Chen; Hsin-Hung Chi; Chuen-Her Ueng","Synthesis of an Se-Bridged Triiron Acyl Cluster Complex and the Fischer-Type Carbene Complex Derived from It: Isolation of Rotational Isomers","Inorganic Chemistry","2000","39","","5561","5564","10.1021/ic000301+","","","0.7093","MolybdenumKα","","0.063","0.026","","0.022","0.02","","","","","1.51","1.51","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4327626","16.534","0.006","8.592","0.003","21.152","0.007","90","","108.69","","90","","2846.4","1.7","188","2","188","2","","","","","","","synthesized by Yeong-Joon Kim","4","C 1 2/c 1","-C 2yc","15","triethylamine salt of 2-hydroxy-2-phenylpropenal anion","triethylammonium 2-formyl-2-phenyl-1-ethenoxide","","- C30 H46 N2 O4 -","- C30 H46 N2 O4 -","- C120 H184 N8 O16 -","4","0.5","","Charles L. Perrin; Yeong-Joon Kim","Symmetry of Metal Chelates","Inorganic Chemistry","2000","39","","3902","3910","10.1021/ic000382+","","","0.71073","MoKα","","0.0686","0.0452","","0.1162","0.0998","","","","1.006","1.011","1.011","","","","","has coordinates","179379","2020-10-21","18:00:00",""
"4327627","10.925","0.005","11.146","0.004","12.327","0.004","99.37","","92.39","","112.75","","1356.7","0.9","295","2","295","2","","","","","","","synthesized by Yeong-Joon Kim","4","P -1","-P 1","2","(2-phenylmalonaldehydato)tetraphenylantimony","(2-formyl-2-phenyl-1-ethenoxy)tetraphenylantimony","","- C33 H27 O2 Sb -","- C33 H27 O2 Sb -","- C66 H54 O4 Sb2 -","2","1","","Charles L. Perrin; Yeong-Joon Kim","Symmetry of Metal Chelates","Inorganic Chemistry","2000","39","","3902","3910","10.1021/ic000382+","","","0.71073","MoKα","","0.0424","0.0355","","0.0926","0.0875","","","","1.042","1.052","1.052","","","","","has coordinates,has disorder","179379","2020-10-21","18:00:00",""
"4327628","9.512","0.005","16.656","0.008","14.724","0.006","90","","92.5","","90","","2330.5","1.9","296","2","296","2","","","","","","","synthesized by Yeong-Joon Kim","4","P 1 21/n 1","-P 2yn","14","(2-phenylmalonaldehydato)triphenyltin","(2-formyl-2-phenyl-1-ethenoxy)triphenyltin","","- C27 H22 O2 Sn -","- C27 H22 O2 Sn -","- C108 H88 O8 Sn4 -","4","1","","Charles L. Perrin; Yeong-Joon Kim","Symmetry of Metal Chelates","Inorganic Chemistry","2000","39","","3902","3910","10.1021/ic000382+","","","0.71073","MoKα","","0.059","0.0402","","0.112","0.0989","","","","1.051","1.076","1.076","","","","","has coordinates","179379","2020-10-21","18:00:00",""
"4327629","16.644","0.002","6.357","0.001","6.752","0.001","90","","108.12","0.01","90","","678.97","0.17","293","2","293","2","","","","","","","aqueous synthesis","5","C 1 2 1","C 2y","5","","catena-[(mu!2$-oxalato-0,0')-{aqua-bis(4-aminopyridine)-copper(II)}]","","- C12 H14 Cu N4 O5 -","- C12 H14 Cu N4 O5 -","- C24 H28 Cu2 N8 O10 -","2","0.5","","Oscar Castillo; Antonio Luque; Jon Sertucha; Pascual Román; Francesc Lloret","Synthesis, Crystal Structure, and Magnetic Properties of a One-Dimensional Polymeric Copper(II) Complex Containing an Unusual 1,1'-Bicoordinated Oxalato Bridge","Inorganic Chemistry","2000","39","","6142","6144","10.1021/ic000543+","","","0.71069","MoKα","","0.056","0.047","","0.057","","0.054","","","1.68","","","1.49","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4327630","14.684","0.003","16.325","0.007","17.785","0.004","90","","108.77","0.02","90","","4037","2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","1","","","- C16 H20 Cl2 Cu N4 O8 -","- C16 H20 Cl2 Cu N4 O8 -","- C128 H160 Cl16 Cu8 N32 O64 -","8","2","","Jason A. Halfen; Joseph M. Uhan; Derek C. Fox; Mark P. Mehn; Lawrence Que","Copper(II) Complexes of Pyridyl-Appended Diazacycloalkanes: Synthesis, Characterization, and Application to Catalytic Olefin Aziridination","Inorganic Chemistry","2000","39","","4913","4920","10.1021/ic000664+","","","0.71073","MoKα","","0.1633","0.0698","","","0.1674","0.2066","","","","","","1.03","","","","has coordinates","179379","2020-10-21","18:00:00",""
"4327631","8.498","0.001","9.079","0.001","14.944","0.003","85.98","0.02","88.29","0.02","66.83","0.01","1057.4","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","2","","","- C17 H22 Cl2 Cu N4 O8 -","- C17 H22 Cl2 Cu N4 O8 -","- C34 H44 Cl4 Cu2 N8 O16 -","2","1","","Jason A. Halfen; Joseph M. Uhan; Derek C. Fox; Mark P. Mehn; Lawrence Que","Copper(II) Complexes of Pyridyl-Appended Diazacycloalkanes: Synthesis, Characterization, and Application to Catalytic Olefin Aziridination","Inorganic Chemistry","2000","39","","4913","4920","10.1021/ic000664+","","","0.71073","MoKα","","0.0893","0.0508","","","0.1235","0.1397","","","","","","1.017","","","","has coordinates,has disorder","179379","2020-10-21","18:00:00",""
"4327632","14.143","0.003","17.302","0.002","17.97","0.002","90","","90","","90","","4397.3","1.2","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","3","","","- C18 H24 Cl2 Cu N4 O8 -","- C18 H24 Cl2 Cu N4 O8 -","- C144 H192 Cl16 Cu8 N32 O64 -","8","1","","Jason A. Halfen; Joseph M. Uhan; Derek C. Fox; Mark P. Mehn; Lawrence Que","Copper(II) Complexes of Pyridyl-Appended Diazacycloalkanes: Synthesis, Characterization, and Application to Catalytic Olefin Aziridination","Inorganic Chemistry","2000","39","","4913","4920","10.1021/ic000664+","","","0.71073","MoKα","","0.1393","0.0635","","","0.1502","0.1821","","","","","","0.988","","","","has coordinates","179379","2020-10-21","18:00:00",""
"4327633","11.312","0.001","13.545","0.004","16.615","0.003","90","","90","","90","","2545.8","0.9","293","2","293","2","","","","","","","","6","P b c m","-P 2c 2b","57","4","","","- C18 H23 Cu F12 N5 P2 -","- C18 H23 Cu F12 N5 P2 -","- C72 H92 Cu4 F48 N20 P8 -","4","0.5","","Jason A. Halfen; Joseph M. Uhan; Derek C. Fox; Mark P. Mehn; Lawrence Que","Copper(II) Complexes of Pyridyl-Appended Diazacycloalkanes: Synthesis, Characterization, and Application to Catalytic Olefin Aziridination","Inorganic Chemistry","2000","39","","4913","4920","10.1021/ic000664+","","","0.71073","MoKα","","0.1276","0.054","","","0.1258","0.1535","","","","","","1.008","","","","has coordinates,has disorder","179379","2020-10-21","18:00:00",""
"4327634","11.733","0.002","13.645","0.003","16.509","0.003","90","","91.01","0.03","90","","2642.6","0.9","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","5","","","- C19 H25 Cu F12 N5 P2 -","- C19 H25 Cu F12 N5 P2 -","- C76 H100 Cu4 F48 N20 P8 -","4","1","","Jason A. Halfen; Joseph M. Uhan; Derek C. Fox; Mark P. Mehn; Lawrence Que","Copper(II) Complexes of Pyridyl-Appended Diazacycloalkanes: Synthesis, Characterization, and Application to Catalytic Olefin Aziridination","Inorganic Chemistry","2000","39","","4913","4920","10.1021/ic000664+","","","0.71073","MoKα","","0.1967","0.0889","","","0.2287","0.2791","","","","","","1.046","","","","has coordinates","179379","2020-10-21","18:00:00",""
"4327635","14.416","0.004","15.284","0.001","11.161","0.002","90","","99.09","0.03","90","","2428.3","0.8","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","6","","","- C18 H24 Cu F12 N4 P2 -","- C18 H24 Cu F12 N4 P2 -","- C72 H96 Cu4 F48 N16 P8 -","4","1","","Jason A. Halfen; Joseph M. Uhan; Derek C. Fox; Mark P. Mehn; Lawrence Que","Copper(II) Complexes of Pyridyl-Appended Diazacycloalkanes: Synthesis, Characterization, and Application to Catalytic Olefin Aziridination","Inorganic Chemistry","2000","39","","4913","4920","10.1021/ic000664+","","","0.71073","MoKα","","0.1377","0.0521","","","0.1129","0.1397","","","","","","1.007","","","","has coordinates","179379","2020-10-21","18:00:00",""
"4327636","18.36","0.001","11.761","0.001","25.754","0.002","90","","90.72","0.01","90","","5560.7","0.7","243","2","243","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C63 H70 B2 Fe N6 -","- C63 H70 B2 Fe N6 -","- C252 H280 B8 Fe4 N24 -","4","1","","David W. Blakesley; Sonha C. Payne; Karl S. Hagen","Spin-State Variation in Solid State and Solution of Mononuclear Iron(II) 1,4,7-Trimethyl-1,4,7-triazacyclonane Complexes","Inorganic Chemistry","2000","39","","1979","1989","10.1021/ic990584+","","","1.54178","CuKα","","0.087","0.0512","","","0.1193","0.1394","","","","","","0.998","","","","has coordinates","179379","2020-10-21","18:00:00",""
"4327637","18.456","0.0009","11.823","0.0012","26.258","0.004","90","","90.32","0.011","90","","5729.5","1.1","368","2","368","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C63 H70 B2 Fe N6 -","- C63 H70 B2 Fe N6 -","- C252 H280 B8 Fe4 N24 -","4","1","","David W. Blakesley; Sonha C. Payne; Karl S. Hagen","Spin-State Variation in Solid State and Solution of Mononuclear Iron(II) 1,4,7-Trimethyl-1,4,7-triazacyclonane Complexes","Inorganic Chemistry","2000","39","","1979","1989","10.1021/ic990584+","","","1.54178","CuKα","","0.0849","0.0587","","","0.1548","0.1759","","","","","","1.027","","","","has coordinates","179379","2020-10-21","18:00:00",""
"4327638","8.5","0.001","11.421","0.002","15.677","0.002","92.23","0.01","94.79","0.01","97.03","0.01","1503.3","0.4","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C16 H29 Cl2 F6 Fe N5 O6 S2 -","- C16 H29 Cl2 F6 Fe N5 O6 S2 -","- C32 H58 Cl4 F12 Fe2 N10 O12 S4 -","2","1","","David W. Blakesley; Sonha C. Payne; Karl S. Hagen","Spin-State Variation in Solid State and Solution of Mononuclear Iron(II) 1,4,7-Trimethyl-1,4,7-triazacyclonane Complexes","Inorganic Chemistry","2000","39","","1979","1989","10.1021/ic990584+","","","1.54178","CuKα","","0.101","0.073","","","0.1791","0.1992","","","","","","1.036","","","","has coordinates,has disorder","179379","2020-10-21","18:00:00",""
"4327639","11.253","0.003","12.624","0.005","14.683","0.005","90","","94.02","0.02","90","","2080.7","1.2","211","2","211","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C11 H23 F6 Fe N3 O7 S2 -","- C11 H23 F6 Fe N3 O7 S2 -","- C44 H92 F24 Fe4 N12 O28 S8 -","4","1","","David W. Blakesley; Sonha C. Payne; Karl S. Hagen","Spin-State Variation in Solid State and Solution of Mononuclear Iron(II) 1,4,7-Trimethyl-1,4,7-triazacyclonane Complexes","Inorganic Chemistry","2000","39","","1979","1989","10.1021/ic990584+","","","1.54178","CuKα","","0.0771","0.0703","","","0.1776","0.1864","","","","","","1.073","","","","has coordinates","179379","2020-10-21","18:00:00",""
"4327640","12.3856","0.0006","12.8029","0.0007","16.4921","0.0009","90","","90","","90","","2615.2","0.2","295","2","295","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C18 H32 Cl2 Ni O8 S4 -","- C18 H32 Cl2 Ni O8 S4 -","- C72 H128 Cl8 Ni4 O32 S16 -","4","1","","Chandrika P. Kulatilleke; Scott N. Goldie; Mary Jane Heeg; L. A. Ochrymowycz; D. B. Rorabacher","Formation and Dissociation Kinetics and Crystal Structures of Nickel(II)-Macrocyclic Tetrathiaether Complexes in Acetonitrile. Comparison to Nickel(II)-Macrocyclic Tetramines","Inorganic Chemistry","2000","39","","1444","1453","10.1021/ic991019+","","","0.71073","MoKα","","0.0794","0.0476","","0.1265","0.1132","","","","0.945","1.057","1.057","","","","","has coordinates","179379","2020-10-21","18:00:00",""
"4327641","17.7381","0.0011","7.0613","0.0004","20.9705","0.0012","90","","99.699","0.001","90","","2589.1","0.3","295","2","295","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C18 H32 Cl2 Ni O8 S4 -","- C18 H32 Cl2 Ni O8 S4 -","- C72 H128 Cl8 Ni4 O32 S16 -","4","0.5","","Chandrika P. Kulatilleke; Scott N. Goldie; Mary Jane Heeg; L. A. Ochrymowycz; D. B. Rorabacher","Formation and Dissociation Kinetics and Crystal Structures of Nickel(II)-Macrocyclic Tetrathiaether Complexes in Acetonitrile. Comparison to Nickel(II)-Macrocyclic Tetramines","Inorganic Chemistry","2000","39","","1444","1453","10.1021/ic991019+","","","0.71073","MoKα","","0.0841","0.0623","","0.1651","0.1517","","","","0.946","1.08","1.08","","","","","has coordinates","179379","2020-10-21","18:00:00",""
"4327642","7.3849","0.0006","8.8365","0.0007","9.7503","0.0008","83.428","0.002","76.639","0.001","87.677","0.001","614.92","0.09","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H32 Cl2 Ni O8 S4 -","- C18 H32 Cl2 Ni O8 S4 -","- C18 H32 Cl2 Ni O8 S4 -","1","0.5","","Chandrika P. Kulatilleke; Scott N. Goldie; Mary Jane Heeg; L. A. Ochrymowycz; D. B. Rorabacher","Formation and Dissociation Kinetics and Crystal Structures of Nickel(II)-Macrocyclic Tetrathiaether Complexes in Acetonitrile. Comparison to Nickel(II)-Macrocyclic Tetramines","Inorganic Chemistry","2000","39","","1444","1453","10.1021/ic991019+","","","0.71073","MoKα","","0.0421","0.031","","0.0823","0.0773","","","","0.971","1.032","1.032","","","","","has coordinates","179379","2020-10-21","18:00:00",""
"4327643","9.5786","0.0005","14.179","0.0007","19.0814","0.001","90","","90","","90","","2591.5","0.2","295","2","295","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C18 H32 Cl2 Ni O8 S4 -","- C18 H32 Cl2 Ni O8 S4 -","- C72 H128 Cl8 Ni4 O32 S16 -","4","1","","Chandrika P. Kulatilleke; Scott N. Goldie; Mary Jane Heeg; L. A. Ochrymowycz; D. B. Rorabacher","Formation and Dissociation Kinetics and Crystal Structures of Nickel(II)-Macrocyclic Tetrathiaether Complexes in Acetonitrile. Comparison to Nickel(II)-Macrocyclic Tetramines","Inorganic Chemistry","2000","39","","1444","1453","10.1021/ic991019+","","","0.71073","MoKα","","0.0846","0.0554","","0.1453","0.1313","","","","0.971","1.123","1.123","","","","","has coordinates","179379","2020-10-21","18:00:00",""
"4327644","9.603","0.002","14.304","0.003","11.774","0.002","90","","105.48","0.03","90","","1558.6","0.6","295","2","295","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C22 H38 Cl2 N2 Ni O8 S4 -","- C22 H38 Cl2 N2 Ni O8 S4 -","- C44 H76 Cl4 N4 Ni2 O16 S8 -","2","1","","Chandrika P. Kulatilleke; Scott N. Goldie; Mary Jane Heeg; L. A. Ochrymowycz; D. B. Rorabacher","Formation and Dissociation Kinetics and Crystal Structures of Nickel(II)-Macrocyclic Tetrathiaether Complexes in Acetonitrile. Comparison to Nickel(II)-Macrocyclic Tetramines","Inorganic Chemistry","2000","39","","1444","1453","10.1021/ic991019+","","","0.71073","MoKα","","0.0723","0.0618","","0.1761","0.1627","","","","1.028","1.065","1.065","","","","","has coordinates,has disorder","179379","2020-10-21","18:00:00",""
"4327645","13.081","","13.429","","17.375","","90","","102.31","","90","","2982","","160","","160","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","dimanganese(mu-acetato)(mu-methoxy)(1,5-bis(5-bromosalicylidenamino) pentan-3-olato)(di-methanol)bromide","","- C24 H31 Br3 Mn2 N2 O8 -","- C24 H31 Br3 Mn2 N2 O8 -","- C96 H124 Br12 Mn8 N8 O32 -","4","1","","Claudia Palopoli; Benoit Chansou; Jean-Pierre Tuchagues; Sandra Signorella","Catalysis and Kinetics of Hydrogen Peroxide Disproportionation by Dinuclear Manganese(III) Complexes of 1,5-Bis(salicylidenamino)pentan-3-ol and the 5-Bromophenyl-Substituted Derivative","Inorganic Chemistry","2000","39","","1458","1462","10.1021/ic991030+","","","0.71073","MoKα","","","0.0386","","","0.0454","","","","","0.8093","0.8093","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4327646","11.104","0.001","15.49","0.001","14.39","0.001","90","","106.02","0.02","90","","2379","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C44 H46 Co2 N8 O18 -","- C44 H46 Co2 N8 O18 -","- C88 H92 Co4 N16 O36 -","2","0.5","","Ming-Liang Tong; Hong-Ji Chen; Xiao-Ming Chen","Molecular Ladders with Multiple Interpenetration of the Lateral Arms into the Squares of Adjacent Ladders Observed for [M2(4,4'-bpy)3(H2O)2(phba)2](NO3)2.4H2O (M = Cu2+ or Co2+; 4,4'-bpy = 4,4'-Bipyridine; phba = 4-Hydroxybenzoate)","Inorganic Chemistry","2000","39","","2235","2238","10.1021/ic991312+","","","0.71073","MoKα","","0.0706","0.0443","","","0.1077","0.116","","","","","","0.949","","","","has coordinates","179379","2020-10-21","18:00:00",""
"4327647","11.023","0.003","15.398","0.008","14.315","0.008","90","","106.02","","90","","2335.4","1.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C44 H46 Cu2 N8 O18 -","- C44 H46 Cu2 N8 O18 -","- C88 H92 Cu4 N16 O36 -","2","0.5","","Ming-Liang Tong; Hong-Ji Chen; Xiao-Ming Chen","Molecular Ladders with Multiple Interpenetration of the Lateral Arms into the Squares of Adjacent Ladders Observed for [M2(4,4'-bpy)3(H2O)2(phba)2](NO3)2.4H2O (M = Cu2+ or Co2+; 4,4'-bpy = 4,4'-Bipyridine; phba = 4-Hydroxybenzoate)","Inorganic Chemistry","2000","39","","2235","2238","10.1021/ic991312+","","","0.71073","MoKα","","0.0706","0.0456","","","0.1062","0.1189","","","","","","1.01","","","","has coordinates","179379","2020-10-21","18:00:00",""
"4327648","15.38","0.005","13.037","0.005","16.649","0.005","90.33","0.05","91.2","0.1","89.71","0.09","3337","2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C55 H86 B N2 O13 P4 Re -","- C55 H86 B N2 O13 P4 Re -","- C110 H172 B2 N4 O26 P8 Re2 -","2","1","","Gabriele Albertin; Stefano Antoniutti; Alessia Bacchi; Giovanni B. Ballico; Emilio Bordignon; Giancarlo Pelizzi; Maria Ranieri; Paolo Ugo","Preparations, Structures, and Electrochemical Studies of Aryldiazene Complexes of Rhenium: Syntheses of the First Heterobinuclear and Heterotrinuclear Derivatives with Bis(diazene) or Bis(diazenido) Bridging Ligands","Inorganic Chemistry","2000","39","","3265","3279","10.1021/ic991393+","","","0.71069","MoKα","","0.097","0.0384","","","0.0811","0.097","","","","","","0.829","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4327649","14.559","0.003","14.571","0.003","14.722","0.002","105.17","0.01","113.3","0.01","109.61","0.02","2404.9","1.1","295","","295","","","","","","","","?","4","P -1","-P 1","2","","","","- C18 H6 Co4 O14 -","- C18 H4.5 Co4 O14 -","- C72 H18 Co16 O56 -","4","2","","Hani Amouri; M. Gruselle; C. Da Silva; Bernard Malézieux; Roman Andrés; Jacqueline Vaissermann","Cobalt-Complexed Conjugated Diyne Salts: A Family of Rigid Masked Dielectrophiles. Syntheses, Structures, and Double Nucleophilic Substitutions","Inorganic Chemistry","2000","39","","5053","5058","10.1021/ic991433+","","","0.71069","MoKα","","","0.0342","","","0.0394","","","","","1.0322","1.0322","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4327650","12.758","0.003","13.36","0.003","20.494","0.003","90","","91.44","0.01","90","","3492","1.2","295","","295","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C22 H16 B2 Co4 F8 O12 S2 -","- C22 H4 B2 Co4 F8 O12 S2 -","- C88 H16 B8 Co16 F32 O48 S8 -","4","1","","Hani Amouri; M. Gruselle; C. Da Silva; Bernard Malézieux; Roman Andrés; Jacqueline Vaissermann","Cobalt-Complexed Conjugated Diyne Salts: A Family of Rigid Masked Dielectrophiles. Syntheses, Structures, and Double Nucleophilic Substitutions","Inorganic Chemistry","2000","39","","5053","5058","10.1021/ic991433+","","","0.71069","MoKα","","","0.0602","","","0.0714","","","","","1.0443","1.0443","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4327651","9.426","0.002","21.739","0.005","18.704","0.003","90","","94.86","0.01","90","","3818.9","1.3","295","","295","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C30 H18 B2 Co4 F8 N2 O12 -","- C30 H18 B2 Co4 F8 N2 O12 -","- C120 H72 B8 Co16 F32 N8 O48 -","4","1","","Hani Amouri; M. Gruselle; C. Da Silva; Bernard Malézieux; Roman Andrés; Jacqueline Vaissermann","Cobalt-Complexed Conjugated Diyne Salts: A Family of Rigid Masked Dielectrophiles. Syntheses, Structures, and Double Nucleophilic Substitutions","Inorganic Chemistry","2000","39","","5053","5058","10.1021/ic991433+","","","0.71069","MoKα","","","0.0474","","","0.0564","","","","","1.1514","1.1514","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4331387","10.9211","","6.5188","","13.7553","","90","","108.956","","90","","926.166","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Cs (Ag As2 Se4)","","- Ag As2 Cs Se4 -","- Ag As2 Cs Se4 -","- Ag4 As8 Cs4 Se16 -","4","1","","Wachhold, M.; Kanatzidis, M.G.","Cs3 Ag As4 Se8 and Cs Ag As2 Se4 : selenoarsenates with infinite (1 infty)(As Se2)(-) chains in different Ag(+) coordination environments","Inorganic Chemistry","2000","39","","2337","2343","10.1021/ic000027j","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4331390","25.212","","8.0748","","22.803","","90","","116.272","","90","","4162.74","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Cs3 (Ag As4 Se8)","","- Ag As4 Cs3 Se8 -","- Ag As4 Cs3 Se8 -","- Ag8 As32 Cs24 Se64 -","8","1","","Kanatzidis, M.G.; Wachhold, M.","Cs3 Ag As4 Se8 and Cs Ag As2 Se4 : selenoarsenates with infinite (1 infty)(As Se2)(-) chains in different Ag(+) coordination environments","Inorganic Chemistry","2000","39","","2337","2343","10.1021/ic000027j","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4331391","5.79109","","5.79109","","10.8168","","90","","90","","90","","362.76","","","","","","","","","","","","","3","I 4/m c m","-I 4 2c","140","","Ag (Au F4)","","- Ag Au F4 -","- Ag Au F4 -","- Ag4 Au4 F16 -","4","0.125","","Graudejus, O.; Wilkinson, A.P.; Bartlett, N.","Structural features of Ag (Au F4) and Ag (Au F6) and the structuralrelationship of Ag (Ag F4)2 and Au (Au F4)2 to Ag (Au F4)2","Inorganic Chemistry","2000","39","","1545","1548","10.1021/ic991178t","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4331392","4.6441","","4.6292","","23.765","","90","","101.28","","90","","501.042","","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","(K0.345 Ba0.655) Ag Te2","","- Ag Ba0.655 K0.345 Te2 -","- Ag Ba0.6555 K0.3445 Te2 -","- Ag4 Ba2.622 K1.378 Te8 -","4","2","","Hanko, J.; Gourdon, O.; Whangbo Myunghwan; Evain, M.; Petricek, V.; Kanatzidis, M.G.; Boucher, F.","A unique distortion in K1/3 Ba 2/3 Ag Te2: X-ray diffraction determination and electronic band structure analysis of its incommensurately modulated structure","Inorganic Chemistry","2000","39","","1398","1409","10.1021/ic991457g","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4331408","5.04664","","11.0542","","5.44914","","90","","97.17","","90","","301.612","","","","","","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","Ag (Ag F4)2","","- Ag3 F8 -","- Ag3 F8 -","- Ag6 F16 -","2","0.5","","Bartlett, N.; Graudejus, O.; Wilkinson, A.P.","Structural features of Ag (Au F4) and Ag (Au F6) and the structural relationship of Ag (Ag F4)2 and Au (Au F4)2 to Ag (Au F4)2","Inorganic Chemistry","2000","39","","1545","1548","10.1021/ic991178t","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4343556","7.886","","9.261","","19.191","","90","","92.82","","90","","1399.86","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(S4 (As F6)2) (As F3)","","- As3 F15 S4 -","- As3 F15 S4 -","- As12 F60 S16 -","4","1","","Cameron, T.S.; Dionne, I.; Passmore, J.; Parsons, S.; Brooke Jenkins, H.D.; Roobottom, H.K.","Preparation, X-ray crystal structure determination, lattice potential energy, and energetics of formation of the salt S4 (As F6)2 . (As F3) containing the lattice-stabilized tetrasulfur(2+) cation.","Inorganic Chemistry","2000","39","","2042","2052","","","","","","","","","","","","","","","","","","","","","","has coordinates","140487","2020-10-21","18:00:00",""
"4343565","8.2871","","15.352","","22.873","","90","","90","","90","","2909.98","","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","Sr6 Sb6 S17","","- S17 Sb6 Sr6 -","- S17 Sb6 Sr6 -","- S68 Sb24 Sr24 -","4","1","","Choi, K.-S.; Kanatzidis, M.G.","Sulfosalts with alkaline earth metals. Centrosymmetric vs acentric interplay in Ba3 Sb4.66 S10 and Ba2.62 Pb1.38 Sb4 S10 based on the Ba/Pb/Sb ratio. Phases related to arsenosulfide minerals of the rathite group and novel polysulfide Sr6 Sb6 S17","Inorganic Chemistry","2000","39","","5655","5662","","","","","","","","","","","","","","","","","","","","","","has coordinates","140572","2020-10-21","18:00:00",""
"4343566","8.955","","8.225","","26.756","","90","","100.29","","90","","1939.01","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Ba3 Sb4.667 S10","","- Ba3 S10 Sb4.667 -","- Ba3 S10 Sb4.667 -","- Ba12 S40 Sb18.668 -","4","1","","Choi, K.-S.; Kanatzidis, M.G.","Sulfosalts with alkaline earth metals. Centrosymmetric vs acentric interplay in Ba3 Sb4.66 S10 and Ba2.62 Pb1.38 Sb4 S10 based on the Ba/Pb/Sb ratio. Phases related to arsenosulfide minerals of the rathite group and novel polysulfide Sr6 Sb6 S17","Inorganic Chemistry","2000","39","","5655","5662","","","","","","","","","","","","","","","","","","","","","","has coordinates","140574","2020-10-21","18:00:00",""
"4343567","8.8402","","8.2038","","26.7623","","90","","99.488","","90","","1914.34","","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","Ba2.605 Pb1.39 Sb4 S10","","- Ba2.605 Pb1.39 S10 Sb4 -","- Ba2.605 Pb1.39 S10 Sb4 -","- Ba10.42 Pb5.56 S40 Sb16 -","4","2","","Choi, K.-S.; Kanatzidis, M.G.","Sulfosalts with alkaline earth metals. Centrosymmetric vs acentric interplay in Ba3 Sb4.66 S10 and Ba2.62 Pb1.38 Sb4 S10 based on the Ba/Pb/Sb ratio. Phases related to arsenosulfide minerals of the rathite group and novel polysulfide Sr6 Sb6 S17","Inorganic Chemistry","2000","39","","5655","5662","","","","","","","","","","","","","","","","","","","","","","has coordinates","140575","2020-10-21","18:00:00",""
"4343572","9.28673","","5.08216","","8.93493","","90","","90","","90","","421.699","","","","","","","","","","","","","4","P c 21 n","P -2n -2ac","33","","Rb (Ni P O4)","","- Ni O4 P Rb -","- Ni O4 P Rb -","- Ni4 O16 P4 Rb4 -","4","1","","Henry, P.F.; Hughes, R.W.; Weller, M.T.","Nikel phosphate based zeotype, Rb Ni P O4","Inorganic Chemistry","2000","39","","5420","5421","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4343573","33.076","","23.466","","23.537","","90","","110.701","","90","","17089.1","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","La48 Br81 Os8","","- Br81 La48 Os8 -","- Br81 La48 Os8 -","- Br324 La192 Os32 -","4","1","","Hong, S.-T.; Corbett, J.D.; Hoistad, L.M.","La48 Br81 Os8 : isolated clusters in an unusual superstructure with significantly greater intercluster bonding","Inorganic Chemistry","2000","39","","98","104","","","","","","","","","","","","","","","","","","","","","","has coordinates","140842","2020-10-21","18:00:00",""
"4343574","21.0215","","9.8341","","9.5223","","90","","97.292","","90","","1952.6","","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Rb2 (Mo O2)3 (As2 O7)2 (H2 O)2","","- As4 H4 Mo3 O22 Rb2 -","- As4 Mo3 O22 Rb2 -","- As16 Mo12 O88 Rb8 -","4","0.5","","Hsu, K.-F.; Wang, S.-L.","Synthesis and characterization of Rb2 (Mo O2)3 (As2 O7)2 . 2(H2 O): the first rubidium molybdenum(VI) diarsenate with a porous structure","Inorganic Chemistry","2000","39","","4654","4657","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4343575","19.975","","4.0016","","5.3119","","90","","90.818","","90","","424.547","","","","","","","","","","","","","2","C 1 2/m 1","-C 2y","12","","","","- Ir Te2 -","- Ir Te2 -","- Ir6 Te12 -","6","0.75","","Jobic, S.; Brec, R.; Koo, H.-J.; Chateau, C.; Leger, J.M.; Haines, J.; Whangbo Myunghwan","Synthesis and crystal structure determination of a new pressure-induced iridium ditelluride phase, m-(Ir Te2), and comparison of the crystal structures and relative stabilities of various Ir Te2 polymorphs","Inorganic Chemistry","2000","39","","4370","4373","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4343585","9.281","","12.4999","","6.2","","90","","106.36","","90","","690.149","","","","","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","(N D4)2 (Cu0.995 Zn0.005 (D2 O)6) (S O4)2","","- Cu0.995 D20 N2 O14 S2 Zn0.005 -","- Cu0.995 D20 N2 O14 S2 Zn0.005 -","- Cu1.99 D40 N4 O28 S4 Zn0.01 -","2","0.5","","Simmons, C.; Hitchman, M.A.; Astley, T.; Stratemeier, H.","Effect of Zn substitution on the crystal structure of (N D4)2 (Cu (Zn) (D2 O)6) (S O4)2","Inorganic Chemistry","2000","39","","4651","4653","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4343586","9.208","","12.4027","","6.274","","90","","106.22","","90","","687.996","","","","","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","(N D4)2 (Cu0.966 Zn0.034 (D2 O)6) (S O4)2","","- Cu0.966 D20 N2 O14 S2 Zn0.034 -","- Cu0.966 D20 N2 O14 S2 Zn0.034 -","- Cu1.932 D40 N4 O28 S4 Zn0.068 -","2","0.5","","Simmons, C.; Hitchman, M.A.; Stratemeier, H.; Astley, T.","Effect of Zn substitution on the crystal structure of (N D4)2 (Cu (Zn) (D2 O)6) (S O4)2","Inorganic Chemistry","2000","39","","4651","4653","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4343587","9.236","","12.5122","","6.246","","90","","106.86","","90","","690.779","","","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","(N H4)2 (Zn (H2 O)6) (S O4)2","","- H20 N2 O14 S2 Zn -","- H20 N2 O14 S2 Zn -","- H40 N4 O28 S4 Zn2 -","2","0.5","","Simmons, C.J.; Stratemeier, H.; Hitchman, M.A.","Influence of deuteration on the crystal structure of (N H4)2 (Zn (H2 O)6) (S O4)2","Inorganic Chemistry","2000","39","","6124","6126","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4343588","9.1434","","12.3689","","6.2828","","90","","106.918","","90","","679.795","","","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","(N D4)2 (Zn (D2 O)6) (S O4)2","","- D20 N2 O14 S2 Zn -","- D20 N2 O14 S2 Zn -","- D40 N4 O28 S4 Zn2 -","2","0.5","","Simmons, C.J.; Hitchman, M.A.; Stratemeier, H.","Influence of deuteration on the crystal structure of (N H4)2 (Zn (H2 O)6) (S O4)2","Inorganic Chemistry","2000","39","","6124","6126","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4343591","10.328","","10.328","","10.328","","90","","90","","90","","1101.66","","","","","","","","","","","","","2","P m -3 n","-P 4n 2 3","223","","","","- Ba8 Si46 -","- Ba8 Si46 -","- Ba8 Si46 -","1","0.0208333","","Yamanaka, S.; Enishi, E.; Fukuoka, H.; Yasukawa, M.","High-pressure synthesis of a new silicon clathrate superconductor, Ba8 Si46","Inorganic Chemistry","2000","39","","56","58","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4343593","6.7407","","6.7407","","6.7407","","88.83","","88.83","","88.83","","306.088","","","","","","","","","","","","","3","R -3 :R","-P 3*","148","","","","- Ce0.82 Mo6 Se8 -","- Ce0.814 Mo6 Se8 -","- Ce0.814 Mo6 Se8 -","1","0.166667","","le Berre, F.; Hamard, C.; Pena, O.; Wojakowski, A.","Structural studies on single crystals of Chevrel phase selenides RE Mo6 Se8 (RE= La, Ce, Pr, Nd, or Sm) at 298 K","Inorganic Chemistry","2000","39","","1100","1105","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4343594","6.7473","","6.7473","","6.7473","","88.69","","88.69","","88.69","","306.941","","","","","","","","","","","","","3","R -3 :R","-P 3*","148","","","","- Ce0.92 Mo6 Se8 -","- Ce0.924 Mo6 Se8 -","- Ce0.924 Mo6 Se8 -","1","0.166667","","le Berre, F.; Hamard, C.; Pena, O.; Wojakowski, A.","Structural studies on single crystals of Chevrel phase selenides RE Mo6 Se8 (RE= La, Ce, Pr, Nd, or Sm) at 298 K","Inorganic Chemistry","2000","39","","1100","1105","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4343595","6.7385","","6.7385","","6.7385","","88.81","","88.81","","88.81","","305.782","","","","","","","","","","","","","3","R -3 :R","-P 3*","148","","Pr0.86 Mo6 Se8","","- Mo6 Pr0.86 Se8 -","- Mo6 Pr0.861 Se8 -","- Mo6 Pr0.861 Se8 -","1","0.166667","","le Berre, F.; Hamard, C.; Pena, O.; Wojakowski, A.","Structural studies on single crystals of Chevrel phase selenides RE Mo6 Se8 (RE= La, Ce, Pr, Nd, or Sm) at 298 K","Inorganic Chemistry","2000","39","","1100","1105","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4343596","6.7286","","6.7286","","6.7286","","88.85","","88.85","","88.85","","304.449","","","","","","","","","","","","","3","R -3 :R","-P 3*","148","","Nd0.85 Mo6 Se8","","- Mo6 Nd0.85 Se8 -","- Mo6 Nd0.847 Se8 -","- Mo6 Nd0.847 Se8 -","1","0.166667","","le Berre, F.; Hamard, C.; Pena, O.; Wojakowski, A.","Structural studies on single crystals of Chevrel phase selenides RE Mo6 Se8 (RE= La, Ce, Pr, Nd, or Sm) at 298 K","Inorganic Chemistry","2000","39","","1100","1105","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4343597","6.7182","","6.7182","","6.7182","","88.956","","88.956","","88.956","","303.071","","","","","","","","","","","","","3","R -3 :R","-P 3*","148","","Sm0.87 Mo6 Se8","","- Mo6 Se8 Sm0.87 -","- Mo6 Se8 Sm0.871 -","- Mo6 Se8 Sm0.871 -","1","0.166667","","le Berre, F.; Hamard, C.; Pena, O.; Wojakowski, A.","Structural studies on single crystals of Chevrel phase selenides RE Mo6 Se8 (RE= La, Ce, Pr, Nd, or Sm) at 298 K","Inorganic Chemistry","2000","39","","1100","1105","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4343715","8.8452","","10.8891","","11.1008","","65.038","","74.701","","70.795","","905.553","","","","","","","","","","","","","4","P -1","-P 1","2","","(H3 O)2 (Ni (H2 O)6)2 (V10 O28 H6) (H2 O)4","","- H44 Ni2 O46 V10 -","- Ni2 O46 V10 -","- Ni2 O46 V10 -","1","0.5","","Ishaque Khan, M.; Tabussum, S.; Zheng, C.","Synthesis and characterisation of decavanadates: X-ray crystal structures of (H3 O)2 (M (H2 O)6)2 (V10 O28 H6) * 4(H2 O) (M = Co, Ni) and Na (H3 N (C H2)2 N H3)2.5 (V10 O28) * 5(H2 O)","Synthesis and Reactivity in Inorganic and Metal-Organic Chemistry","2000","30","","1773","1790","","","","","","","","","","","","","","","","","","","","","","has coordinates","147635","2020-10-21","18:00:00",""
"4343716","8.8539","","10.8742","","11.0934","","65.307","","74.396","","71.39","","908.171","","","","","","","","","","","","","4","P -1","-P 1","2","","(H3 O)2 (Co (H2 O)6)2 (V10 O28 H6) (H2 O)4","","- Co2 H44 O46 V10 -","- Co2 O46 V10 -","- Co2 O46 V10 -","1","0.5","","Ishaque Khan, M.; Tabussum, S.; Zheng, C.","Synthesis and characterisation of decavanadates: X-ray crystal structures of (H3 O)2 (M (H2 O)6)2 (V10 O28 H6) * 4(H2 O) (M = Co, Ni) and Na (H3 N (C H2)2 N H3)2.5 (V10 O28) * 5(H2 O)","Synthesis and Reactivity in Inorganic and Metal-Organic Chemistry","2000","30","","1773","1790","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4343717","10.5127","","10.6165","","15.683","","82.518","","78.564","","78.841","","1675.47","","","","","","","","","","","","","6","P -1","-P 1","2","","Na (H3 N (C H2)2 N H3)2.5 (V10 O28) (H2 O)5","","- C5 H35 N5 Na O33 V10 -","- C5 N5 Na O33 V10 -","- C10 N10 Na2 O66 V20 -","2","1","","Ishaque Khan, M.; Tabussum, S.; Zheng, C.","Synthesis and characterisation of decavanadates: X-ray crystal structures of (H3 O)2 (M (H2 O)6)2 (V10 O28 H6) * 4(H2 O) (M = Co, Ni) and Na (H3 N (C H2)2 N H3)2.5 (V10 O28) * 5(H2 O)","Synthesis and Reactivity in Inorganic and Metal-Organic Chemistry","2000","30","","1773","1790","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4343833","6.316","","6.316","","13.54","","90","","90","","90","","540.136","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","(N H4) (V O P O4) (H2 O)1.5","","- N O5 P V -","- N O5 P V -","- N4 O20 P4 V4 -","4","0.125","","Do, J.; Bontchev, R.; Jacobson, A.J.","A hydrothermal investigation of the 1/2V2 O5-H2 C2 O4/H3 P O4/N H4 O H system: synthesis and structures of (N H4) V O P O4 * 1.5(H2 O), (N H4) (N H4)0.5 V O P O4 * 1.5(H2 O), (N H4)2 [V O (H2 O)3]2 [V O (H2 O)] [V O (P O4)2] * 23(H2 O), (N H4)2 [V O (H P O4)]2 (C2 O4) (H2 O)","Inorganic Chemistry","2000","39","","3230","3237","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4344501","13.232","","15.5731","","26.015","","90","","90.952","","90","","5360","","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(Co1.04 (N H3)6)6 (K1.8 (H2 O)10) (Nd2 (C O3)8)2 (H2 O)20","","- Co6.25 H108 K1.76 N36 Nd4 O78.02 -","- Co6.25 H108 K1.76 N36 Nd4 O78.02 -","- Co12.5 H216 K3.52 N72 Nd8 O156.04 -","2","0.5","","Bond, D.L.; Clark, D.L.; Keogh, D.W.; Tait, C.D.; Donohoe, R.J.; Scott, B.L.; Gordon, J.C.; Gordon, P.L.; Watkin, J.G.","A new structural class of lanthanide carbonates: synthesis, properties and x-ray structure of the one-dimensional chain complex (Co(NH3)6)6 (K2(H2O)10) (Nd2(CO3)8)2 . 20 (H2O)","Inorganic Chemistry","2000","39","","3934","3937","","","","","","","","","","","","","","","","","","","","","","has coordinates","172696","2020-10-21","18:00:00",""
"4344505","10.2523","","12.2626","","12.3615","","69.041","","65.653","","87.789","","1311.32","","","","","","","","","","","","","5","P -1","-P 1","2","","(N H4)2 (V O (H2 O)3)2 (V O (H2 O)) (V O (P O4)2)2","","- H22 N2 O28 P4 V5 -","- N2 O28 P4 V5 -","- N4 O56 P8 V10 -","2","1","","Do, J.; Bontchev, R.P.; Jacobsen, A.J.","A hydrothermal investigation of the 1/2 V2O5 - H2C2O4 / H3PO4 / NH4OH system: synthesis and structures of (NH4)VO PO4 . 1.5(H2O), (NH4)0.5VOPO4 . 1.5(H2O), (NH4)2(VO(H2O)3)2 (VO(H2O))(VO(PO4)2)2 . 3(H2O), (NH4)2(VO(HPO4))2(C2O4) . 5 H2O","Inorganic Chemistry","2000","39","","3230","3237","","","","","","","","","","","","","","","","","","","","","","has coordinates","172890","2020-10-21","18:00:00",""
"4344515","4.877","","21.187","","5.307","","90","","91.42","","90","","548.199","","","","","","","","","","","","","6","P 1 21 1","P 2yb","4","","(Ag C N) (Ag Cl O4)2 (H2 O)2","","- C H4 Ag3 Cl2 N O10 -","- C Ag3 Cl2 N O10 -","- C2 Ag6 Cl4 N2 O20 -","2","1","","Guo, G.-C.; Wang, Q.-M.; Mak, T.","Variation of (Ag C N) chain configuration in silver(I) double salts: crystal structures of Ag C N * 2Ag N O3 and Ag C N * 2Ag Cl O4 * 2H2 O","Inorganic Chemistry Communications","2000","3","","313","315","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4344522","4.965","","10.211","","17.188","","90","","90","","90","","871.391","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Co4 Fe3.33 (V O4)6","","- Co4 Fe3.33 O24 V6 -","- Co4.004 Fe3.32 O24 V6 -","- Co8.008 Fe6.64 O48 V12 -","2","0.25","","Wang, X.; Vander Griend, A.; Stern, C.L.; Poeppelmeier, K.R.","Site-specific vanadates Co4 Fe3.33 (V O4)6 and Mn3 Fe4 (V O4)6","Inorganic Chemistry","2000","39","","136","140","","","","","","","","","","","","","","","","","","","","","","has coordinates","173432","2020-10-21","18:00:00",""
"4344525","5.345","","11.366","","6.233","","90","","101.98","","90","","370.415","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(Ag C N) (Ag N O3)2","","- C Ag3 N3 O6 -","- C Ag3 N3 O6 -","- C2 Ag6 N6 O12 -","2","0.5","","Guo, G.-C.; Wang, Q.-M.; Mak, T.","Variation of (Ag C N) chain configuration in silver(I) double salts: crystal structures of Ag C N * 2Ag N O3 and Ag C N * 2Ag Cl O4 * 2H2 O","Inorganic Chemistry Communications","2000","3","","313","315","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"5000141","8.126","0.002","15.217","0.004","12.998","0.002","90","","94.77","0.02","90","","1601.68","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C7 H6 N2 O4 -","- C7 H6 N2 O4 -","- C56 H48 N16 O32 -","8","2","","Sarma, Jagarlapudi A. R. P.; Nagaraju, Akula","Solid state nuclear bromination with N-bromosuccinimide. Part 1. Experimental and theoretical studies on some substituted aniline, phenol and nitro aromatic compounds","Journal of the Chemical Society, Perkin Transactions 2","2000","","6","1113","1118","10.1039/a905466i","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"5000145","12.7852","0.0008","8.8395","0.0003","13.9239","0.0008","90","","98.031","0.006","90","","1558.17","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C8 N8 O16 -","- C16 N16 O32 -","- C64 N64 O128 -","4","0.5","","Zhang, Mao-Xi; Eaton, Philip E.; Gilardi, Richard","Hepta- and Octanitrocubanes","Angewandte Chemie International Edition","2000","39","2","401","404","10.1002/(SICI)1521-3773(20000117)39:2<401::AID-ANIE401>3.0.CO;2-P","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"5000239","7.5059","0.0001","14.199","0.0003","28.7786","0.0001","90","","90","","90","","3067.12","","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C33 H50 O7 -","- C33 H50 O7 -","- C132 H200 O28 -","4","1","","Jiménez, Jorge I.; Yoshida, Wesley Y.; Scheuer, Paul J.; Lobkovsky, Emil; Clardy, Jon; Kelly, Michelle","Honulactones: New Bishomoscalarane Sesterterpenes from the Indonesian Sponge Strepsichordaia aliena","Journal of Organic Chemistry","2000","65","21","6837","6840","10.1021/jo991924b","","","","","","","","","","","","","","","","","","","","","has coordinates","175443","2020-10-21","18:00:00",""
"5000259","11.766","0.001","31.797","0.002","11.233","0.001","90","","90","","90","","4202.53","","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C44 H62 O8 -","- C44 H62 O8 -","- C176 H248 O32 -","4","1","","Kobayashi, Jun'ichi; Shimbo, Kazutaka; Sato, Masaaki; Shiro, Motoo; Tsuda, Masashi","Absolute Stereochemistry of Amphidinolides G and H","Organic Letters","2000","2","18","2805","2807","10.1021/ol006223b","","","","","","","","","","","","","","","","","","","","","has coordinates","176476","2020-10-21","18:00:00",""
"5000288","21.4725","0.0008","8.8163","0.0004","14.0146","0.0006","90","","90","","90","","2653.08","0.19","115","2","115","2","","","","","","","","7","C m c 21","C 2c -2","36","","","","- C21 H50 Cl N O P2 Ru -","- C21 H49 Cl N O P2 Ru -","- C84 H196 Cl4 N4 O4 P8 Ru4 -","4","0.5","","Coalter, Joseph N.; Huffman, John C.; Caulton, Kenneth G.","Cleavage of H-C(sp^2^) and C(sp^2^)-X Bonds (X = Alkyl, Aryl, OR, NR~2~): Facile Decarbonylation, Isonitrile Abstraction, or Dehydrogenation of Aldehydes, Esters, Amides, Amines, and Imines by [RuHCl(P^i^Pr~3~)~2~]~2~","Organometallics","2000","19","18","3569","3578","10.1021/om000390y","","","0.71073","MoKα","","","0.0193","","","","0.0225","","","","","","0.6094","","","","has coordinates,has disorder","176755","2020-10-21","18:00:00",""
"5000289","39.3311","0.0013","9.0754","0.0003","16.5133","0.0006","90","","99.6192","0.0012","90","","5811.5","0.3","115","2","115","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C26 H52 Cl N P2 Ru -","- C26 H52 Cl N P2 Ru -","- C208 H416 Cl8 N8 P16 Ru8 -","8","1","","Coalter, Joseph N.; Huffman, John C.; Caulton, Kenneth G.","Cleavage of H-C(sp^2^) and C(sp^2^)-X Bonds (X = Alkyl, Aryl, OR, NR~2~): Facile Decarbonylation, Isonitrile Abstraction, or Dehydrogenation of Aldehydes, Esters, Amides, Amines, and Imines by [RuHCl(P^i^Pr~3~)~2~]~2~","Organometallics","2000","19","18","3569","3578","10.1021/om000390y","","","0.71073","MoKα","","","0.0242","","","","0.0239","","","","","","0.726","","","","has coordinates,has disorder","176755","2020-10-21","18:00:00",""
"5000330","11.459","0.006","16.457","0.008","11.376","0.006","92.36","0.03","105.11","0.03","74.4","0.03","1993.9","1.8","108","","108","","","","","","","","","6","P -1","-P 1","2","","","","- C41 H35.5 Cl2 Fe2 N6.5 O5 -","- C41.5 H34 Cl2 Fe2 N6 O5 -","- C83 H68 Cl4 Fe4 N12 O10 -","2","1","","Seddon, Elisa J.; Yoo, Jae; Folting, Kirsten; Huffman, John C.; Hendrickson, David N.; Christou, George","Dinuclear and hexanuclear iron(III) carboxylate clusters with a bis(bipyridine) ligand: supramolecular aggregation of [Fe2O2] units to give a [Fe6O6] ladder structure †","Journal of the Chemical Society, Dalton Transactions","2000","","20","3640","","10.1039/b004925p","","","0.71069","MoKα","","","0.0448","","","","0.0457","","","","","","1.0395","","","","has coordinates,has disorder","176451","2020-10-21","18:00:00",""
"5000336","9.341","0.007","11.46","0.014","5.383","0.006","95.73","0.1","105.82","0.11","90.06","0.05","551.4","1.1","173","","173","","","","","","","","","5","P -1","-P 1","2","","","","- C22 H20 B2 F8 N4 -","- C22 H20 B2 F8 N4 -","- C22 H20 B2 F8 N4 -","1","0.5","","Seddon, Elisa J.; Yoo, Jae; Folting, Kirsten; Huffman, John C.; Hendrickson, David N.; Christou, George","Dinuclear and hexanuclear iron(III) carboxylate clusters with a bis(bipyridine) ligand: supramolecular aggregation of [Fe2O2] units to give a [Fe6O6] ladder structure †","Journal of the Chemical Society, Dalton Transactions","2000","","20","3640","","10.1039/b004925p","","","0.71069","MoKα","","","0.0707","","","","0.0719","","","","","","1.6417","","","","has coordinates,has disorder","176451","2020-10-21","18:00:00",""
"5000338","14.343","0.009","17.631","0.011","14.465","0.009","90","","90.12","0.03","90","","3658","4","104","","104","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C12 H20 Cl4 Fe N4 O4 -","- C33 H37 Cl3 Fe2 N6 O7 -","- C132 H148 Cl12 Fe8 N24 O28 -","4","0.5","","Seddon, Elisa J.; Yoo, Jae; Folting, Kirsten; Huffman, John C.; Hendrickson, David N.; Christou, George","Dinuclear and hexanuclear iron(III) carboxylate clusters with a bis(bipyridine) ligand: supramolecular aggregation of [Fe2O2] units to give a [Fe6O6] ladder structure †","Journal of the Chemical Society, Dalton Transactions","2000","","20","3640","","10.1039/b004925p","","","0.71069","MoKα","","","0.0675","","","","0.0573","","","","","","2.322","","","","has coordinates,has disorder","176451","2020-10-21","18:00:00",""
"5000339","11.353","0.003","18.453","0.004","11.83","0.003","90","","112.917","0.01","90","","2282.8","1","105","","105","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H80 O4 P4 Ru2 -","- C40 H80 O4 P4 Ru2 -","- C80 H160 O8 P8 Ru4 -","2","0.5","","Torsten Gottschalk-Gaudig; John C. Huffman; Hélène Gérard; Odile Eisenstein; Kenneth G. Caulton","Unsaturated Ru(0) Species with a Constrained Bis-Phosphine Ligand: [Ru(CO)2(tBu2PCH2CH2PtBu2)]2. Comparison to [Ru(CO)2(PtBu2Me)2]","Inorganic Chemistry","2000","39","","3957","3962","10.1021/ic9911320","","","0.71069","MoKα","","","0.0669","","","","0.0376","","","","","","1.1184","","","","has coordinates,has disorder","176451","2020-10-21","18:00:00",""
"5000340","11.914","0.004","15.342","0.005","9.66","0.003","104.577","0.017","93.422","0.017","106.063","0.015","1626.1","0.9","105","","105","","","","","","","","","6","P -1","-P 1","2","","","","- C58 H78 Cl2 Mn4 N8 O26 -","- C57 H54 Cl2 Mn4 N8.298 O23.484 -","- C57 H54 Cl2 Mn4 N8.298 O23.484 -","1","0.5","","Jae Yoo; Euan K. Brechin; Akira Yamaguchi; Motohiro Nakano; John C. Huffman; A. L. Maniero; Louis-Claude Brunel; Kunio Awaga; Hidehiko Ishimoto; George Christou; David N. Hendrickson","Single-Molecule Magnets: A New Class of Tetranuclear Manganese Magnets","Inorganic Chemistry","2000","39","","3615","3623","10.1021/ic000237w","","","0.71069","MoKα","","","0.0871","","","","0.0679","","","","","","2.2652","","","","has coordinates,has disorder","130149","2020-10-21","18:00:00",""
"5000343","8.759","0.002","18.811","0.006","16.618","0.005","90","","104.75","0.015","90","","2647.8","1.3","107","","107","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H18 Fe2 N8 O13 -","- C22 H18 Fe2 N8 O13 -","- C88 H72 Fe8 N32 O52 -","4","1","","Seddon, Elisa J.; Yoo, Jae; Folting, Kirsten; Huffman, John C.; Hendrickson, David N.; Christou, George","Dinuclear and hexanuclear iron(III) carboxylate clusters with a bis(bipyridine) ligand: supramolecular aggregation of [Fe2O2] units to give a [Fe6O6] ladder structure †","Journal of the Chemical Society, Dalton Transactions","2000","","20","3640","","10.1039/b004925p","","","0.71069","MoKα","","","0.0483","","","","0.0476","","","","","","0.9517","","","","has coordinates,has disorder","176451","2020-10-21","18:00:00",""
"5000348","18.272","0.003","20.688","0.003","15.284","0.002","102.498","0.007","95.013","0.008","101.045","0.008","5485.9","1.4","105","","105","","","","","","","","","6","P -1","-P 1","2","","","","- C87 H111 Cl3 Fe6 N12 O33 -","- C87 H69 Cl3 Fe6 N12 O33.25 -","- C174 H138 Cl6 Fe12 N24 O66.5 -","2","1","","Seddon, Elisa J.; Yoo, Jae; Folting, Kirsten; Huffman, John C.; Hendrickson, David N.; Christou, George","Dinuclear and hexanuclear iron(III) carboxylate clusters with a bis(bipyridine) ligand: supramolecular aggregation of [Fe~2~O~2~] units to give a [Fe~6~O~6~] ladder structure","Journal of the Chemical Society, Dalton Transactions","2000","","20","3640","3648","10.1039/b004925p","","","0.71069","MoKα","","","0.0945","","","","0.1034","","","","","","2.2981","","","","has coordinates,has disorder","176451","2020-10-21","18:00:00",""
"5000350","13.353","0.002","11.228","0.001","17.536","0.002","90","","109.3","0.01","90","","2481.3","0.9","110","","110","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C18 H35 Cl4 N3 O Ru S -","- C18 H35 Cl4 N3 O Ru S -","- C72 H140 Cl16 N12 O4 Ru4 S4 -","4","1","","Christian Gemel; Kirsten Folting; Kenneth G. Caulton","New Approach to Ru(II) Pincer Ligand Chemistry. Bis(tert-butylaminomethyl)pyridine Coordinated to Ruthenium(II)","Inorganic Chemistry","2000","39","","1593","1597","10.1021/ic990737t","","","0.71069","","","","0.029","","","","0.0319","","","","","","1.0201","","","","has coordinates,has disorder","176451","2020-10-21","18:00:00",""
"5000385","14.0352","0.0004","10.8625","0.0003","19.6268","0.0006","90","","90","","90","","2992.25","","","","200","","","","","","","","","5","P n a 21","P 2c -2n","33","","fac-Tricarbonyl-(bis(bis(4-methylphenyl)phosphino)ethane)-hydrido-manganese","","- C33 H33 Mn O3 P2 -","- C33 H33 Mn O3 P2 -","- C132 H132 Mn4 O12 P8 -","4","1","","O'Keiffe, L. S.; Mitchell, A. C.; Becker, T. M.; Ho, D. M.; Mandal, S. K.","Reactions of [(CO)~3~(P-P)Mn]~2~ with primary alcohols, where, P-P is dppe {Ph~2~P(CH~2~)~2~PPh~2~}, dppp {Ph~2~P(CH~2~)~3~PPh~2~}, dppb {Ph~2~P(CH~2~)~4~PPh~2~}, dpppe {Ph~2~P(CH~2~)~5~PPh~2~}, dtpe {(p-tol)~2~P(CH~2~)~2~P(p-tol)~2~}, or dcpe {(^c^hex)~2~P(CH~2~)~2~P(^c^hex)~2~}. Synthesis of fac-(CO)~3~(P-P)MnH and the X-ray structure of fac-(CO)~3~(dtpe)MnH","Journal of Organometallic Chemistry","2000","613","1","13","","10.1016/S0022-328X(00)00473-3","","","","","","","3.92","","","3.92","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"5000386","17.8435","0.0003","16.5212","0.0002","19.8756","0.0003","90","","90","","90","","5859.25","","","","200","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","fac-Tricarbonyl-(1,3-bis(diphenylphosphino)propane-P,P')-(formato-O)-rhenium(i)","","- C31 H27 O5 P2 Re -","- C31 H27 O5 P2 Re -","- C248 H216 O40 P16 Re8 -","8","1","","Williams, M. T.; McEachin, C.; Becker, T. M.; Ho, D. M.; Mandal, S. K.","Synthesis and X-ray structures of manganese(I) and rhenium(I) formato complexes, fac-(CO)~3~(dppp)M—OC(H)O","Journal of Organometallic Chemistry","2000","599","2","308","312","10.1016/S0022-328X(99)00743-3","","","","","","","3.14","","","3.14","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"5000389","23.3892","0.0015","10.6998","0.0006","13.889","0.0009","90","","125.22","0.002","90","","2839.58","","","","200","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","bis(1,2-Dicarbadodecaborano)-(1,2-a:1',2'-i)tetrahydrobiphenylene toluene solv ate","","- C19 H36 B20 -","- C44 H78 B40 -","- C176 H312 B160 -","4","0.5","","A.Z.Bradley; A.D.Cohen; A.C.Jones; D.M.Ho; M.Jones Junior","","Tetrahedron Lett.","2000","41","","8695","","10.1016/S0040-4039(00)01580-X","","","","","","","5.59","","","5.59","","","","","","","","","","","has coordinates","176451","2020-10-21","18:00:00",""
"5000394","9.8213","0.0004","12.1285","0.0007","13.6158","0.0007","64.967","0.002","86.852","0.003","83.841","0.003","1460.97","","","","200","","","","","","","","","2","P -1","-P 1","2","","1,2,3,8-Tetraphenylbenz(e)acephenanthrylene","","- C44 H28 -","- C70 H28 -","- C140 H56 -","2","1","","Hayashi, Naoto; Ho, Douglas M.; Pascal, Jr, Robert A.","An unusual cobalt-mediated cleavage of a hindered alkyne","Tetrahedron Letters","2000","41","22","4261","4264","10.1016/S0040-4039(00)00667-5","","","","","","","5.05","","","5.05","","","","","","","","","","","has coordinates","175456","2020-10-21","18:00:00",""
"5000395","16.5203","0.0002","16.5203","0.0002","25.6779","0.0004","90","","90","","120","","6069.12","0.14","","","200","2","","","","","","","","3","P 32 2 1","P 32 2""","154","","2,5,8,12,15,18,21,25-Octa(t-butyl)diacenaphtho[1,2-l:1',2'-l']-benzo[1,2-j:4,5-j']difluoranthene-10,23-dione Ethyl Acetate Solvate","","- C94 H104 O6 -","- C94 H104 O6 -","- C282 H312 O18 -","3","0.5","","Watson, Jr, James A.; Pascal, Jr, Robert A.; Ho, Douglas M.; Kilway, Kathleen V.","Synthesis and structure of a twisted, colossal quinone","Tetrahedron Letters","2000","41","26","5005","5008","10.1016/S0040-4039(00)00773-5","","","0.71073","MoKα","","0.0706","0.0516","","0.1424","0.1294","","","","1.023","1.046","1.046","","","","","has coordinates,has disorder","277867","2022-09-15","08:51:11",""
"5000399","10.66","0.008","16.048","0.015","8.225","0.005","91.49","0.05","105.33","0.04","72.87","0.05","1294.8","1.8","103.15","","103.15","","","","","","","","","6","P -1","-P 1","2","","","","- C12 H38 B18 Br4 Co N -","- C12 H18 B18 Br4 Co N -","- C24 H36 B36 Br8 Co2 N2 -","2","1","","Santos, Erich C.; Pinkerton, Anthony B.; Kinkead, Scott A.; Hurlburt, Paul K.; Jasper, Steve A.; Sellers, Christopher W.; Huffman, John C.; Todd, Lee J.","Syntheses of nido-9,11-X~2~-7,8-C~2~B~9~H~10~- anions (X=Cl, Br or I) and the synthesis and structural characterization of N(C~2~H~5~)~4~[commo-3,3'-Co(4,7-Br~2~-3,1,2-CoC~2~B~9~H~9~)~2~]","Polyhedron","2000","19","15","1777","1781","10.1016/S0277-5387(00)00461-7","","","0.71069","MoKα","","","1.6022","","","","0.0482","","","","","","1.8596","","","","has coordinates,has disorder","176451","2020-10-21","18:00:00",""
"6000026","7.4319","0.0011","7.5997","0.0005","7.8402","0.0002","118.994","0.0009","101.66","0.0009","103.431","0.0014","350.01","0.06","","","","","","","","","","","","7","P -1","-P 1","2","","","","- B Co0.12 H4 N O8 P2 Zn0.88 -","- B Co0.12 H4 N O8 P2 Zn0.88 -","- B2 Co0.24 H8 N2 O16 P4 Zn1.76 -","2","1","","Schäfer, G.; Borrmann, H.; Kniep, R.","Synthesis and crystal structure of NH4[(Zn1-xCox)BP2O8] (0 <= x <= 0.14), a metallo-borophosphate analogue of the zeolite gismondine","Microporous and Mesoporous Materials","2000","41","","161","167","10.1016/S1387-1811(00)00283-3","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","277869","2022-09-15","09:05:59",""
"6000027","11.726","0.0007","8.3745","0.0004","5.7062","0.0003","90","","90","","90","","560.35","","","","","","","","","","","","","4","C m c m","-C 2c 2","63","","","","- B2 Ga2 O7 Sr -","- B2 Ga2 O7 Sr -","- B8 Ga8 O28 Sr4 -","4","0.25","","Park, H.; Barbier, J.","Crystal structures of new gallo-borates MGa2B2O7, m = Sr, Ba","Journal of Solid State Chemistry","2000","154","","598","602","10.1006/jssc.2000.8901","","","","","","","","","","","","","","","","","","","","","has coordinates","277869","2022-09-15","09:05:59",""
"6000028","11.7434","0.0006","8.7076","0.0004","5.8038","0.0003","90","","90","","90","","593.48","","","","","","","","","","","","","4","C m c m","-C 2c 2","63","","","","- B2 Ba Ga2 O7 -","- B2 Ba Ga2 O7 -","- B8 Ba4 Ga8 O28 -","4","0.25","","Park, H.; Barbier, J.","Crystal structures of new gallo-borates MGa2B2O7, m = Sr, Ba","Journal of Solid State Chemistry","2000","154","","598","602","10.1006/jssc.2000.8901","","","","","","","","","","","","","","","","","","","","","has coordinates","277869","2022-09-15","09:05:59",""
"6000031","5.378","","5.4154","","7.6248","","90","","89.968","","90","","222.06","","","","","","","","","","","","","4","P 1 21/n 1","","","","","","- Al Ca2 Nb O6 -","","","","","","Vanderah, T. A.; Febo, W.; Chan, J. Y.; Roth, R. S.; Loezos, J. M.; Rotter, L. D.; Geyer, R. G.; Minor, D. B.","Phase equilibria and dielectric behavior in the CaO : Al2O3 : Nb2O5 system","Journal of Solid State Chemistry","2000","155","","78","85","10.1006/jssc.2000.8894","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000032","16.821","0.0005","9.379","0.0003","7.4568","0.0002","90","","90","","90","","1176.4","0.1","","","","","","","","","","","","5","I m m m","-I 2 2","71","","","","- C3 H12 O19 P4 V2 -","- C3 O11 P2 V2 -","- C12 O44 P8 V8 -","4","0.25","","Riou, D.; Serre, C.; Provost, J.; Ferey, G.","Hybrid open frameworks. Hydrothermal synthesis, structure determinations, and magnetic behavior of ((VO)-O-IV)(2)(H2O){O3P-(CH2)(3)-PO3}.2H(2)O: a new vanado-alkyldiphosphonate closely related to VO(HPO4).0.5H(2)O","Journal of Solid State Chemistry","2000","155","","238","242","10.1006/jssc.2000.8947","","","","","","","","","","","","","","","","","","","","","has coordinates","277869","2022-09-15","09:05:59",""
"6000033","8.146","","6.8989","","6.5932","","90","","90","","90","","370.53","","","","","","","","","","","","","4","P m n 21","","","","","","- Ag Cd2 Ga S4 -","","","","","","Chykhrij, S. I.; Parasyuk, O. V.; Halka, V. O.","Crystal structure of the new quaternary phase AgCd2GaS4 and phase diagram of the quasi-binary system AgGaS2-CdS","Journal of Alloys and Compounds","2000","312","","189","195","10.1016/S0925-8388(00)01145-2","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000034","6.804","0.0003","11.7456","0.0005","6.3187","0.0003","90","","110.851","0.003","90","","471.9","","","","","","","","","","","","","2","C 1 2/m 1","-C 2y","12","","","","- Cl3 Er -","- Cl12 Er4 -","- Cl12 Er4 -","","","","Krämer, K. W.; Güdel, H. U.; Fischer, P.; Fauth, F.; Fernandez-Diaz, M. T.; Hauß, T.","Triangular antiferromagnetic order in the honeycomb layer lattice of ErCl~3~","European Physical Journal B","2000","18","","39","47","10.1007/s100510070075","","","","","","","","","","","","","","","","","","","","","has coordinates","277869","2022-09-15","09:05:59",""
"6000035","12.998","0.002","7.5014","0.0003","15.156","0.003","90","","105.8","0.03","90","","1420.8","0.7","","","","","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- Cs2 O15 Si6 Ti -","- Cs2 O15 Si6 Ti -","- Cs8 O60 Si24 Ti4 -","4","1","","Nyman, M.; Bonhomme, F.; Teter, D. M.; Maxwell, R. S.; Gu, B. X.; Wang, L. M.; Ewing, R. C.; Nenoff, T. M.","Integrated experimental and computational methods for structure determination and characterization of a new, highly stable cesium silicotitanate phase, Cs~2~TiSi~6~O~15~ (SNL-A)","Chemistry of Materials","2000","12","","3449","3458","10.1021/cm000259g","","","","","","","","","","","","","","","","","","","","","has coordinates","277869","2022-09-15","09:05:59",""
"6000036","9.4302","","9.4302","","6.8911","","90","","90","","120","","530.72","","","","","","","","","","","","","4","P 63/m","","","","","","- Ca10 H2 O26 P6 -","","","","","","Kim, J. Y.; Fenton, R. R.; Hunter, B. A.; Kennedy, B. J.","Powder diffraction studies of synthetic calcium and lead apatites","Australian Journal of Chemistry","2000","53","","679","686","10.1071/CH00060","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000037","9.3475","0.0003","9.3475","0.0003","6.8646","0.0001","90","","90","","120","","519.5","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Ca10 F2 O24 P6 -","","","","","","Kim, J. Y.; Fenton, R. R.; Hunter, B. A.; Kennedy, B. J.","Powder diffraction studies of synthetic calcium and lead apatites","Australian Journal of Chemistry","2000","53","","679","686","10.1071/CH00060","","","","","","","","","","","","","","","","","","","","","","203334","2020-10-21","18:00:00",""
"6000038","9.5902","","9.5902","","6.7666","","90","","90","","120","","538.96","","","","","","","","","","","","","4","P 63/m","","","","","","- Ca10 Cl2 O24 P6 -","","","","","","Kim, J. Y.; Fenton, R. R.; Hunter, B. A.; Kennedy, B. J.","Powder diffraction studies of synthetic calcium and lead apatites","Australian Journal of Chemistry","2000","53","","679","686","10.1071/CH00060","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000039","9.6482","","9.6482","","6.7788","","90","","90","","120","","546.48","","","","","","","","","","","","","4","P 63/m","","","","","","- Br2 Ca10 O24 P6 -","","","","","","Kim, J. Y.; Fenton, R. R.; Hunter, B. A.; Kennedy, B. J.","Powder diffraction studies of synthetic calcium and lead apatites","Australian Journal of Chemistry","2000","53","","679","686","10.1071/CH00060","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000040","9.8612","","9.8612","","7.4242","","90","","90","","120","","625.23","","","","","","","","","","","","","4","P 63/m","","","","","","- H2 O26 P6 Pb10 -","","","","","","Kim, J. Y.; Fenton, R. R.; Hunter, B. A.; Kennedy, B. J.","Powder diffraction studies of synthetic calcium and lead apatites","Australian Journal of Chemistry","2000","53","","679","686","10.1071/CH00060","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000041","9.7547","","9.7547","","7.2832","","90","","90","","120","","600.18","","","","","","","","","","","","","4","P 63/m","","","","","","- F2 O24 P6 Pb10 -","","","","","","Kim, J. Y.; Fenton, R. R.; Hunter, B. A.; Kennedy, B. J.","Powder diffraction studies of synthetic calcium and lead apatites","Australian Journal of Chemistry","2000","53","","679","686","10.1071/CH00060","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000042","9.9767","","9.9767","","7.3255","","90","","90","","120","","631.45","","","","","","","","","","","","","4","P 63/m","","","","","","- Cl2 O24 P6 Pb10 -","","","","","","Kim, J. Y.; Fenton, R. R.; Hunter, B. A.; Kennedy, B. J.","Powder diffraction studies of synthetic calcium and lead apatites","Australian Journal of Chemistry","2000","53","","679","686","10.1071/CH00060","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000043","10.0618","","10.0618","","7.3792","","90","","90","","120","","646.98","","","","","","","","","","","","","4","P 63/m","","","","","","- Br2 O24 P6 Pb10 -","","","","","","Kim, J. Y.; Fenton, R. R.; Hunter, B. A.; Kennedy, B. J.","Powder diffraction studies of synthetic calcium and lead apatites","Australian Journal of Chemistry","2000","53","","679","686","10.1071/CH00060","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000044","16.387","","3.8258","","9.979","","90","","90","","90","","625.62","","","","","","","","","","","","","3","P n m a","","","","","","- P3 Pd4 Zr3 -","","","","","","Wang, M. T.; Mcdonald, R.; Mar, A.","Ternary early-transition-metal palladium pnictides Zr3Pd4P3, Hf3Pd4P3, HfPdSb, and Nb5Pd4P4","Inorganic Chemistry","2000","39","","4936","4941","10.1021/ic0006551","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000045","16.34","","3.7867","","9.954","","90","","90","","90","","615.9","","","","","","","","","","","","","3","P n m a","","","","","","- H3 P3 Pd4 -","","","","","","Wang, M. T.; Mcdonald, R.; Mar, A.","Ternary early-transition-metal palladium pnictides Zr3Pd4P3, Hf3Pd4P3, HfPdSb, and Nb5Pd4P4","Inorganic Chemistry","2000","39","","4936","4941","10.1021/ic0006551","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000046","6.754","","4.204","","7.701","","90","","90","","90","","218.66","","","","","","","","","","","","","3","P n m a","","","","","","- Hf Pd Sb -","","","","","","Wang, M. T.; Mcdonald, R.; Mar, A.","Ternary early-transition-metal palladium pnictides Zr3Pd4P3, Hf3Pd4P3, HfPdSb, and Nb5Pd4P4","Inorganic Chemistry","2000","39","","4936","4941","10.1021/ic0006551","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000047","10.3059","0.0012","10.3059","0.0012","3.6372","0.0005","90","","90","","90","","386.31","0.08","295","2","295","2","","","","","","","","3","I 4/m","-I 4","87","","niobium palladium phosphide","","- Nb5 P4 Pd4 -","- Nb5 P4 Pd4 -","- Nb10 P8 Pd8 -","2","0.125","","Meitian Wang; Robert McDonald; Arthur Mar","Ternary early-transition-metal palladium pnictides Zr3Pd4P3, Hf3Pd4P3, HfPdSb, and Nb5Pd4P4","Inorganic Chemistry","2000","39","","4936","4941","10.1021/ic0006551","","","0.71073","MoKα","","0.0703","0.0386","","","0.0638","0.0701","","","","","","0.879","","","","has coordinates","176292","2020-10-21","18:00:00",""
"6000048","6.709","","4.351","","5.154","","90","","90","","90","","150.45","","","","","","","","","","","","","4","P n m a","","","","","","- Cl H2 Hg N -","","","","","","Leineweber, A.; Jacobs, H.","Crystal growth and refinement of the crystal structure of mercury(II) amide chloride - HgClNH2","Zeitschrift Fur Anorganische Und Allgemeine Chemie","2000","626","","2143","2145","10.1002/1521-3749(200010)626:10<2143::AID-ZAAC2143>3.0.CO;2-Z","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000049","14.8976","","3.5625","","13.9229","","90","","106.301","","90","","709.22","","","","","","","","","","","","","4","I2/m","","","","","","- Cl2 H3 N Ni -","","","","","","Leineweber, A.; Jacobs, H.; Ehrenberg, H.","Crystal structure of Ni(NH3)Cl-2 and Ni(NH3)Br-2","Zeitschrift Fur Anorganische Und Allgemeine Chemie","2000","626","","2146","2152","10.1002/1521-3749(200010)626:10<2146::AID-ZAAC2146>3.0.CO;2-H","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000050","15.5764","","3.7435","","14.4224","","90","","105.894","","90","","808.82","","","","","","","","","","","","","4","I2/m","","","","","","- Br2 H3 N Ni -","","","","","","Leineweber, A.; Jacobs, H.; Ehrenberg, H.","Crystal structure of Ni(NH3)Cl-2 and Ni(NH3)Br-2","Zeitschrift Fur Anorganische Und Allgemeine Chemie","2000","626","","2146","2152","10.1002/1521-3749(200010)626:10<2146::AID-ZAAC2146>3.0.CO;2-H","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000051","5.7506","0.0003","5.7506","0.0003","61.413","0.002","90","","90","","120","","1758.8","0.2","","","293","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","","","- Ba11 Fe8 O41 Ti9 -","- Ba11 Fe6 O41 Ti11 -","- Ba22 Fe12 O82 Ti22 -","2","0.0833333","","Siegrist, Theo; Svensson, Christer; Vanderah, Terreil A.; Roth, Robert S.","Structural study of Ba11Fe8Ti9O41 by X-ray diffraction","Solid State Sciences","2000","2","","539","544","10.1016/S1293-2558(00)01073-6","","x-ray","0.71073","MoKα","","","0.0449","","","0.0584","","","","","","","","","","","has coordinates","190905","2020-10-21","18:00:00",""
"6000052","5.711","0.0004","14.699","0.001","8.823","0.0004","90","","90","","90","","740.66","0.08","","","293","","","","","","","","","3","C m c 21","C 2c -2","36","","","","- O9 Re2 V -","- O9 Re2 V -","- O36 Re8 V4 -","4","0.5","","Bastide, Beatrice; Enjalbert, Renee; Fuess, Hartmut; Galy, Jean","VO(ReO4)(2): solid state and structural chemistry","Solid State Sciences","2000","2","","545","552","10.1016/S1293-2558(00)01058-X","","x-ray","0.71069","MoKα","","","0.038","","","0.093","","","","","","","1.029","","","","has coordinates","190905","2020-10-21","18:00:00",""
"6000053","9.622","","10.921","","11.42","","100.73","","94.04","","108.08","","1110.22","","","","","","","","","","","","","6","P -1","","","","","","- C22 H20 Cl2 Cu2 N4 O3 -","","","","","","Kara, H.; Elerman, Y.; Prout, K.","Synthesis, crystal structure and magnetic properties of a (μ-hydroxo)(μ-pyrazolato) dicopper(II) complex","Zeitschrift für Naturforschung B","2000","55","9","796","802","10.1515/znb-2000-0903","","","","","","","","","","","","","","","","","","","","","","174973","2020-10-21","18:00:00",""
"6000054","5.0978","","8.8163","","5.0815","","90","","109.835","","90","","214.83","","","","","","","","","","","","","4","C 1 2/m 1","","","","","","- Li4 Mg O6 Re -","","","","","","Bieringer, M.; Greedan, J. E.; Luke, G. M.","Li4MgReO6: An S=1/2 antiferromagnet exhibiting spin-glass behavior","Physical Review B","2000","62","","6521","6529","10.1103/PhysRevB.62.6521","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000055","5.5014","","5.5014","","20.2457","","90","","90","","90","","612.74","","","","","","","","","","","","","4","P 42/m n m","","","","","","- Ba Gd2 Mn2 O7 -","","","","","","Kamegashira, N.; Satoh, H.; Mikami, T.","Superstructure of tetragonal BaGd2Mn2O7","Journal of Alloys and Compounds","2000","311","","69","73","10.1016/S0925-8388(00)00864-1","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000056","3.6554","","12.3954","","7.6316","","90","","90","","90","","345.79","","","","3.8","","","","","","","","","4","A m m 2","","","","","","- Al D1.1 Ni Tb -","","","","","","Brinks, H. W.; Yartys, V. A.; Hauback, B. C.; Fjellvag, H.; Yvon, K.; Gingl, F.; Vogt, T.","The magnetic structure of TbNiAlD1.1","Journal of Alloys and Compounds","2000","311","","114","119","10.1016/S0925-8388(00)01034-3","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000057","5.1131","","9.0183","","10.86","","90","","101.01","","90","","491.553","","","","","","","","","","","","","3","P 1 21/c 1","","","","","","- Hg2 Mo O4 -","","","","","","Mormann, T. J.; Jeitschko, W.","Mercury(I) molybdates and tungstates: Hg2WO4 and two modifications of Hg2MoO4","Inorganic Chemistry","2000","39","","4219","4223","10.1021/ic000331c","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000058","8.7352","","11.5519","","4.9305","","90","","115.196","","90","","450.19","","","","","","","","","","","","","3","C 1 2/c 1","","","","","","- Hg2 Mo O4 -","","","","","","Mormann, T. J.; Jeitschko, W.","Mercury(I) molybdates and tungstates: Hg2WO4 and two modifications of Hg2MoO4","Inorganic Chemistry","2000","39","","4219","4223","10.1021/ic000331c","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000059","8.73","","11.476","","4.9324","","90","","114.86","","90","","448.37","","","","","","","","","","","","","3","C 1 2/c 1","","","","","","- Hg2 O4 W -","","","","","","Mormann, T. J.; Jeitschko, W.","Mercury(I) molybdates and tungstates: Hg2WO4 and two modifications of Hg2MoO4","Inorganic Chemistry","2000","39","","4219","4223","10.1021/ic000331c","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000060","19.943","","3.2895","","6.2896","","90","","95.746","","90","","410.54","","","","","","","","","","","","","4","C 1 2/m 1","","","","","","- C8 H6 Co2 O6 -","","","","","","Huang, Z. L.; Drillon, M.; Masciocchi, N.; Sironi, A.; Zhao, J. T.; Rabu, P.; Panissod, P.","Ab-initio xrpd crystal structure and giant hysteretic effect (H-c=5.9 T) of a new hybrid terephthalate-based cobalt(II) magnet","Chemistry of Materials","2000","12","","2805","2812","10.1021/cm000386c","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000061","17.0694","0.0009","33.324","0.002","9.9536","0.0005","90","","90","","90","","5661.8","0.5","","","296","","","","","","","","","6","F m m 2","F 2 -2","42","","","","- Al6 N54 O7 Si30 Sm6 Sr10 -","- Al6 N54 O7 Si30 Sm6 Sr10 -","- Al24 N216 O28 Si120 Sm24 Sr40 -","4","0.25","","Lauterbach, Rainer; Schnick, Wolfgang","High-temperature synthesis and single-crystal X-ray structure determination of Sr10Sm6Si30Al6O7N54 - a layered sialon with an ordered distribution of Si, Al, O, and N","Solid State Sciences","2000","2","","463","472","10.1016/S1293-2558(00)00147-3","","x-ray","0.71073","MoKα","","","0.0706","","","0.1273","","","","","","","1.119","","","","has coordinates","190905","2020-10-21","18:00:00",""
"6000062","5.9888","","5.9916","","8.4667","","90","","90.026","","90","","303.81","","","","100","","","","","","","","","4","P 1 21/n 1","","","","","","- Ba2 Nd O6 Ru -","","","","","","Izumiyama, Y.; Doi, Y.; Wakeshima, M.; Hinatsu, Y.; Oikawa, K.; Shimojo, Y.; Morii, Y.","Magnetic and neutron diffraction studies of the ordered perovskite Ba2NdRuO6","Journal of Materials Chemistry","2000","10","","2364","2367","10.1039/b003629n","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000063","13.718","","13.718","","9.4526","","90","","90","","120","","1540.51","","","","","","","","","","","","","2","P 6","","","","","","- Al Po4 -","","","","","","Klap, G. J.; Van, Koningsveld H; Graafsma, H.; Schreurs, A. M. M.","Absolute configuration and domain structure of AlPO4-5 studied by single crystal X-ray diffraction","Microporous and Mesoporous Materials","2000","38","","403","412","10.1016/S1387-1811(00)00161-X","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000064","6.877","","6.877","","5.66","","90","","90","","90","","267.68","","","","","","","","","","","","","3","P 4/m c c","","","","","","- Au1.15 Cr2 Sn8.85 -","","","","","","Walle, C.; Torgersen, A. N.; Karlsen, O. B.; Kjekshus, A.; Klewe, B.","The ternary system Au-Cr-Sn and the crystal structure of Au1.15Cr2Sn8.85","Journal of Alloys and Compounds","2000","308","","126","133","10.1016/S0925-8388(00)01021-5","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000065","7.662","","7.662","","3.9041","","90","","90","","120","","198.49","","","","","","","","","","","","","3","P -6 2 m","","","","","","- Mn Sc6 Te2 -","","","","","","Maggard, P. A.; Corbett, J. D.","Sc6MTe2 (M = Mn, Fe, Co, Ni): Members of the flexible Zr6CoAl2-type family of compounds","Inorganic Chemistry","2000","39","","4143","4146","10.1021/ic0003269","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000066","7.6795","","7.6795","","3.8368","","90","","90","","120","","195.96","","","","","","","","","","","","","3","P -6 2 m","","","","","","- Fe Sc6 Te2 -","","","","","","Maggard, P. A.; Corbett, J. D.","Sc6MTe2 (M = Mn, Fe, Co, Ni): Members of the flexible Zr6CoAl2-type family of compounds","Inorganic Chemistry","2000","39","","4143","4146","10.1021/ic0003269","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000067","7.6977","","7.6977","","3.7855","","90","","90","","120","","194.26","","","","","","","","","","","","","3","P -6 2 m","","","","","","- Co Sc6 Te2 -","","","","","","Maggard, P. A.; Corbett, J. D.","Sc6MTe2 (M = Mn, Fe, Co, Ni): Members of the flexible Zr6CoAl2-type family of compounds","Inorganic Chemistry","2000","39","","4143","4146","10.1021/ic0003269","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000068","7.7235","","7.7235","","3.7656","","90","","90","","120","","194.53","","","","","","","","","","","","","3","P -6 2 m","","","","","","- Ni Sc6 Te2 -","","","","","","Maggard, P. A.; Corbett, J. D.","Sc6MTe2 (M = Mn, Fe, Co, Ni): Members of the flexible Zr6CoAl2-type family of compounds","Inorganic Chemistry","2000","39","","4143","4146","10.1021/ic0003269","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000069","6.719","","6.627","","4.893","","90","","90","","90","","217.87","","","","","","","","","","","","","3","P m m n","","","","","","- Li5 N4 Re -","","","","","","Chaushli, A.; Jacobs, H.; Weisser, U.; Strahle, J.","Li5ReN4, a lithium nitridorhenate(VII) with anti fluorite superstructure","Zeitschrift Fur Anorganische Und Allgemeine Chemie","2000","626","","1909","1914","10.1002/1521-3749(200009)626:9<1909::AID-ZAAC1909>3.0.CO;2-T","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000070","5.7676","","5.7676","","49.58","","90","","90","","120","","1428.33","","","","","","","","","","","","","4","P 63/m m c","","","","","","- Ba Co0.29 Mn0.72 O3 -","","","","","","Cherepanov, V. A.; Filonova, E. A.; Voronin, V. I.; Berger, I. F.","Phase equilibria in the LaCoO3-LaMnO3-BaCoOz-BaMnO3 system","Journal of Solid State Chemistry","2000","153","","205","211","10.1006/jssc.2000.8743","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000071","8.9978","","9.2581","","6.4742","","90","","91.629","","90","","539.1","","","","","","","","","","","","","4","C 1 2/c 1","","","","","","- Ca3.1 Cu0.9 O6 Ru -","","","","","","Moore, C. A.; Cussen, E. J.; Battle, P. D.","Synthesis, structural chemistry, and magnetic properties of Ca3.1Cu0.9RuO6","Journal of Solid State Chemistry","2000","153","","254","262","10.1006/jssc.2000.8751","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000072","6.956","","7.711","","8.57","","106.64","","106.63","","82.47","","421.4","","","","","","","","","","","","","5","P -1","","","","","","- H K O10 P3 Sm -","","","","","","Zouari, N.; Mhiri, T.; Daoud, A.; Gravereau, P.; Lebraud, E.","Crystal structure and Rietveld refinement using X-ray powder diffraction data of two potassium and ammonium-samarium condensed phosphates: KSmHP3O10 and NH4SmHP3O10","International Journal of Inorganic Materials","2000","2","","379","387","10.1016/S1466-6049(00)00036-2","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000073","6.9782","","7.7578","","8.623","","106.354","","105.961","","82.471","","429.93","","","","","","","","","","","","","0","P -1","","","","","","?","","","","","","Zouari, N.; Mhiri, T.; Daoud, A.; Gravereau, P.; Lebraud, E.","Crystal structure and Rietveld refinement using X-ray powder diffraction data of two potassium and ammonium-samarium condensed phosphates: KSmHP3O10 and NH4SmHP3O10","International Journal Of Inorganic Materials","2000","2","","379","387","10.1016/S1466-6049(00)00036-2","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000074","9.537","0.001","29.622","0.003","8.9398","0.0009","90","","121.19","0.04","90","","2160.5","0.3","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C8 H12 O22 Pb2 Zr -","- C8 H12 O22 Pb2 Zr -","- C32 H48 O88 Pb8 Zr4 -","4","0.5","","Boudaren, C.; Auffrédic, J. P.; Louër, M.; Louër, D.","Synthesis, structure determination from powder diffraction data, and thermal behavior of lead zirconium oaxalate hydrate Pb2Zr(C2O4)(4)center dot nH(2)O (3 < n < 9)","Chemistry of Materials","2000","12","","2324","2333","10.1021/cm001063j","","","","","","","","","","","","","","","","","","","","","has coordinates","277869","2022-09-15","09:05:59",""
"6000075","8.526","","7.608","","11.696","","90","","90","","90","","758.67","","","","","","","","","","","","","4","P m c 21","","","","","","- Ba5 Cl4 O7 Ti2 -","","","","","","Ingle, S. G.; Patil, N. M.","New ferroelectric Ba~5~Ti~2~O~7~Cl~4~","Japanese Journal of Applied Physics, Part 1: Regular Papers, Brief Communications & Review Papers","2000","39","","2670","2674","10.1143/JJAP.39.2670","","","","","","","","","","","","","","","","","","","","","","188692","2020-10-21","18:00:00",""
"6000077","7.3276","0.0001","8.1282","0.0001","9.7632","0.0001","90","","101.239","0.0007","90","","570.35","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- Ca H2 O7 P2 -","- Ca H2 O7 P2 -","- Ca4 H8 O28 P8 -","4","0.5","","Trommer, J.; Schneider, M.; Worzala, H.; Fitch, A. N.","Structure determination of CaH~2~P~2~O~7~ from in situ powder diffraction data","Materials Science Forum","2000","","","374","379","10.4028/www.scientific.net/MSF.321-324.374","powder diffraction","","","","","","","","","","","","0.065","","","","","","","","has coordinates","279539","2022-11-24","09:24:47",""
"6000078","9.977","","9.977","","9.977","","90","","90","","90","","993.12","","","","","","","","","","","","","5","Fm3m","","","","","","- C12 Co2 Cu K N12 -","","","","","","Ratuszna, A.; Małecki, G.","Crystal structure of cubic KMe[M(CN)~6~]~2~ and monoclinic Mn~3~[Fe(CN)~6~]~2~ with Me=Co, Ni, Cu; M=Co, Fe","Materials Science Forum","2000","","","947","953","10.4028/www.scientific.net/MSF.321-324.947","","","","","","","","","","","","","","","","","","","","","","188694","2020-10-21","18:00:00",""
"6000079","10.093","","10.093","","10.093","","90","","90","","90","","1028.16","","","","","","","","","","","","","5","Fm3m","","","","","","- C12 Co2 K N12 Ni -","","","","","","Ratuszna, A.; Małecki, G.","Crystal structure of cubic KMe[M(CN)~6~]~2~ and monoclinic Mn~3~[Fe(CN)~6~]~2~ with Me=Co, Ni, Cu; M=Co, Fe","Materials Science Forum","2000","","","947","953","10.4028/www.scientific.net/MSF.321-324.947","","","","","","","","","","","","","","","","","","","","","","188694","2020-10-21","18:00:00",""
"6000080","10.227","","10.227","","10.227","","90","","90","","90","","1069.66","","","","","","","","","","","","","4","Fm3m","","","","","","- C12 Co3 K N12 -","","","","","","Ratuszna, A.; Małecki, G.","Crystal structure of cubic KMe[M(CN)~6~]~2~ and monoclinic Mn~3~[Fe(CN)~6~]~2~ with Me=Co, Ni, Cu; M=Co, Fe","Materials Science Forum","2000","","","947","953","10.4028/www.scientific.net/MSF.321-324.947","","","","","","","","","","","","","","","","","","","","","","188694","2020-10-21","18:00:00",""
"6000081","10.059","","10.059","","10.059","","90","","90","","90","","1017.8","","","","","","","","","","","","","5","Fm3m","","","","","","- C12 Co Fe2 K N12 -","","","","","","Ratuszna, A.; Małecki, G.","Crystal structure of cubic KMe[M(CN)~6~]~2~ and monoclinic Mn~3~[Fe(CN)~6~]~2~ with Me=Co, Ni, Cu; M=Co, Fe","Materials Science Forum","2000","","","947","953","10.4028/www.scientific.net/MSF.321-324.947","","","","","","","","","","","","","","","","","","","","","","188694","2020-10-21","18:00:00",""
"6000082","10.121","","10.117","","10.136","","90","","92.92","","90","","1036.52","","","","","","","","","","","","","4","P 1 21/c 1","","","","","","- C12 Fe2 Mn3 N12 -","","","","","","Ratuszna, A.; Małecki, G.","Crystal structure of cubic KMe[M(CN)~6~]~2~ and monoclinic Mn~3~[Fe(CN)~6~]~2~ with Me=Co, Ni, Cu; M=Co, Fe","Materials Science Forum","2000","","","947","953","10.4028/www.scientific.net/MSF.321-324.947","","","","","","","","","","","","","","","","","","","","","","188694","2020-10-21","18:00:00",""
"6000083","3.77","","3.77","","12.076","","90","","90","","90","","171.63","","","","","","","","","","","","","4","P 4/n m m","","","","","","- La Li O4 Ti -","","","","","","Thangadurai, V.; Shukla, A. K.; Gopalakrishnan, J.; Joubert, O.; Brohan, L.; Tournoux, M.","X-ray powder diffraction study of LiLnTiO~4~ (Ln = La, Nd): a lithium-ion conductor","Materials Science Forum","2000","","","965","970","10.4028/www.scientific.net/MSF.321-324.965","","","","","","","","","","","","","","","","","","","","","","188694","2020-10-21","18:00:00",""
"6000084","3.7465","","3.7465","","11.895","","90","","90","","90","","166.96","","","","","","","","","","","","","4","P 4/n m m","","","","","","- Li Nd O4 Ti -","","","","","","Thangadurai, V.; Shukla, A. K.; Gopalakrishnan, J.; Joubert, O.; Brohan, L.; Tournoux, M.","X-ray powder diffraction study of LiLnTiO~4~ (Ln = La, Nd): a lithium-ion conductor","Materials Science Forum","2000","","","965","970","10.4028/www.scientific.net/MSF.321-324.965","","","","","","","","","","","","","","","","","","","","","","188694","2020-10-21","18:00:00",""
"6000085","7.1725","","10.299","","12.3691","","90","","90","","90","","913.7","","","","","","","","","","","","","5","P 21 21 21","","","","","","- H10 N O11 P V2 -","","","","","","Wilde, I.; Worzala, H.; Steinike, U.; Wolf, G. U.","NH~4~(VO~2~)~2~PO~4~ x 3H~2~O - ab initio structure analysis and its transformation during the ammoxidation of toluene","Materials Science Forum","2000","","","982","987","10.4028/www.scientific.net/MSF.321-324.982","","","","","","","","","","","","","","","","","","","","","","188694","2020-10-21","18:00:00",""
"6000086","10.3367","","10.3367","","10.3367","","90","","90","","90","","1104.45","","","","","","","","","","","","","4","P 21 3","","","","","","- Ce4 N6 O5 Si4 -","","","","","","Irran, E.; Kollisch, K.; Leoni, S.; Nesper, R.; Henry, P. F.; Weller, M. T.; Schnick, W.","Ce-4[Si4O4N6]O - a hyperbolically layered oxonitridosilicate oxide with an ordered distribution of oxygen and nitrogen","Chemistry - a European Journal","2000","6","","2714","2720","10.1002/1521-3765(20000804)6:15<2714::AID-CHEM2714>3.0.CO;2-J","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000087","6.7037","","3.9062","","3.9542","","90","","125.258","","90","","84.55","","","","","","","","","","","","","3","C 1 2/m 1","","","","","","- Bi2 Nd4 O9 -","","","","","","Lan, Y. C.; Chen, X. L.; Li, J. Q.","Structure of Bi2Nd4O9 monoclinic phase","Journal of Solid State Chemistry","2000","153","","30","33","10.1006/jssc.2000.8734","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000088","11.897","","5.277","","7.819","","90","","90","","90","","490.88","","","","","","","","","","","","","4","P n m a","","","","","","- Bi O6 P Zn2 -","","","","","","Ketatni, E.; Mernari, B.; Abraham, F.; Mentre, O.","Crystal structure of BiZn2PO6. Filiation between related compounds","Journal of Solid State Chemistry","2000","153","","48","54","10.1006/jssc.2000.8738","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000089","6.9937","0.0001","11.0014","0.0002","7.3404","0.0002","90","","107.98","0.02","90","","537.19","","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- O6 Pu Te2 -","- O6 Pu Te2 -","- O24 Pu4 Te8 -","4","1","","Krishnan, K.; Mudher, K. D. S.; Venugopal, V.","Structural and thermal studies on PuTe~2~O~6~","Journal of Alloys and Compounds","2000","307","","114","118","10.1016/S0925-8388(00)00841-0","","","","","","","","","","","","","","","","","","","","","has coordinates","277869","2022-09-15","09:05:59",""
"6000090","7.3827","","7.3827","","10.4152","","90","","90","","90","","567.67","","","","","","","","","","","","","4","I 41/a","","","","","","- Cd Cu2 S8 Sn3 -","","","","","","Chykhrij, S. I.; Sysa, L. V.; Parasyuk, O. V.; Piskach, L. V.","Crystal structure of the Cu2CdSn3S8 compound","Journal of Alloys and Compounds","2000","307","","124","126","10.1016/S0925-8388(00)00803-3","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000091","3.8994","","3.8994","","7.8502","","90","","90","","90","","119.36","","","","","","","","","","","","","3","P 4/m m m","","","","","","- Nb O3 Th0.25 -","","","","","","Chakhmouradian, A. R.; Mitchell, R. H.; Burns, P. C.","The A-site deficient ordered perovskite Th-0.25 square 0.75NbO3: a re-investigation","Journal of Alloys and Compounds","2000","307","","149","156","10.1016/S0925-8388(00)00830-6","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000092","7.9602","","5.6779","","5.6967","","90","","90.047","","90","","257.47","","","","","","","","","","","","","4","I2/m","","","","","","- Co O6 Pb2 W -","","","","","","Baldinozzi, G.; Calvarin, G.; Sciau, P.; Grebille, D.; Suard, E.","Neutron Rietveld refinement of the incommensurate phase of the ordered perovskite Pb2CoWO6","Acta Crystallographica B","2000","56","4","570","576","10.1107/S0108768100000677","","","","","","","","","","","","","","","","","","","","","","188498","2020-10-21","18:00:00",""
"6000095","11.48","","11.48","","87.46","","90","","90","","120","","9982.15","","","","","","","","","","","","","4","R 3","","","","","","- H3 Mo12 O40 P -","","","","","","Marosi, L.; Platero, E. E.; Cifre, J.; Arean, C. O.","Thermal dehydration of H3+xPVxM12-xO40 center dot yH(2)O Keggin type heteropolyacids; formation, thermal stability and structure of the anhydrous acids H3PM12O40, of the corresponding anhydrides PM12O38.5 and of a novel trihydrate H3PW12O40 3H(2)O","Journal of Materials Chemistry","2000","10","","1949","1955","10.1039/b001476l","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000096","5.7049","","5.7049","","8.0499","","90","","90","","90","","261.99","","","","","","","","","","","","","4","I 4/m c m","","","","","","- N O2 Sr Ta -","","","","","","Gunther, E.; Hagenmayer, R.; Jansen, M.","Structural investigations on the oxidenitrides SrTaO2N, CaTaO2N and LaTaON2 by neutron and X-ray powder diffraction","Zeitschrift Fur Anorganische Und Allgemeine Chemie","2000","626","","1519","1525","10.1002/1521-3749(200007)626:7<1519::AID-ZAAC1519>3.0.CO;2-I","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000097","8.0922","","8.0603","","5.7118","","90","","134.815","","90","","264.29","","","","","","","","","","","","","4","C 1 2/m 1","","","","","","- La N O2 Ta -","","","","","","Gunther, E.; Hagenmayer, R.; Jansen, M.","Structural investigations on the oxidenitrides SrTaO2N, CaTaO2N and LaTaON2 by neutron and X-ray powder diffraction","Zeitschrift Fur Anorganische Und Allgemeine Chemie","2000","626","","1519","1525","10.1002/1521-3749(200007)626:7<1519::AID-ZAAC1519>3.0.CO;2-I","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000098","5.6239","","7.8953","","5.5473","","90","","90","","90","","246.31","","","","","","","","","","","","","4","P n m a","","","","","","- Ca N O2 Ta -","","","","","","Gunther, E.; Hagenmayer, R.; Jansen, M.","Structural investigations on the oxidenitrides SrTaO2N, CaTaO2N and LaTaON2 by neutron and X-ray powder diffraction","Zeitschrift Fur Anorganische Und Allgemeine Chemie","2000","626","","1519","1525","10.1002/1521-3749(200007)626:7<1519::AID-ZAAC1519>3.0.CO;2-I","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000099","24.2599","","4.0506","","5.4437","","90","","102.69","","90","","521.87","","","","","","","","","","","","","2","C 1 2/m 1","","","","","","- Ga5 Pd13 -","","","","","","Wannek, C.; Harbrecht, B.","The crystal structure of Ga5Pd13 - a low-symmetrical ordering variant of the cubic close sphere packing","Zeitschrift Fur Anorganische Und Allgemeine Chemie","2000","626","","1540","1544","10.1002/1521-3749(200007)626:7<1540::AID-ZAAC1540>3.0.CO;2-T","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000100","5.3263","","5.3527","","7.5399","","90","","90","","90","","214.96","","","","300","","","","","","","","","3","P b n m","","","","","","- Ca Fe O3 -","","","","","","Woodward, P. M.; Cox, D. E.; Moshopoulou, E.; Sleight, A. W.; Morimoto, S.","Structural studies of charge disproportionation and magnetic order in CaFeO3","Physical Review B","2000","62","","844","855","10.1103/PhysRevB.62.844","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000101","5.3118","","5.3478","","7.5206","","90","","90.065","","90","","213.63","","","","15","","","","","","","","","3","P 1 21/n 1","","","","","","- Ca Fe O3 -","","","","","","Woodward, P. M.; Cox, D. E.; Moshopoulou, E.; Sleight, A. W.; Morimoto, S.","Structural studies of charge disproportionation and magnetic order in CaFeO3","Physical Review B","2000","62","","844","855","10.1103/PhysRevB.62.844","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000102","23.1962","","7.2381","","6.9652","","90","","90","","90","","1169.43","","","","","","","","","","","","","6","C m m m","","","","","","- H25 Na O51 Si12 Sr4 Ti5 -","","","","","","Braunbarth, C.; Hillhouse, H. W.; Tsapatsis, M.; Burton, A.; Lobo, R. F.; Jacubinas, R. M.; Kuznicki, S. M.","Structure of strontium ion-exchanged ETS-4 microporous molecular sieves","Chemistry of Materials","2000","12","","1857","1865","10.1021/cm9907211","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000103","10.18","","15.899","","23.227","","90","","90","","90","","3759.33","","","","","","","","","","","","","6","P 21 21 21","","","","","","- C10 H56 N10 O29 P6 Ti3 -","","","","","","Guo, Y. H.; Shi, Z.; Qu, X. J.; Pang, W. Q.","Studies on solvothermal synthesis and structure of a new titanium phosphate large single crystal","Gaodeng Xuexiao Huaxue Xuebao","2000","21","","1010","1012","","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000104","9.897","","13.337","","9.037","","90","","90","","90","","1192.85","","","","","","","","","","","","","4","P m m n","","","","","","- C12 H42 B10 N2 -","","","","","","Hofmann, K.; Albert, B.","Crystal structure of bis(triethylammonium)closo-decahydrodecaborate, [(C~2~H~5~)~3~NH]~2~[B~10~H~10~]","Zeitschrift für Naturforschung B","2000","55","6","499","503","10.1515/znb-2000-0610","","","","","","","","","","","","","","","","","","","","","","174974","2020-10-21","18:00:00",""
"6000105","3.8891","","3.8891","","27.9818","","90","","90","","90","","423.22","","","","","","","","","","","","","4","I 4/m m m","","","","","","- C Fe2 O9 Sr4 -","","","","","","Yamaura, K.; Huang, Q.; Lynn, J. W.; Erwin, R. W.; Cava, R. J.","Synthesis, crystal structure, and magnetic order of the layered iron oxycarbonate Sr4Fe2O6CO3","Journal of Solid State Chemistry","2000","152","","374","380","10.1006/jssc.2000.8665","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000106","3.813","0.0005","3.813","0.0005","34.723","0.0004","90","","90","","90","","504.84","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","","","- Ca1.85 Cu3.22 O10 Sr2 Tl1.93 -","- Ca3.7 Cu6.44 O20 Sr4 Tl3.86 -","- Ca3.7 Cu6.44 O20 Sr4 Tl3.86 -","","","","Kandyel, E.; Wu, X. J.; Tajima, S.","Annealing study on (Tl1-xHgx)(2)Sr2Ca2Cu3Oy and determination of its crystal structure by X-ray powder diffractometry","Journal of Physics and Chemistry of Solids","2000","61","","1379","1388","10.1016/S0022-3697(00)00021-4","","","","","","0.034","","","0.0453","","","","","","","","","","","","has coordinates","176292","2020-10-21","18:00:00",""
"6000107","12.7397","0.0013","9.1676","0.0009","9.2608","0.0007","90","","90","","90","","1081.59","","","","","","","","","","","","","3","P b c n","-P 2n 2ab","60","","","","- O12 S3 Y2 -","- O12 S3 Y2 -","- O48 S12 Y8 -","4","0.5","","Wickleder, M. S.","Anhydrous sulfates of rare earth elements: Syntheses and crystal structures of Y-2(SO4)(3) and Sc-2(SO4)(3)","Zeitschrift Fur Anorganische Und Allgemeine Chemie","2000","626","","1468","1472","10.1002/(SICI)1521-3749(200006)626:6<1468::AID-ZAAC1468>3.0.CO;2-M","","","","","","","","","","","","","","","","","","","","","has coordinates","203336","2020-10-21","18:00:00",""
"6000108","8.7071","0.0013","8.7071","0.0013","22.47","0.004","90","","90","","120","","1703.49","","","","","","","","","","","","","3","R -3 :H","-R 3","148","","","","- O12 S3 Sc2 -","- O12 S3 Sc2 -","- O72 S18 Sc12 -","6","0.333333","","Wickleder, M. S.","Anhydrous sulfates of rare earth elements: Syntheses and crystal structures of Y-2(SO4)(3) and Sc-2(SO4)(3)","Zeitschrift Fur Anorganische Und Allgemeine Chemie","2000","626","","1468","1472","10.1002/(SICI)1521-3749(200006)626:6<1468::AID-ZAAC1468>3.0.CO;2-M","","","","","","","","","","","","","","","","","","","","","has coordinates","203335","2020-10-21","18:00:00",""
"6000109","11.9022","0.0001","5.553","0.0001","7.3401","0.0001","90","","90.091","0.001","90","","485.13","","","","293","","","","","","","","","5","I 1 m 1","I -2y","8","","","","- Ba2 Cd H O11 P3 -","- Ba2 Cd O11 P3 -","- Ba4 Cd2 O22 P6 -","2","0.5","","Ben Taher, L.; Smiri, L.; Laligant, Y.; Le Bail, A.","Investigation of mixed divalent cation phosphates: synthesis and X-ray powder structure determination of CdBa2(P2O7)(HPO4)","Solid State Sciences","2000","2","","285","292","10.1016/S1293-2558(00)00126-6","powder diffraction","x-ray","1.5418","CuKα","","","","","","","","","0.037","","","","","","","","has coordinates","190905","2020-10-21","18:00:00",""
"6000110","4.3955","","4.3955","","6.015","","90","","90","","120","","100.65","","","","","","","","","","","","","3","P 63/m m c","","","","","","- Cu Sn Ti -","","","","","","Weitzer, F.; Perring, L.; Shibayanagi, T.; Naka, M.; Schuster, J. C.","Determination of the crystal structure of CuSnTi by full profile Rietveld analysis","Powder Diffraction","2000","15","","91","93","10.1017/S0885715600010897","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000111","5.7527","","5.7527","","21.0473","","90","","90","","120","","603.22","","","","","","","","","","","","","4","R -3 m","","","","","","- Ba2 La0.66 O8 V2 -","","","","","","Skakle, J. M. S.; Coats, A. M.; Marr, J.","The crystal structures of Ba2R2/3V2O8 (R = La, Nd) and Sr2La2/3V2O8; palmierite derivatives","Journal of Materials Science","2000","35","","3251","3256","10.1023/A:1004815120209","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000112","8.6826","","13.8828","","16.2484","","90","","90","","90","","1958.56","","","","","","","","","","","","","5","P n m a","","","","","","- Ga10 H38 O83 Si22 Sr5 -","","","","","","Lee, Y. J.; Kim, S. J.; Schoonen, M. A. A.; Parise, J. B.","Structural and Sr2+ ion exchange studies of gallosilicate TsG-1","Chemistry of Materials","2000","12","","1597","1603","10.1021/cm990789g","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000125","7.94","","24.562","","5.402","","90","","90","","90","","1053.51","","","","","","","","","","","","","4","P n a 21","","","","","","- C14 H9 N O3 -","","","","","","Zhukov, S. G.; Babaev, E. V.; Chernyshev, V. V.; Rybakov, V. B.; Sonneveld, E. J.; Schenk, H.","Crystal structure determination of 2-oxo-3-benzoyloxazolo[3,Z-a]pyridine from X-ray powder data","Zeitschrift für Kristallographie","2000","215","5","306","308","10.1524/zkri.2000.215.5.306","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000126","10.83","","5.763","","5.762","","90","","90","","90","","359.63","","","","","","","","","","","","","2","C m c a","","","","","","- Ge2 Ni -","","","","","","Takizawa, H.; Uheda, K.; Endo, T.","NiGe2: a new intermetallic compound synthesized under high-pressure","Journal of Alloys and Compounds","2000","305","","306","310","10.1016/S0925-8388(00)00733-7","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000127","13.382","0.002","13.382","0.002","13.382","0.002","90","","90","","90","","2396.4","0.6","296","2","296","2","","","","","","","","6","I -4 3 m","I -4 2 3","217","","","","- Al12 Ce10 N36 O18 Si18 Sr3 -","- Al12 Ce9.96 N36 O18 Si18 Sr3.04 -","- Al24 Ce19.92 N72 O36 Si36 Sr6.08 -","2","0.0416667","","Lauterbach, Rainer; Irran, Elisabeth; Henry, Paul F.; Weller, Mark T.; Schnick, Wolfgang","High-temperature synthesis, single-crystal X-ray and neutron powder diffraction, and materials properties of Sr3Ln10Si18Al12O18N36 (Ln = Ce, Pr, Nd)—novel sialons with an ordered distribution of Si, Al, O, and N","Journal of Materials Chemistry","2000","10","6","1357","1364","10.1039/a908844j","","","0.71073","MoKα","","0.0333","0.0298","","","0.0708","0.074","","","","","","1.116","","","","has coordinates","176428","2020-10-21","18:00:00",""
"6000128","13.3454","0.0006","13.3454","0.0006","13.3454","0.0006","90","","90","","90","","2376.81","0.19","293","2","293","2","","","","","","","","6","I -4 3 m","I -4 2 3","217","","","","- Al12 N36 O18 Pr10 Si18 Sr3 -","- Al12 N36 O18 Pr9.96 Si18 Sr3.04 -","- Al24 N72 O36 Pr19.92 Si36 Sr6.08 -","2","0.0416667","","Lauterbach, Rainer; Irran, Elisabeth; Henry, Paul F.; Weller, Mark T.; Schnick, Wolfgang","High-temperature synthesis, single-crystal X-ray and neutron powder diffraction, and materials properties of Sr3Ln10Si18Al12O18N36 (Ln = Ce, Pr, Nd)—novel sialons with an ordered distribution of Si, Al, O, and N","Journal of Materials Chemistry","2000","10","6","1357","1364","10.1039/a908844j","","","0.71073","MoKα","","0.0296","0.0261","","","0.0627","0.0646","","","","","","1.093","","","","has coordinates","176428","2020-10-21","18:00:00",""
"6000129","13.3285","0.0006","13.3285","0.0006","13.3285","0.0006","90","","90","","90","","2367.79","0.18","293","2","293","2","","","","","","","","6","I -4 3 m","I -4 2 3","217","","","","- Al12 N36 Nd10 O18 Si18 Sr3 -","- Al12 N36 Nd9.96 O18 Si18 Sr3.04 -","- Al24 N72 Nd19.92 O36 Si36 Sr6.08 -","2","0.0416667","","Lauterbach, Rainer; Irran, Elisabeth; Henry, Paul F.; Weller, Mark T.; Schnick, Wolfgang","High-temperature synthesis, single-crystal X-ray and neutron powder diffraction, and materials properties of Sr3Ln10Si18Al12O18N36 (Ln = Ce, Pr, Nd)—novel sialons with an ordered distribution of Si, Al, O, and N","Journal of Materials Chemistry","2000","10","6","1357","1364","10.1039/a908844j","","","0.71073","MoKα","","0.0271","0.0249","","","0.0494","0.0501","","","","","","1.117","","","","has coordinates","176428","2020-10-21","18:00:00",""
"6000130","10.155","","7.4649","","16.8814","","90","","90","","90","","1279.71","","","","4.5","","","","","","","","","2","P b c a","","","","","","- C8 D10 -","","","","","","Ibberson, R. M.; David, W. I. F.; Parsons, S.; Prager, M.; Shankland, K.","The crystal structures of m-xylene and p-xylene, C8D10, at 4.5 k","Journal of Molecular Structure","2000","524","","121","128","10.1016/S0022-2860(99)00448-2","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000131","5.7337","","4.9485","","11.1385","","90","","100.713","","90","","310.53","","","","4.5","","","","","","","","","2","P 1 21/n 1","","","","","","- C8 D10 -","","","","","","Ibberson, R. M.; David, W. I. F.; Parsons, S.; Prager, M.; Shankland, K.","The crystal structures of m-xylene and p-xylene, C8D10, at 4.5 k","Journal of Molecular Structure","2000","524","","121","128","10.1016/S0022-2860(99)00448-2","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000132","4.444","0.001","15.514","0.006","11.261","0.007","90","","90","","90","","776.38","","","","","","","","","","","","","4","C m c m","","","","","","- Cs Hg Sb Se3 -","- Cs Hg Sb2 Se3 -","- Cs4 Hg4 Sb8 Se12 -","4","0.25","","Chen, Z.; Wang, R.-J.","Crystal structures and semiconductor properties of alkline metal selenides MHgSbSe~3~ (M = K, Rb, Cs)","Acta Chimica Sinica","2000","58","3","326","331","","","","","","","0.0605","","","0.1234","","","","","","","","","","","","has coordinates","188714","2020-10-21","18:00:00",""
"6000133","7.758","","11.234","","8.849","","90","","106.6","","90","","739.08","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- Hg Rb Sb Se3 -","- Hg Rb Sb Se3 -","- Hg4 Rb4 Sb4 Se12 -","4","1","","Chen, Z.; Wang, R.-J.","Crystal structures and semiconductor properties of alkaline metal selenides MHgSbSe~3~ (M = K, Rb, Cs)","Acta Chimica Sinica","2000","58","3","326","331","","","","","","","0.0552","","","0.1198","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"6000135","8.067","","7.5889","","7.3997","","90","","116.281","","90","","406.18","","","","","","","","","","","","","5","P 1 21/c 1","","","","","","- C2 H8 Cu2 O8 P2 -","","","","","","Riou, D.; Belier, F.; Serre, C.; Nogues, M.; Vichard, D.; Ferey, G.","Hybrid open-frameworks: hydrothermal synthesis, structure determinations and magnetic properties of MIL-29, two copper diphosphonates (Cu-II(H2O))(2){O3P-X-PO3} with X=C2H4, CH2-C6H4-CH2","International Journal of Inorganic Materials","2000","2","","29","33","10.1016/S1466-6049(99)00066-5","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000136","10.812","","7.577","","7.412","","90","","92.34","","90","","606.7","","","","","","","","","","","","","5","P 1 21/c 1","","","","","","- C8 H12 Cu2 O8 P2 -","","","","","","Riou, D.; Belier, F.; Serre, C.; Nogues, M.; Vichard, D.; Ferey, G.","Hybrid open-frameworks: hydrothermal synthesis, structure determinations and magnetic properties of MIL-29, two copper diphosphonates (Cu-II(H2O))(2){O3P-X-PO3} with X=C2H4, CH2-C6H4-CH2","International Journal of Inorganic Materials","2000","2","","29","33","10.1016/S1466-6049(99)00066-5","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000137","7.7791","","7.7791","","7.7791","","90","","90","","90","","470.75","","","","","","","","","","","","","4","Fm3m","","","","","","- Al Nb O6 Sr2 -","","","","","","Chan, J. Y.; Levin, I.; Vanderah, T. A.; Geyer, R. G.; Roth, R. S.","Subsolidus phase relations and dielectric properties in the SrO-Al2O3-Nb2O5 system","International Journal of Inorganic Materials","2000","2","","107","114","10.1016/S1466-6049(00)00014-3","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000138","7.1728","","5.8024","","19.733","","90","","97.332","","90","","814.56","","","","","","","","","","","","","4","P 1 21/c 1","","","","","","- Al Nb O8 Sr4 -","","","","","","Chan, J. Y.; Levin, I.; Vanderah, T. A.; Geyer, R. G.; Roth, R. S.","Subsolidus phase relations and dielectric properties in the SrO-Al2O3-Nb2O5 system","International Journal of Inorganic Materials","2000","2","","107","114","10.1016/S1466-6049(00)00014-3","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000139","12.374","","12.374","","3.8785","","90","","90","","90","","593.86","","","","","","","","","","","","","4","P 4 b m","","","","","","- Al0.7 Nb9.3 O30 Sr5.7 -","","","","","","Chan, J. Y.; Levin, I.; Vanderah, T. A.; Geyer, R. G.; Roth, R. S.","Subsolidus phase relations and dielectric properties in the SrO-Al2O3-Nb2O5 system","International Journal of Inorganic Materials","2000","2","","107","114","10.1016/S1466-6049(00)00014-3","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000140","16.2271","","9.5805","","18.9208","","90","","125.399","","90","","2397.75","","","","50","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- Mo3 O12 Sc2 -","- Mo3 O12 Sc2 -","- Mo24 O96 Sc16 -","8","2","","Evans, J. S. O.; Mary, T. A.","Structural phase transitions and negative thermal expansion in Sc2(MoO4)(3)","International Journal of Inorganic Materials","2000","2","","143","151","10.1016/S1466-6049(00)00012-X","","","","","","","","","","","","","","","","","","","","","has coordinates","208441","2020-10-21","18:00:00",""
"6000141","8.6676","","7.5312","","7.4054","","90","","94.508","","90","","481.91","","","","","","","","","","","","","5","P 1 21/c 1","","","","","","- Cu H6 N O5 P -","","","","","","Ivashkevich, L. S.; Lyakhov, A. S.; Shulga, N. V.; Trifonov, V. A.","The crystal structure of CuNH4PO4.H2O from X-ray powder diffraction data","Zeitschrift für Kristallographie","2000","215","4","231","234","10.1524/zkri.2000.215.4.231","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000142","13.952","","12.602","","11.524","","90","","90","","90","","2026.19","","","","","","","","","","","","","3","P b c a","","","","","","- Na2 Se5 Sn2 -","","","","","","Klepp, K. O.; Hainz, M.","Preparation and crystal structure of Na2Sn2Se5 - a novel chalcogenostannate(IV) with layered complex anions","Zeitschrift Fur Anorganische Und Allgemeine Chemie","2000","626","","863","866","10.1002/(SICI)1521-3749(200004)626:4<863::AID-ZAAC863>3.0.CO;2-N","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000143","7.0065","","11.7976","","19.52","","90","","90","","90","","1613.52","","","","","","","","","","","","","5","P b c n","","","","","","- F6 Ge5 H17.34 N4 O9.67 -","","","","","","Conradsson, T.; Zou, X. D.; Dadachov, M. S.","Synthesis and crystal structure of a novel germanate: (NH4)(4)[(GeO2)(3)(GeO1.5F3)(2)] 0.67H(2)O","Inorganic Chemistry","2000","39","","1716","1720","10.1021/ic9911217","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000144","3.976","","3.976","","40.554","","90","","90","","120","","555.21","","","","","","","","","","","","","3","R -3 m","","","","","","- Cu5.59 Ho2 P4.5 -","","","","","","Mozharivskyj, Y.; Kuz'ma, Y. B.","Ternary phosphide Ho2Cu6-xP5-y, its crystal structure, and REm+n(Cu2P3)(m)(Cu4P2)(n) relationship with other rhombohedral rare-earth copper phosphides","Journal of Solid State Chemistry","2000","151","","150","156","10.1006/jssc.2000.8639","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000146","3.5445","","15.661","","11.892","","90","","96.202","","90","","656.27","","","","","","","","","","","","","5","P 1 21/c 1","","","","","","- C4 H13 Co0.5 O14 Pd -","","","","","","Mulagaleev, R. F.; Solov'ev, L. A.; Blokhin, A. I.; Kirik, S. D.","Complexed palladium oxalates Co0.5H[Pd(C2O4)(2)] 6H(2)O and Zn0.5H[Pd(C2O4)(2)] 6H(2)O: Synthesis, thermal properties, and structure","Russian Journal of Coordination Chemistry","2000","26","","205","210","","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000147","3.5429","","15.6485","","11.9228","","90","","96.415","","90","","656.87","","","","","","","","","","","","","5","P 1 21/c 1","","","","","","- C4 H13 O14 Pd Zn0.5 -","","","","","","Mulagaleev, R. F.; Solov'ev, L. A.; Blokhin, A. I.; Kirik, S. D.","Complexed palladium oxalates Co0.5H[Pd(C2O4)(2)] 6H(2)O and Zn0.5H[Pd(C2O4)(2)] 6H(2)O: Synthesis, thermal properties, and structure","Russian Journal of Coordination Chemistry","2000","26","","205","210","","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000148","15.144","","3.596","","14.972","","90","","90.08","","90","","815.34","","","","","","","","","","","","","3","C 1 2/m 1","","","","","","- Ba1.13 O21 V8 -","","","","","","Oka, Y.; Yao, T.; Yamamoto, N.","Hydrothermal synthesis and crystal structure of a new barium vanadium bronze Ba1+xV8O21 with a tunnel structure","Journal of Solid State Chemistry","2000","150","","330","335","10.1006/jssc.1999.8598","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000149","7.723","","10.155","","12.505","","90","","90","","90","","980.73","","","","","","","","","","","","","4","P 21 21 21","","","","","","- B6 Na3 O13 V -","","","","","","Touboul, M.; Penin, N.; Nowogrocki, G.","Synthesis and crystal structure of the first fully characterized vanadoborate Na-3[B6O9(VO4)]","Journal of Solid State Chemistry","2000","150","","342","346","10.1006/jssc.1999.8600","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000150","5.552","","6.668","","6.124","","90","","115","","90","","205.47","","","","","","","","","","","","","4","P 1 21/a 1","","","","","Belloite","- Cl Cu H O -","","","","","","Schluter, J.; Klaska, K. H.; Gebhard, G.","Belloite, Cu(OH)Cl, a new mineral from Sierra Gorda, Antofagasta, Chile","Neues Jahrbuch Fur Mineralogie-Monatshefte","2000","","","67","73","","","","","","","","","","","","","","","","","","","","","","","201212","2020-10-21","18:00:00",""
"6000151","9.163","","9.163","","25.014","","90","","90","","120","","1818.82","","","","","","","","","","","","","4","R -3","","","","","","- Cl18 Nb6 Rb Ti -","","","","","","Nägele, A.; Anokhina, E.; Sitar, J.; Meyer, H. J.; Lachgar, A.","Synthesis and crystal structures of ATi[Nb~6~Cl~18~] compounds (A = K, Rb, Cs, In, Tl)","Zeitschrift für Naturforschung B","2000","55","2","139","144","10.1515/znb-2000-0202","","","","","","","","","","","","","","","","","","","","","","174975","2020-10-21","18:00:00",""
"6000152","9.1075","","9.1075","","17.0017","","90","","90","","120","","1221.3","","","","","","","","","","","","","0","P -3","","","","","","?","","","","","","Nägele, A.; Anokhina, E.; Sitar, J.; Meyer, H. J.; Lachgar, A.","Synthesis and crystal structures of ATi[Nb~6~Cl~18~] compounds (A = K, Rb, Cs, In, Tl)","Zeitschrift für Naturforschung B","2000","55","2","139","144","10.1515/znb-2000-0202","","","","","","","","","","","","","","","","","","","","","","174975","2020-10-21","18:00:00",""
"6000154","17.978","","13.561","","7.163","","90","","90","","90","","1746.34","","","","","","","","","","","","","4","C m c m","","","","","","- H10 O19 U3 V2 -","","","","","","Saadi, M.; Dion, C.; Abraham, F.","Synthesis and crystal structure of the pentahydrated uranyl orthovanadate (UO2)(3)(VO4)(2) 5H(2)O, precursor for the new (UO2)(3)(VO4)(2) uranyl-vanadate","Journal of Solid State Chemistry","2000","150","","72","80","10.1006/jssc.1999.8549","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000155","6.477","","14.948","","3.5725","","90","","93.496","","90","","345.24","","","","","","","","","","","","","3","P 1 21/n 1","","","","","","- C2 N3 Na -","","","","","","Jurgens, B.; Irran, E.; Schneider, J.; Schnick, W.","Trimerization of NaC2N3 to Na3C6N9 in the solid: Ab initio crystal structure determination of two polymorphs of NaC2N3 and of Na3C6N9 from X-ray powder diffractometry","Inorganic Chemistry","2000","39","","665","670","10.1021/ic991044f","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000157","11.0482","","23.3806","","3.5162","","90","","97.913","","90","","899.62","","","","","","","","","","","","","3","P 1 21/n 1","","","","","","- C6 N9 Na3 -","","","","","","Jurgens, B.; Irran, E.; Schneider, J.; Schnick, W.","Trimerization of NaC2N3 to Na3C6N9 in the solid: Ab initio crystal structure determination of two polymorphs of NaC2N3 and of Na3C6N9 from X-ray powder diffractometry","Inorganic Chemistry","2000","39","","665","670","10.1021/ic991044f","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000158","6.766","","11.205","","22.299","","90","","91.05","","90","","1690.27","","","","","","","","","","","","","4","P 1 21/c 1","","","","","","- Cs7 N3 O5 W2 -","","","","","","Stegen, H.; Jacobs, H.","Synthesis and crystal structure of a cesium oxo nitrido monotungstate(VI), Cs-7[WN1.5O2.5](2)","Zeitschrift Fur Anorganische Und Allgemeine Chemie","2000","626","","536","539","10.1002/(SICI)1521-3749(200002)626:2<536::AID-ZAAC536>3.0.CO;2-2","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000159","10.6233","","10.6233","","14.318","","90","","90","","120","","1399.37","","","","","","","","","","","","","3","R -3 m","","","","","","- B12 Re13 Tb8 -","","","","","","Mykhalenko, S. I.; Kuz'ma, Y. B.","The Tb-Re-B system: Phase equilibria and crystal structures","Polish Journal of Chemistry","2000","74","","163","171","","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000160","7.448","","7.552","","7.632","","90","","100.47","","90","","422.13","","","","298","","","","","","","","","5","P 1 21/n 1","","","","","","- H3 O8 P Rb2 S -","","","","","","Stiewe, A.; Sonntag, R.; Troyanov, S. I.; Hansen, T.; Kemnitz, E.","Synthesis and structure determination of Rb-2(HSO4)(H2PO4) and Rb-4(HSO4)(3)(H2PO4) by X-ray single crystal and neutron powder diffraction","Journal of Solid State Chemistry","2000","149","","9","15","10.1006/jssc.1999.8468","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000161","11.555","","7.536","","9.593","","90","","91.56","","90","","835.03","","","","160","","","","","","","","","5","P 1 21/c 1","","","","","","- H3 O8 P Rb2 S -","","","","","","Stiewe, A.; Sonntag, R.; Troyanov, S. I.; Hansen, T.; Kemnitz, E.","Synthesis and structure determination of Rb-2(HSO4)(H2PO4) and Rb-4(HSO4)(3)(H2PO4) by X-ray single crystal and neutron powder diffraction","Journal of Solid State Chemistry","2000","149","","9","15","10.1006/jssc.1999.8468","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000162","7.612","","14.795","","7.446","","90","","90","","90","","838.57","","","","","","","","","","","","","5","P 21 21 2","","","","","","- H5 O16 P Rb4 S3 -","","","","","","Stiewe, A.; Sonntag, R.; Troyanov, S. I.; Hansen, T.; Kemnitz, E.","Synthesis and structure determination of Rb-2(HSO4)(H2PO4) and Rb-4(HSO4)(3)(H2PO4) by X-ray single crystal and neutron powder diffraction","Journal of Solid State Chemistry","2000","149","","9","15","10.1006/jssc.1999.8468","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000163","11.6779","","11.6779","","16.1488","","90","","90","","90","","2202.27","","","","","","","","","","","","","3","I 41/a","","","","","","- O24 Re4 Sr11 -","","","","","","Bramnik, K. G.; Miehe, G.; Ehrenberg, H.; Fuess, H.; Abakumov, A. M.; Shpanchenko, R. V.; Pomjakushin, V. Y.; Balagurov, A. M.","Preparation, structure, and magnetic studies of a new Sr11Re4O24 double oxide","Journal of Solid State Chemistry","2000","149","","49","55","10.1006/jssc.1999.8493","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000164","5.7762","","13.271","","13.083","","90","","90","","90","","1002.89","","","","","","","","","","","","","3","C m c a","","","","","","- Ba4 O10 Ru3 -","","","","","","Carim, A. H.; Dera, P.; Finger, L. W.; Mysen, B.; Prewitt, C. T.; Schlom, D. G.","Crystal structure and compressibility of Ba4Ru3O10","Journal of Solid State Chemistry","2000","149","","137","142","10.1006/jssc.1999.8511","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000165","16.569","","5.791","","9.813","","90","","90.17","","90","","941.56","","","","","","","","","","","","","5","P 1 21/n 1","","","","","","- H2 K N3 O11 Zr -","","","","","","Benard-Rocherulle, P.; Louer, D.","Ab initio structure determination of new mixed zirconium hydroxide nitrates ZrM(OH)(2)(NO3)(3) (M = K, Rb) from X-ray powder diffraction data","Journal of Solid State Chemistry","2000","149","","167","175","10.1006/jssc.1999.8515","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000166","10.126","","16.492","","5.855","","90","","90","","90","","977.77","","","","","","","","","","","","","5","P b c n","","","","","","- H2 N3 O11 Rb Zr -","","","","","","Benard-Rocherulle, P.; Louer, D.","Ab initio structure determination of new mixed zirconium hydroxide nitrates ZrM(OH)(2)(NO3)(3) (M = K, Rb) from X-ray powder diffraction data","Journal of Solid State Chemistry","2000","149","","167","175","10.1006/jssc.1999.8515","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000167","11.276","","13.097","","16.751","","90","","90","","90","","2473.82","","","","","","","","","","","","","4","P b c n","","","","","","- B4 H11.2 O12.6 Rb2 -","","","","","","Touboul, M.; Penin, N.; Nowogrocki, G.","Crystal structure and thermal behavior of Rb-2[B4O5(OH)(4)] 3.6H(2)O","Journal of Solid State Chemistry","2000","149","","197","202","10.1006/jssc.1999.8522","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000168","8.424","","11.378","","13.16","","90","","92.06","","90","","1260.55","","","","","","","","","","","","","4","P 1 21/c 1","","","","","","- B4 Cs2 H10 O12 -","","","","","","Touboul, M.; Penin, N.; Nowogrocki, G.","Crystal structure and thermal behavior of Rb-2[B4O5(OH)(4)] 3.6H(2)O","Journal of Solid State Chemistry","2000","149","","197","202","10.1006/jssc.1999.8522","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000169","10.737","0.001","10.737","0.001","10.737","0.001","90","","90","","90","","1237.7","0.2","","","","","","","","","","","","2","P m -3 n","-P 4n 2 3","223","","","","- Hg20 Rb3 -","- Hg20 Rb3 -","- Hg40 Rb6 -","2","0.0416667","","Todorov, E.; Sevov, S. C.","Synthesis and structure of the alkali-metal amalgams A(3)Hg(20) (A = Rb, Cs), K3Hg11, Cs5Hg19, and A(7)Hg(31) (A = K, Rb)","Journal of Solid State Chemistry","2000","149","","419","427","10.1006/jssc.1999.8569","","","","","","","","","0.2595","0.2216","","","","","","","","","","","has coordinates","277869","2022-09-15","09:05:59",""
"6000170","10.913","0.001","10.913","0.001","10.913","0.001","90","","90","","90","","1299.7","0.3","","","","","","","","","","","","2","P m -3 n","-P 4n 2 3","223","","","","- Cs3 Hg20 -","- Cs3 Hg20 -","- Cs6 Hg40 -","2","0.0416667","","Todorov, E.; Sevov, S. C.","Synthesis and structure of the alkali-metal amalgams A(3)Hg(20) (A = Rb, Cs), K3Hg11, Cs5Hg19, and A(7)Hg(31) (A = K, Rb)","Journal of Solid State Chemistry","2000","149","","419","427","10.1006/jssc.1999.8569","","","","","","","","","0.1809","0.1556","","","","","","","","","","","has coordinates","277869","2022-09-15","09:05:59",""
"6000171","5.122","0.001","10.063","0.002","14.782","0.003","90","","90","","90","","761.9","0.3","","","","","","","","","","","","2","I m m m","-I 2 2","71","","","","- Hg11 K3 -","- Hg11 K3 -","- Hg22 K6 -","2","0.125","","Todorov, E.; Sevov, S. C.","Synthesis and structure of the alkali-metal amalgams A(3)Hg(20) (A = Rb, Cs), K3Hg11, Cs5Hg19, and A(7)Hg(31) (A = K, Rb)","Journal of Solid State Chemistry","2000","149","","419","427","10.1006/jssc.1999.8569","","","","","","","","","0.2102","0.1796","","","","","","","","","","","has coordinates","277869","2022-09-15","09:05:59",""
"6000172","10.85","0.002","10.85","0.002","10.21","0.002","90","","90","","120","","1040.9","0.3","","","","","","","","","","","","2","P 6/m m m","-P 6 2","191","","","","- Hg31 K7 -","- Hg31 K7 -","- Hg31 K7 -","1","0.0416667","","Todorov, E.; Sevov, S. C.","Synthesis and structure of the alkali-metal amalgams A(3)Hg(20) (A = Rb, Cs), K3Hg11, Cs5Hg19, and A(7)Hg(31) (A = K, Rb)","Journal of Solid State Chemistry","2000","149","","419","427","10.1006/jssc.1999.8569","","","","","","","","","0.2251","0.1816","","","","","","","","","","","has coordinates","277869","2022-09-15","09:05:59",""
"6000173","11","0.002","11","0.002","10.377","0.003","90","","90","","120","","1087.4","","","","","","","","","","","","","2","P 6/m m m","-P 6 2","","","","","- Hg31 Rb7 -","","","1","0.0416667","","Todorov, E.; Sevov, S. C.","Synthesis and structure of the alkali-metal amalgams A(3)Hg(20) (A = Rb, Cs), K3Hg11, Cs5Hg19, and A(7)Hg(31) (A = K, Rb)","Journal of Solid State Chemistry","2000","149","","419","427","10.1006/jssc.1999.8569","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000174","11.803","0.003","11.803","0.003","10.814","0.005","90","","90","","90","","1506.5","0.9","","","","","","","","","","","","2","I 4/m","-I 4","87","","","","- Cs5 Hg19 -","- Cs5 Hg19 -","- Cs10 Hg38 -","2","0.125","","Todorov, E.; Sevov, S. C.","Synthesis and structure of the alkali-metal amalgams A(3)Hg(20) (A = Rb, Cs), K3Hg11, Cs5Hg19, and A(7)Hg(31) (A = K, Rb)","Journal of Solid State Chemistry","2000","149","","419","427","10.1006/jssc.1999.8569","","","","","","","","","0.1576","0.1381","","","","","","","","","","","has coordinates","277869","2022-09-15","09:05:59",""
"6000175","10.362","","18.468","","12.066","","90","","124.53","","90","","1902.24","","","","","","","","","","","","","6","P 1 21/c 1","","","","","","- C22 H32 Br N2 Ni O2 -","","","","","","Lasocha, W.; Opozda, E.; Schenk, H.","Crystal structure of new Ni(II) complex with non-symmetrical bis-enaminone from powder diffraction data","Zeitschrift für Kristallographie","2000","215","1","34","38","10.1524/zkri.2000.215.1.34","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000178","14.98","0.002","7.4909","0.0008","6.1048","0.0009","90","","90","","110.39","0.01","642.12","","","","","","","","","","","","","3","P 1 1 21/a","-P 2ac","14","","","","- O8 Pr3 Re -","- O8 Pr3 Re -","- O32 Pr12 Re4 -","4","1","","Jeitschko, W.; Heumannskamper, D. K.; Rodewald, U. C.; Schriewer-Pottgen, M. S.","Preparation and crystal structure of rare earth rhenates: the series Ln(5)Re(2)O(12) with Ln = Y, Gd-Lu, and the praseodymium rhenates Pr3ReO8, Pr3Re2O10, and Pr4Re2O11","Zeitschrift Fur Anorganische Und Allgemeine Chemie","2000","626","","80","88","10.1002/(SICI)1521-3749(200001)626:1<80::AID-ZAAC80>3.0.CO;2-S","","","","","","","0.017","","","0.017","","","","","","","","","","","has coordinates","203888","2020-10-21","18:00:00",""
"6000179","3.3315","","3.3315","","7.6737","","90","","90","","90","","85.17","","","","","","","","","","","","","3","P 4/m m m","","","","","","- C3 B0.75 Sc3 -","","","","","","Shi, Y.; Bourgeois, L.; Leithe-Jasper, A.; Bando, Y.; Tanaka, T.","Sc3B0.75C3, a novel scandium boron carbide","Journal of Alloys and Compounds","2000","298","","99","106","10.1016/S0925-8388(99)00556-3","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000180","8.159","","9.485","","11.997","","110","","99.22","","100.57","","832.27","","","","","","","","","","","","","5","P -1","","","","","","- C12 H8 N2 S6 Zn -","","","","","","Chen, Z. R.; Li, J. H.; Li, H. J.; Su, W. P.; Cao, R.","Synthesis and crystal structure of compound [ZnS6(C12H8N2)]","Chinese Journal of Structural Chemistry","2000","19","","11","14","","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000185","5.732","","5.732","","9.383","","90","","90","","120","","266.98","","","","","","","","","","","","","3","P 63/m m c","","","","","","- Cu1.2 Pd1.8 Y -","","","","","","Kotur, B. Y.; Michor, H.; Bauer, E.; Hilscher, G.","The Y-Cu-Pd ternary system at 600 degrees c (0-25 at.% Y): a reinvestigation","Journal of Alloys and Compounds","2000","296","","285","289","10.1016/S0925-8388(99)00541-1","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000186","7.078","","7.078","","7.078","","90","","90","","90","","354.59","","","","","","","","","","","","","3","F -4 3 m","","","","","","- Cu3.77 Pd1.23 Y -","","","","","","Kotur, B. Y.; Michor, H.; Bauer, E.; Hilscher, G.","The Y-Cu-Pd ternary system at 600 degrees c (0-25 at.% Y): a reinvestigation","Journal of Alloys and Compounds","2000","296","","285","289","10.1016/S0925-8388(99)00541-1","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000233","9.936","","3.744","","20.994","","90","","93.3","","90","","779.69","","","","","","","","","","","","","2","C 1 2/m 1","","","","","","- Mn6 O11 -","","","","","","Cranswick, L. M. D.; Li, C.; White, T. J.; Bursill, L. A.","New M3O5-anatase intergrowth structures formed during low-temperature oxidation of anosovite","Journal of Solid State Chemistry","2000","150","","128","138","10.1006/jssc.1999.8564","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000472","22.0237","","22.3722","","7.2962","","90","","90","","90","","3594.97","","","","","","","","","","","","","6","F d d 2","","","","","","- C2 H18 Mn O20 P4 V2 -","","","","","","Barthelet, K.; Jouve, C.; Riou, D.; Ferey, G.","Hybrid open-frameworks: structure determinations and ferromagnetism of MIL-41 or (V(IV)O)(2)M(II)(H2O)(4){HO3P-CH2-PO3}(2).2H(2)O (M = Mn, Co, Ni, Zn): four mixed metallomethylendiphosphonates hydrothermally synthesized by using pre-assembled building units","Solid State Sciences","2000","2","","871","876","10.1016/S1293-2558(00)01093-1","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000474","12.688","","6.554","","12.697","","90","","95.21","","90","","1051.48","","","","","","","","","","","","","6","P 1 21/c 1","","","","","","- Al F6 H16 N O6 Zn -","","","","","","Adamczyk, B.; Troyanov, S. I.; Schneider, M.; Kemnitz, E.","Synthesis, crystal structure and thermal behaviour of fluoroaluminates of the composition (NH4)[M(H2O)(6)] (AlF6) (M = Zn, Ni), [Zn(H2O)(6)][AlF5(H2O)], and (PyH)(4)[Al2F10].4 H2O","Zeitschrift Fur Anorganische Und Allgemeine Chemie","2000","626","","2543","2548","10.1002/1521-3749(200012)626:12<2543::AID-ZAAC2543>3.0.CO;2-3","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000475","12.685","","6.517","","12.664","","90","","94.55","","90","","1043.61","","","","","","","","","","","","","6","P 1 21/c 1","","","","","","- Al F6 H16 N Ni O6 -","","","","","","Adamczyk, B.; Troyanov, S. I.; Schneider, M.; Kemnitz, E.","Synthesis, crystal structure and thermal behaviour of fluoroaluminates of the composition (NH4)[M(H2O)(6)] (AlF6) (M = Zn, Ni), [Zn(H2O)(6)][AlF5(H2O)], and (PyH)(4)[Al2F10].4 H2O","Zeitschrift Fur Anorganische Und Allgemeine Chemie","2000","626","","2543","2548","10.1002/1521-3749(200012)626:12<2543::AID-ZAAC2543>3.0.CO;2-3","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000476","10.769","","13.747","","6.487","","90","","100.02","","90","","945.7","","","","","","","","","","","","","5","C 1 2/m 1","","","","","","- Al F5 H14 O7 Zn -","","","","","","Adamczyk, B.; Troyanov, S. I.; Schneider, M.; Kemnitz, E.","Synthesis, crystal structure and thermal behaviour of fluoroaluminates of the composition (NH4)[M(H2O)(6)] (AlF6) (M = Zn, Ni), [Zn(H2O)(6)][AlF5(H2O)], and (PyH)(4)[Al2F10].4 H2O","Zeitschrift Fur Anorganische Und Allgemeine Chemie","2000","626","","2543","2548","10.1002/1521-3749(200012)626:12<2543::AID-ZAAC2543>3.0.CO;2-3","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000477","7.4364","","9.5646","","20.4537","","90","","90","","90","","1454.79","","","","","","","","","","","","","5","P b c 21","","","","","","- C3 H8 Fe O7 P -","","","","","","Riou-Cavellec, M.; Sanselme, M.; Greneche, J. M.; Ferey, G.","Hydrothermal synthesis, structural approach, magnetic and Mossbauer study of the layered Fe(III) carboxyethylphosphonate [Fe(OH)(H2O)(O3P-(CH2)(2)-CO2H)] or MIL-37","Solid State Sciences","2000","2","","717","724","10.1016/S1293-2558(00)01080-3","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000478","4.8716","","14.614","","15.825","","90","","94.06","","90","","1123.81","","","","","","","","","","","","","6","C 1 2/m 1","","","","","","- C2 H12 K2 O30 P4 V5 -","","","","","","Riou, D.; Serre, C.; Ferey, G.","Hybrid open frameworks - Hydrothermal synthesis and structure determination of MIL-33: a new vanadomethylendiphosphonate intercalating potassium cations","International Journal of Inorganic Materials","2000","2","","551","556","10.1016/S1466-6049(00)00056-8","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000479","9.287","","22.665","","8.966","","90","","91.82","","90","","1886.3","","","","","","","","","","","","","6","P 1 21/c 1","","","","","","- Ba Fe4 H5 Na O25 P6 -","","","","","","Korzenski, M. B.; Kolis, J. W.","Structural, magnetic, and ion-exchange properties of a new layered alkaline/alkaline earth iron phosphate: NaBaFe4(HPO4)(3)(PO4)(3).H2O","Inorganic Chemistry","2000","39","","5663","5668","10.1021/ic0001513","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000480","6.226","","16.241","","14.778","","90","","91.28","","90","","1493.93","","","","","","","","","","","","","6","P 1 21/c 1","","","","","","- C2 H24 N2 Ni6 O14 P2 -","","","","","","Escobal, J.; Pizarro, J. L.; Mesa, J. L.; Arriortua, M. I.; Rojo, T.","An ionic nickel(II) phosphate with ethylenediamine: (C2H10N2)[Ni(H2O)(6)](HPO4)(2). Hydrothermal synthesis, crystal structure, and spectroscopic properties","Journal of Solid State Chemistry","2000","154","","460","465","10.1006/jssc.2000.8865","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000481","9.864","","9.864","","30.353","","90","","90","","90","","2953.3","","","","","","","","","","","","","7","P 43 21 2","","","","","","- C4 H8 F4 Fe5 N4 O29 P7 -","","","","","","Choudhury, A.; Natarajan, S.","A three-dimensional iron(III) phosphate, [C2N2H10](2)[Fe5F4(PO4)(HPO4)(6)]","Journal of Solid State Chemistry","2000","154","","507","513","10.1006/jssc.2000.8871","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000482","9.6448","","8.877","","14.813","","90","","91.936","","90","","1267.52","","","","","","","","","","","","","6","P 1 2/n 1","","","","","","- C4 H25 N2 O29 P5 V4 -","","","","","","Do, J.; Bontchev, R. P.; Jacobson, A. J.","Hydrothermal synthesis and characterization of two mixed valence piperazine-vanadium phosphates: (C4H12N2)(H3O)[(VOPO4)(4)(H2O)H2PO4].3H(2)O and (C4H12N2)[(VO)(VO2)(2)(H2O)(PO4)(2)]","Journal of Solid State Chemistry","2000","154","","514","523","10.1006/jssc.2000.8872","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000483","6.165","","10.8206","","11.854","","66.598","","76.008","","83.439","","704.04","","","","","","","","","","","","","6","P -1","","","","","","- C4 H14 N2 O14 P2 V3 -","","","","","","Do, J.; Bontchev, R. P.; Jacobson, A. J.","Hydrothermal synthesis and characterization of two mixed valence piperazine-vanadium phosphates: (C4H12N2)(H3O)[(VOPO4)(4)(H2O)H2PO4].3H(2)O and (C4H12N2)[(VO)(VO2)(2)(H2O)(PO4)(2)]","Journal of Solid State Chemistry","2000","154","","514","523","10.1006/jssc.2000.8872","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000484","22.894","","7.568","","6.697","","90","","90","","90","","1160.33","","","","","","","","","","","","","6","P b c n","","","","","","- C3 H12 Co2 N2 O9 P2 -","","","","","","Choudhury, A.; Natarajan, S.; Rao, C. N. R.","Layered cobalt phosphates by the amine phosphate route","Journal of Solid State Chemistry","2000","155","","62","70","10.1006/jssc.2000.8892","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000485","8.608","","9.64","","17.258","","90","","93.23","","90","","1429.81","","","","","","","","","","","","","6","P 1 21/c 1","","","","","","- C3 H15 Co2 N2 O13 P3 -","","","","","","Choudhury, A.; Natarajan, S.; Rao, C. N. R.","Layered cobalt phosphates by the amine phosphate route","Journal of Solid State Chemistry","2000","155","","62","70","10.1006/jssc.2000.8892","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000486","12.6707","0.0002","8.24293","0.00008","18.4843","0.0002","90","","109.135","0.0007","90","","1823.91","0.04","","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C6 H20 N3 O13 P3 Zn3 -","- C6 N3 O13 P3 Zn3 -","- C24 N12 O52 P12 Zn12 -","4","1","","Kongshaug, Kjell Ove; Fjellvag, Helmer; Lillerud, Karl Petter","Synthesis and characterization of a novel layered zinc phosphate","Solid State Sciences","2000","2","","569","576","10.1016/S1293-2558(00)01064-5","powder diffraction","x-ray","0.52227","synchrotron","","","","","","","","","0.0844","","","","","","","","has coordinates","190905","2020-10-21","18:00:00",""
"6000487","12.2901","0.0002","8.4","0.0001","18.4991","0.0003","90","","114.25","0.001","90","","1741.26","0.05","","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C6 H18 N3 O12 P3 Zn3 -","- C6 N3 O12 P3 Zn3 -","- C24 N12 O48 P12 Zn12 -","4","1","","Kongshaug, Kjell Ove; Fjellvag, Helmer; Lillerud, Karl Petter","Synthesis and characterization of a novel layered zinc phosphate","Solid State Sciences","2000","2","","569","576","10.1016/S1293-2558(00)01064-5","powder diffraction","x-ray","1.5406","CuKα1","","","","","","","","","0.0607","","","","","","","","has coordinates","190905","2020-10-21","18:00:00",""
"6000488","5.2677","0.0005","13.3025","0.0013","14.7833","0.0014","90","","96.049","0.001","90","","1030.2","0.2","571","2","571","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C3 H13 N2 O8 P2 Zn -","- C3 H13 N2 O8 P2 Zn -","- C12 H52 N8 O32 P8 Zn4 -","4","1","","Amitava Choudhury; Srinivasan Natarajan; C. N. R. Rao","Formation of One-, Two-, and Three-Dimensional Open-Framework Zinc Phosphates in the Presence of a Tetramine","Inorganic Chemistry","2000","39","","4295","4304","10.1021/ic000366c","","","0.71073","MoKα","","0.0366","0.029","","0.0916","0.0783","","","","1.127","1.033","1.033","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"6000489","7.5151","0.0006","8.2553","0.0007","12.9115","0.0011","98.654","0.001","101.274","0.002","115.791","0.001","681.69","0.1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C3 H14 N2 O12 P3 Zn2 -","- C3 H14 N2 O12 P3 Zn2 -","- C6 H28 N4 O24 P6 Zn4 -","2","1","","Amitava Choudhury; Srinivasan Natarajan; C. N. R. Rao","Formation of one-, two-, and three-dimensional open-framework zinc phosphates in the presence of a tetramine","Inorganic Chemistry","2000","39","","4295","4304","10.1021/ic000366c","","","0.71073","MoKα","","0.0405","0.0345","","0.1017","0.0928","","","","1.047","1.045","1.045","","","","","has coordinates","176292","2020-10-21","18:00:00",""
"6000490","8.064","","8.457","","9.023","","111.9","","108","","103.6","","498.35","","","","","","","","","","","","","6","P -1","","","","","","- C3 H11 N2 O8 P2 Zn2 -","","","","","","Choudhury, A.; Natarajan, S.; Rao, C. N. R.","Formation of one-, two-, and three-dimensional open-framework zinc phosphates in the presence of a tetramine","Inorganic Chemistry","2000","39","","4295","4304","10.1021/ic000366c","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000491","5.218","","8.78","","16.081","","89.3","","83.5","","74.3","","704.56","","","","","","","","","","","","","6","P -1","","","","","","- C3 H12 N2 O12 P3 Zn3 -","","","","","","Choudhury, A.; Natarajan, S.; Rao, C. N. R.","Formation of one-, two-, and three-dimensional open-framework zinc phosphates in the presence of a tetramine","Inorganic Chemistry","2000","39","","4295","4304","10.1021/ic000366c","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000492","9.219","","15.239","","10.227","","90","","105.2","","90","","1386.51","","","","","","","","","","","","","6","P 1 21/c 1","","","","","","- C3 H11 N2 O16 P4 Zn4 -","","","","","","Choudhury, A.; Natarajan, S.; Rao, C. N. R.","Formation of one-, two-, and three-dimensional open-framework zinc phosphates in the presence of a tetramine","Inorganic Chemistry","2000","39","","4295","4304","10.1021/ic000366c","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000493","6.316","0.0005","6.316","0.0005","13.54","0.0015","90","","90","","90","","540.14","0.09","293","2","293","2","","","","","","","","5","I 4/m m m","-I 4 2","139","Vanadium phosphate","Ammoniumvanadylphosphatesesquihydrate","","- H7 N O6.5 P V -","- N2.428 O5 P V -","- N9.712 O20 P4 V4 -","4","0.125","","Junghwan Do; Ranko P. Bontchev; Allan J. Jacobson","A Hydrothermal Investigation of the 1/2V~2~O~5~-H~2~C~2~O~4~ / H~3~PO~4~ / NH~4~OH System: Synthesis and Structures of (NH~4~)VOPO~4~1.5H~2~O, (NH~4~) (NH~4~)~0.5~VOPO~4~1.5H~2~O, (NH~4~)~2~[VO(H~2~O)~3~]~2~[VO(H~2~O)][VO(PO~4~)~2~]~2~3H~2~O, and (NH~4~)~2~[VO(HPO~4~)]~2~(C~2~O~4~)H~2~O","Inorganic Chemistry","2000","39","","3230","3237","10.1021/ic0000303","","","0.71073","MoKα","","0.0332","0.0323","","0.0887","0.0878","","","","1.17","1.179","1.179","","","","","has coordinates","176292","2020-10-21","18:00:00",""
"6000494","6.9669","0.0006","17.6627","0.0015","8.9304","0.0008","90","","105.347","0.001","90","","1059.7","0.2","293","2","293","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","Vanadium phosphate","Hemiammoniumvanadyl(IV, V)phosphatesesquihydrate","","- H5 N0.5 O6.5 P V -","- H3.75 N0.5 O6.85 P V -","- H30 N4 O54.8 P8 V8 -","8","2","","Junghwan Do; Ranko P. Bontchev; Allan J. Jacobson","A Hydrothermal Investigation of the 1/2V~2~O~5~-H~2~C~2~O~4~ / H~3~PO~4~ / NH~4~OH System: Synthesis and Structures of (NH~4~)VOPO~4~1.5H~2~O, (NH~4~) (NH~4~)~0.5~VOPO~4~1.5H~2~O, (NH~4~)~2~[VO(H~2~O)~3~]~2~[VO(H~2~O)][VO(PO~4~)~2~]~2~3H~2~O, and (NH~4~)~2~[VO(HPO~4~)]~2~(C~2~O~4~)H~2~O","Inorganic Chemistry","2000","39","","3230","3237","10.1021/ic0000303","","","0.71073","MoKα","","0.061","0.0582","","0.136","0.1349","","","","1.337","1.368","1.368","","","","","has coordinates","176292","2020-10-21","18:00:00",""
"6000495","10.2523","","12.263","","12.362","","69.041","","65.653","","87.789","","1311.42","","","","","","","","","","","","","5","P -1","","","","","","- H28 N2 O21 P4 V5 -","","","","","","Do, J.; Bontchev, R. P.; Jacobson, A. J.","A hydrothermal investigation of the 1/2V(2)O(5)-H2C2O4/H3PO4/NH4OH system: Synthesis and structures of (NH4)VOPO4.1.5H(2)O, (NH4)(0.5)VOPO4.1.5H(2)O, (NH4)(2)[VO(H2O)(3)](2)[VO(H2O)][VO(PO4)(2)](2).3H(2)O, and (NH4)(2)[VO(HPO4)](2)(C2O4).5H(2)O","Inorganic Chemistry","2000","39","","3230","3237","10.1021/ic0000303","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000496","17.735","","6.418","","22.839","","90","","102.017","","90","","2542.64","","","","","","","","","","","","","6","C 1 2/m 1","","","","","","- C2 H22 N2 O20 P2 V2 -","","","","","","Do, J.; Bontchev, R. P.; Jacobson, A. J.","A hydrothermal investigation of the 1/2V(2)O(5)-H2C2O4/H3PO4/NH4OH system: Synthesis and structures of (NH4)VOPO4.1.5H(2)O, (NH4)(0.5)VOPO4.1.5H(2)O, (NH4)(2)[VO(H2O)(3)](2)[VO(H2O)][VO(PO4)(2)](2).3H(2)O, and (NH4)(2)[VO(HPO4)](2)(C2O4).5H(2)O","Inorganic Chemistry","2000","39","","3230","3237","10.1021/ic0000303","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000497","12.2071","","13.8855","","16.9832","","69.584","","71.204","","84.64","","2553.4","","","","","","","","","","","","","5","P -1","","","","","","- C90 H70 N18 O42 V16 -","","","","","","Hagrman, P. J.; Zubieta, J.","Structural influences of organonitrogen ligands on vanadium oxide solids. Hydrothermal syntheses and structures of the terpyridine vanadates [V2O4(terpy)(2)](3)[V10O28], [VO2(terpy)][V4O10], and [V9O22(terpy)(3)]","Inorganic Chemistry","2000","39","","3252","3260","10.1021/ic991473d","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000498","7.7771","0.0001","10.3595","0.0002","25.715","0.0004","90","","92.286","0.001","90","","2070.13","0.06","96","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H11 N3 O12 V5 -","- C15 H11 N3 O12 V5 -","- C60 H44 N12 O48 V20 -","4","1","","Pamela J. Hagrman; Jon Zubieta","Structural influences of organonitrogen ligands on vanadium oxide solids. Hydrothermal syntheses and structures of the terpyridine vanadates [V2O4(terpy)(2)](3)[V10O28], [VO2(terpy)][V4O10], and [V9O22(terpy)(3)]","Inorganic Chemistry","2000","39","","3252","3260","10.1021/ic991473d","","","0.71073","MoKα","","0.0636","0.0476","","","0.0901","0.0962","","","","","","1.15","","","","has coordinates","176292","2020-10-21","18:00:00",""
"6000499","23.7735","0.0016","9.4309","0.0006","25.3804","0.0017","90","","112.047","0.001","90","","5274.3","0.6","96","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C45 H33 N9 O22 V9 -","- C45 H33 N9 O22 V9 -","- C180 H132 N36 O88 V36 -","4","0.5","","Pamela J. Hagrman; Jon Zubieta","Structural influences of organonitrogen ligands on vanadium oxide solids. Hydrothermal syntheses and structures of the terpyridine vanadates [V2O4(terpy)(2)](3)[V10O28], [VO2(terpy)][V4O10], and [V9O22(terpy)(3)]","Inorganic Chemistry","2000","39","","3252","3260","10.1021/ic991473d","","","0.71073","MoKα","","0.0383","0.0281","","","0.0721","0.0765","","","","","","1.028","","","","has coordinates","208362","2020-10-21","18:00:00",""
"6000500","8.0248","0.0004","25.9554","0.0014","9.0127","0.0005","90","","100.151","0.001","90","","1847.8","0.2","293","2","293","2","","","","","","","hydrothermal synthesis","6","P 1 21 1","P 2yb","4","","","","- C12 H36 Ga4 N4 O30 P6 -","- C12 Ga4 N4 O30 P6 -","- C24 Ga8 N8 O60 P12 -","2","1","","Kwang-Hwa Lii; Ching-Yeh Chen","Synthesis and characterization of (R-C5H14N2)(2)[Ga-4(C2O4)(H2PO4)(2)(PO4)(4)].2H(2)O, a layered gallium phosphatooxalate containing a chiral amine","Inorganic Chemistry","2000","39","","3374","3378","10.1021/ic991356i","","","0.71073","MoKα","","0.0382","0.0348","","0.098","0.0957","","","","1.031","1.052","1.052","","","","","has coordinates","176292","2020-10-21","18:00:00",""
"6000501","7.494","","7.726","","17.852","","90","","97.7","","90","","1024.29","","","","","","","","","","","","","6","P 1 21/c 1","","","","","","- C3 H7 Co2 N O6 P -","","","","","","Choudhury, A.; Natarajan, S.","Inorganic hybrid open-framework structures: synthesis and structure of a cobalt phosphate-oxalate, [C4N2H12](0.5)[Co-2(HPO4)(C2O4)(1.5)]","Solid State Sciences","2000","2","","365","372","10.1016/S1293-2558(00)00146-1","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000502","19.1418","","8.5274","","14.5454","","90","","104.543","","90","","2298.17","","","","","","","","","","","","","6","C 1 2 1","","","","","","- C6 H23 Al3 N4 O17 P4 -","","","","","","Simon, N.; Loiseau, T.; Ferey, G.","Synthesis and crystal structure of MIL-32: a new chiral layered aluminophosphate templated with non chiral tris(2-aminoethyl)amine: Al3(PO4)(4), N4C6H21, H2O","Solid State Sciences","2000","2","","389","395","","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000503","5.812","","5.812","","5.812","","90","","90","","90","","196.33","","","","","","","","","","","","","3","P m -3 n","","","","","","- O4 Pd3 Sr -","","","","","","Smallwood, P. L.; Smith, M. D.; zur Loye, H. C.","Flux synthesis of alkaline earth palladates","Journal of Crystal Growth","2000","216","","299","303","10.1016/S0022-0248(00)00432-2","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000504","5.7356","","5.7356","","5.7356","","90","","90","","90","","188.68","","","","","","","","","","","","","3","P m -3 n","","","","","","- Ca O4 Pd3 -","","","","","","Smallwood, P. L.; Smith, M. D.; zur Loye, H. C.","Flux synthesis of alkaline earth palladates","Journal of Crystal Growth","2000","216","","299","303","10.1016/S0022-0248(00)00432-2","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000505","8.642","","19.346","","7.114","","90","","90","","90","","1189.38","","","","","","","","","","","","","7","P b c m","","","","","","- C3 H14 F Ga N2 O8 P2 -","","","","","","Walton, R. I.; Millange, F.; O'hare, D.; Paulet, C.; Loiseau, T.; Ferey, G.","Synthesis, structures, and reactivity of two compounds containing the tancoite-like [Ga(HPO4)(2)F](2-)(infinity) chain","Chemistry of Materials","2000","12","","1977","1984","10.1021/cm000195+","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000506","14.234","","14.234","","7.289","","90","","90","","90","","1476.8","","","","","","","","","","","","","3","I 4/m","","","","","","- F19 Sr5 V3 -","","","","","","Dahlke, P.; Graulich, J.; Welsch, M.; Pebler, J.; Babel, D.","Structural and magnetochemical studies of Ba5Mn3F19 and related compounds A(5)(II)M(3)(III)F(19)","Zeitschrift Fur Anorganische Und Allgemeine Chemie","2000","626","","1255","1263","10.1002/(SICI)1521-3749(200005)626:5<1255::AID-ZAAC1255>3.0.CO;2-J","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000507","14.235","","14.235","","7.281","","90","","90","","90","","1475.39","","","","","","","","","","","","","3","I 4/m","","","","","","- Cr3 F19 Sr5 -","","","","","","Dahlke, P.; Graulich, J.; Welsch, M.; Pebler, J.; Babel, D.","Structural and magnetochemical studies of Ba5Mn3F19 and related compounds A(5)(II)M(3)(III)F(19)","Zeitschrift Fur Anorganische Und Allgemeine Chemie","2000","626","","1255","1263","10.1002/(SICI)1521-3749(200005)626:5<1255::AID-ZAAC1255>3.0.CO;2-J","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000508","14.689","","14.689","","7.703","","90","","90","","90","","1662.05","","","","","","","","","","","","","3","I 4 c m","I 4 -2c","108","","","","- Ba5 F19 Mn3 -","- Ba5 F19 Mn3 -","- Ba20 F76 Mn12 -","4","0.25","","Dahlke, P.; Graulich, J.; Welsch, M.; Pebler, J.; Babel, D.","Structural and magnetochemical studies of Ba5Mn3F19 and related compounds A(5)(II)M(3)(III)F(19)","Zeitschrift Fur Anorganische Und Allgemeine Chemie","2000","626","","1255","1263","10.1002/(SICI)1521-3749(200005)626:5<1255::AID-ZAAC1255>3.0.CO;2-J","","","","","","","","","","","","","","","","","","","","","has coordinates","277869","2022-09-15","09:05:59",""
"6000509","14.835","","14.835","","7.667","","90","","90","","90","","1687.33","","","","","","","","","","","","","3","I 4/m","","","","","","- Ba5 F19 Fe3 -","","","","","","Dahlke, P.; Graulich, J.; Welsch, M.; Pebler, J.; Babel, D.","Structural and magnetochemical studies of Ba5Mn3F19 and related compounds A(5)(II)M(3)(III)F(19)","Zeitschrift Fur Anorganische Und Allgemeine Chemie","2000","626","","1255","1263","10.1002/(SICI)1521-3749(200005)626:5<1255::AID-ZAAC1255>3.0.CO;2-J","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000510","14.66","","14.66","","7.601","","90","","90","","90","","1633.57","","","","","","","","","","","","","3","I 4/m","","","","","","- Ba5 F19 Ga3 -","","","","","","Dahlke, P.; Graulich, J.; Welsch, M.; Pebler, J.; Babel, D.","Structural and magnetochemical studies of Ba5Mn3F19 and related compounds A(5)(II)M(3)(III)F(19)","Zeitschrift Fur Anorganische Und Allgemeine Chemie","2000","626","","1255","1263","10.1002/(SICI)1521-3749(200005)626:5<1255::AID-ZAAC1255>3.0.CO;2-J","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000511","13.7642","","15.6796","","4.6902","","90","","90","","90","","1012.23","","","","","","","","","","","","","6","P m m n","","","","","","- C4 H32 K4 O48 P8 V6 -","","","","","","Riou, D.; Baltazar, P.; Ferey, G.","Hybrid open-frameworks: synthesis and structures of four vanado-alkyldiphosphonates with occluded potassium cations","Solid State Sciences","2000","2","","127","134","10.1016/S1293-2558(00)00103-5","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000512","7.3807","","7.9984","","10.0641","","75.695","","69.178","","80.769","","536.37","","","","","","","","","","","","","6","P -1","","","","","","- C H4 K O11 P2 V2 -","","","","","","Riou, D.; Baltazar, P.; Ferey, G.","Hybrid open-frameworks: synthesis and structures of four vanado-alkyldiphosphonates with occluded potassium cations","Solid State Sciences","2000","2","","127","134","10.1016/S1293-2558(00)00103-5","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000513","14.4939","","10.2595","","18.6782","","90","","98.991","","90","","2743.33","","","","","","","","","","","","","6","C 1 2/c 1","","","","","","- C3 H13 K O14 P2 V2 -","","","","","","Riou, D.; Baltazar, P.; Ferey, G.","Hybrid open-frameworks: synthesis and structures of four vanado-alkyldiphosphonates with occluded potassium cations","Solid State Sciences","2000","2","","127","134","10.1016/S1293-2558(00)00103-5","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000514","14.6228","","10.2783","","18.2716","","90","","100.272","","90","","2702.16","","","","","","","","","","","","","6","C 1 2/c 1","","","","","","- C3 H10 K O12 P2 V2 -","","","","","","Riou, D.; Baltazar, P.; Ferey, G.","Hybrid open-frameworks: synthesis and structures of four vanado-alkyldiphosphonates with occluded potassium cations","Solid State Sciences","2000","2","","127","134","10.1016/S1293-2558(00)00103-5","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000515","12.588","0.0004","12.717","0.0008","7.5827","0.0008","90","","96.1","0.001","90","","1207","0.1","120","","120","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","dirubidium dizinc tri monohydrogenphosphate","","- H3 O12 P3 Rb2 Zn2 -","- H3 O12 P3 Rb2 Zn2 -","- H12 O48 P12 Rb8 Zn8 -","4","1","","Torben R. Jensen; Rita G. Hazell; Thomas Vosegaard; Hans J. Jakobsen","New rubidium zinc hydrogen phosphate, Rb2Zn2(HPO4)(3): Synthesis, crystal structure, and P-31 single-crystal nmr","Inorganic Chemistry","2000","39","","2026","2032","10.1021/ic9906757","","","0.71073","MoKα","","","0.036","","","0.045","","","","","1.37","1.37","","","","","has coordinates","176292","2020-10-21","18:00:00",""
"6000516","12.9207","","6.44","","10.4147","","90","","90","","90","","866.6","","303","2","","","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- F Ga H4 N O4 P -","- F2 Ga2 N2 O8 P2 -","- F8 Ga8 N8 O32 P8 -","4","1","","Loiseau, T.; Paulet, C.; Simon, N.; Munch, V.; Taulelle, F.; Ferey, G.","Hydrothermal synthesis and structural characterization of (NH4)GaPO4F, KTP-type and (NH4)(2)Ga-2(PO4) (HPO4)F-3, pseudo-KTP-type","Chemistry of Materials","2000","12","5","1393","1399","10.1021/cm991177z","","","","","","","","","","","","","","","","","","","","","has coordinates","132296","2020-10-21","18:00:00",""
"6000517","12.4967","","7.7015","","9.8463","","90","","90","","90","","947.64","","303","2","","","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- F3 Ga2 H9 N2 O8 P2 -","- F3 Ga2 N2 O8 P2 -","- F12 Ga8 N8 O32 P8 -","4","1","","Loiseau, T.; Paulet, C.; Simon, N.; Munch, V.; Taulelle, F.; Ferey, G.","Hydrothermal synthesis and structural characterization of (NH4)GaPO4F, KTP-type and (NH4)(2)Ga-2(PO4) (HPO4)F-3, pseudo-KTP-type","Chemistry of Materials","2000","12","5","1393","1399","10.1021/cm991177z","","","","","","","","","","","","","","","","","","","","","has coordinates","132296","2020-10-21","18:00:00",""
"6000518","8.8107","","10.2258","","20.9082","","90","","90","","90","","1883.75","","","","","","","","","","","","","7","P 21 21 21","","","","","","- C5 H19 F3 Ga3 N3 O12 P3 -","","","","","","Paulet, C.; Loiseau, T.; Ferey, G.","Hydrothermal synthesis (in water-dimethylformamide) and crystal structure of MIL-30, a new layered fluorinated gallium phosphate with 1,3-diaminopropane and dimethylamine as templates","Journal of Materials Chemistry","2000","10","","1225","1229","10.1039/a909315j","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000551","9.05","","14.591","","7.294","","90","","90","","90","","963.16","","","","90","","","","","","","","","3","P 21 21 21","","","","","","- C10 H16 S -","","","","","","Brunelli, M.; Fitch, A. N.; Mora, A. J.","Crystal structures of bicyclic organic molecules","Materials Science Forum","2000","","","1092","1097","10.4028/www.scientific.net/MSF.321-324.1092","","","","","","","","","","","","","","","","","","","","","","188694","2020-10-21","18:00:00",""
"6000552","7.607","","8.621","","8.749","","90","","97.219","","90","","569.21","","","","85","","","","","","","","","2","P 1 21/c 1","","","","","","- C7 H10 -","","","","","","Brunelli, M.; Fitch, A. N.; Mora, A. J.","Crystal structures of bicyclic organic molecules","Materials Science Forum","2000","","","1092","1097","10.4028/www.scientific.net/MSF.321-324.1092","","","","","","","","","","","","","","","","","","","","","","188694","2020-10-21","18:00:00",""
"6000553","7.383","","10.387","","9.754","","90","","95.357","","90","","744.74","","","","85","","","","","","","","","3","C 1 2/c 1","","","","","","- C9 H12 O2 -","","","","","","Brunelli, M.; Fitch, A. N.; Mora, A. J.","Crystal structures of bicyclic organic molecules","Materials Science Forum","2000","","","1092","1097","10.4028/www.scientific.net/MSF.321-324.1092","","","","","","","","","","","","","","","","","","","","","","188694","2020-10-21","18:00:00",""
"6000687","8.67","","8.81","","12.6","","90","","90","","90","","962.42","","","","","","","","","","Quenched, from high pressure 13 GPa and temperature 670-820 K","Quenched, from high pressure 13 GPa","","1","I m m m","-I 2 2","71","","","","- C60 -","- C120 -","- C120 -","","","","Chernozatonskii, L. A.; Serebryanaya, N. R.; Mavrin, B. N.","The superhard crystalline three-dimensional polymerized C-60 phase. Quenched, from high pressure 13 GPa and temperature 670-820 K","Chemical Physics Letters","2000","316","","199","204","10.1016/S0009-2614(99)01288-9","","","","","","","","","","","","","","","","","","","","","has coordinates","277869","2022-09-15","09:06:00",""
"6000710","6.8738","","4.9178","","5.7018","","90","","98.829","","90","","190.46","","","","","","","","","","","","","5","P 1 21 1","","","","","","- B F0.25 H0.75 O3.75 Zn2 -","","","","","","Corbel, G.; Suard, E.; Emery, J.; Leblanc, M.","OH-F disorder in non-centrosymmetric Zn2(BO3)(OH)(0.75)F-0.25: ab initio structure determination and nmr study; comparison with tridymite and fluoride borates","Journal of Alloys and Compounds","2000","305","","49","57","10.1016/S0925-8388(00)00713-1","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000718","22.033","","7.6003","","6.6418","","90","","103.813","","90","","1080.05","","","","","","","","","","","","","5","C 1 2/m 1","","","","","","- C4 H6 K La O11 -","","","","","","Bataille, T.; Louer, M.; Auffredic, J. P.; Louer, D.","Crystal structure and thermal behavior of La(H2O)(2)M(C2O4)(2).H2O (M = K, NH4) studied by powder X-ray diffraction","Journal of Solid State Chemistry","2000","150","","81","95","10.1006/jssc.1999.8550","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000719","22.13","","7.774","","6.655","","90","","105.28","","90","","1104.44","","","","","","","","","","","","","5","C 1 2/m 1","","","","","","- C4 H10 La N O11 -","","","","","","Bataille, T.; Louer, M.; Auffredic, J. P.; Louer, D.","Crystal structure and thermal behavior of La(H2O)(2)M(C2O4)(2).H2O (M = K, NH4) studied by powder X-ray diffraction","Journal of Solid State Chemistry","2000","150","","81","95","10.1006/jssc.1999.8550","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000720","5.687","0.003","15.241","0.005","9.017","0.004","90","","92.82","0.03","90","","780.6","0.4","","","","","","","","","","","","4","","","","","","","- C4 K La O8 -","","","","","","Bataille, T.; Louer, M.; Auffredic, J. P.; Louer, D.","Crystal structure and thermal behavior of La(H2O)(2)M(C2O4)(2).H2O (M = K, NH4) studied by powder X-ray diffraction","Journal of Solid State Chemistry","2000","150","","81","95","10.1006/jssc.1999.8550","","","","","","","","","","","","","","","","","","","","","","203578","2020-10-21","18:00:00",""
"6000730","16.4972","","7.0673","","9.495","","90","","113.477","","90","","1015.39","","","","","","","","","","","","","6","P 1 21/c 1","","","","","","- C7 H9 Al Br O5 P -","","","","","","Chaplais, G.; Le, Bideau J; Leclercq, D.; Mutin, H.; Vioux, A.","Novel aluminium phenyl, benzyl, and bromobenzylphosphonates: structural characterisation and hydration-dehydration reactions","Journal of Materials Chemistry","2000","10","","1593","1601","10.1039/b000103l","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000731","8.979","","6.2299","","8.103","","90","","90.05","","90","","453.27","","","","","","","","","","","","","5","P 1 2/n 1","","","","","","- C4 H2 Cs O9 Y -","","","","","","Bataille, T.; Auffredic, J. P.; Louer, D.","Crystal structure and thermal behaviour of the new layered oxalate Y(H2O)Cs(C2O4)(2) studied by powder X-ray diffraction","Journal of Materials Chemistry","2000","10","","1707","1711","10.1039/b001201g","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000732","11.878","0.008","3.941","0.003","5.485","0.003","90","","90","","90","","256.76","","","","","","","","","","","","","3","","","","","","","- Cu2 Ge Se3 -","","","","","","Marcano, G.; Nieves, L.","Temperature dependence of the fundamental absorption edge in Cu2GeSe3","Journal of Applied Physics","2000","87","","1284","1286","10.1063/1.372010","","","","","","","","","","","","","","","","","","","","","","203574","2020-10-21","18:00:00",""
"6000757","9.8461","","9.8461","","7.3591","","90","","90","","120","","617.85","","","","","","","","","","","","","5","P 63/m","","","","","","- H1.2 K0.6 O25.2 P6 Pb9.3 -","","","","","","El, Feki H; Naddari, T.; Savariault, J. M.; Ben, Salah A","Localization of potassium in substituted lead hydroxyapatite: Pb9.30K0.60(PO4)(6)(OH)(1.20) by X-ray diffraction","Solid State Sciences","2000","2","","725","733","10.1016/S1293-2558(00)01075-X","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000758","6.062","","5.068","","4.846","","90","","90","","90","","148.88","","","","","","","","38000000","","","","","2","C m c m","","","","","","- Cu I -","","","","","","Ivdenko, V. A.; Blank, V. D.; Serebryanaya, N. R.","Phase transformations in CuI under high pressure and shear deformation conditions","Materials Science Forum","2000","","","878","882","10.4028/www.scientific.net/MSF.321-324.878","","","","","","","","","","","","","","","","","","","","","","188694","2020-10-21","18:00:00",""
"6000759","11.4612","","11.4612","","8.904","","90","","90","","90","","1169.62","","","","","","","","","","","","","5","I 41/a","","","","","","- C4 H8 K O12 Y -","","","","","","Bataille, T.; Auffrédic, J. P.; Louër, D.","A powder diffraction study of the crystal structure and the dehydration process of yttrium potassium oxalate tetrahydrate","Materials Science Forum","2000","321","","976","981","10.4028/www.scientific.net/MSF.321-324.976","","","","","","","","","","","","","","","","","","","","","","188694","2020-10-21","18:00:00",""
"6000760","6.262","","6.262","","12.897","","90","","90","","90","","505.73","","","","","","","","270000","","","","","3","I -4 2 d","","","","","","- Ag In Te2 -","","","","","","Diaz, M.; de Chalbaud, L. M.; Sagredo, V.; Tinoco, T.; Pineda, C.","Synchrotron structural study of AgInTe2","Physica Status Solidi B: Basic Solid State Physics","2000","220","","281","284","10.1002/1521-3951(200007)220:1<281::AID-PSSB281>3.0.CO;2-X","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000761","7.7516","0.0001","10.874","0.004","7.318","0.001","90","","115.82","0.01","90","","555.26","","","","","","","","","","","","","3","","","","","","","- Ag2 Ge Se3 -","","","","","","Velasquez-Velasquez, A.; Belandria, E.; Fernandez, B. J.; Godoy, R. A.; Delgado, G.; Acosta-Najarro, G. D.","Synthesis and characterization of the ternary compound Ag2GeSe3","Physica Status Solidi B: Basic Solid State Physics","2000","220","","683","686","10.1002/1521-3951(200007)220:1<683::AID-PSSB683>3.0.CO;2-9","","","","","","","","","","","","","","","","","","","","","","203578","2020-10-21","18:00:00",""
"6000762","11.99","","9.496","","8.339","","90","","90","","90","","949.45","","","","","","","","","","","","","4","P 21 21 21","","","","","","- Fe2 H3 O12 V3 -","","","","","","Poizot, P.; Laruelle, S.; Touboul, M.; Louer, M.; Louer, D.","Synthesis and crystal structure of a new hydrated iron(III) vanadate Fe2(H2O)[V2O7 .VO3(OH)]","Journal of Materials Chemistry","2000","10","","1841","1845","10.1039/b000448k","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000763","3.6287","","3.6287","","19.0921","","90","","90","","120","","217.72","","","","","","","","","","","","","2","R -3 m","","","","","","- Ca2 N -","","","","","","Gregory, D. H.; Bowman, A.; Baker, C. F.; Weston, D. P.","Dicalcium nitride, Ca2N - a 2D ""excess electron"" compound; synthetic routes and crystal chemistry","Journal of Materials Chemistry","2000","10","","1635","1641","10.1039/b001911i","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000764","11.097","","11.097","","23.88","","90","","90","","120","","2546.69","","","","","","","","","","","","","2","R???","","","","","","- B18 Si -","","","","","","Imai, M.; Kimura, T.; Sato, K.; Hirano, T.","Single-crystal growth and electrical properties of BnSi (n=18)","Journal of Alloys and Compounds","2000","306","","197","202","10.1016/S0925-8388(00)00813-6","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000765","10.63","","3.8014","","4.9347","","90","","100.889","","90","","195.82","","","","","","","","","","","","","2","C 1 2/m 1","","","","","","- Co Ge -","","","","","","Audebrand, N.; Ellner, M.; Mittemeijer, E. J.","Powder diffraction data for the germanides CoGe and Co5Ge7","Powder Diffraction","2000","15","","120","122","10.1017/S0885715600010964","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000766","7.6262","","7.6262","","5.8017","","90","","90","","90","","337.42","","","","","","","","","","","","","2","I 4 m m","","","","","","- Co5 Ge7 -","","","","","","Audebrand, N.; Ellner, M.; Mittemeijer, E. J.","Powder diffraction data for the germanides CoGe and Co5Ge7","Powder Diffraction","2000","15","","120","122","10.1017/S0885715600010964","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000767","10.9564","","10.9564","","16.835","","90","","90","","120","","1750.17","","","","","","","","","","","","","5","R -3","","","","","","- Cr H24 La N6 O30 -","","","","","","Gobichon, A. E.; Auffredic, J. P.; Louer, D.","A temperature-dependent powder diffraction study of chromium lanthanum nitrate, LaCr(NO3)(6).12H(2)O","Powder Diffraction","2000","15","","23","25","10.1017/S0885715600010782","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000768","12.301","","12.301","","12.301","","90","","90","","90","","1861.32","","","","","","","","","","","","","5","P 21 3","","","","","","- Cr H12 La N6 O24 -","","","","","","Gobichon, A. E.; Auffredic, J. P.; Louer, D.","A temperature-dependent powder diffraction study of chromium lanthanum nitrate, LaCr(NO3)(6).12H(2)O","Powder Diffraction","2000","15","","23","25","10.1017/S0885715600010782","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000769","3.8175","","3.8175","","17.149","","90","","90","","90","","249.92","","","","","","","","","","","","","4","","","","","","","- Bi6 H6 N3 O10.5 -","","","","","","Christensen, A. N.; Chevallier, M. A.; Skibsted, J.; Iversen, B. B.","Synthesis and characterization of basic bismuth(III) nitrates","Dalton (2000)","2000","","","265","270","10.1039/A908055D","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000770","15.185","","15.185","","15.834","","90","","90","","120","","3161.92","","","","","","","","","","","","","4","","","","","","","- Bi6 H7 N5 O25 -","","","","","","Christensen, A. N.; Chevallier, M. A.; Skibsted, J.; Iversen, B. B.","Synthesis and characterization of basic bismuth(III) nitrates","Dalton (2000)","2000","","","265","270","10.1039/A908055D","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"7008883","10.23","0.003","10.358","0.004","13.396","0.008","91.57","0.04","105.53","0.05","96.26","0.03","1357.1","1.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H20 N10 Ni2 O5 -","- C22 H18 N10 Ni2 O5 -","- C44 H36 N20 Ni4 O10 -","2","1","","Serna, Zurine E.; Barandika, M. Gotzone; Cortés, Roberto; Urtiaga, M. Karmele; Barberis, Gaston E.; Rojo, Teófilo","Structural analysis and magnetic properties of the dicubane-like tetramer [Ni(dpk·OH)(N3)]4·2H2O (dpk = di-2-pyridyl ketone) †","Journal of the Chemical Society, Dalton Transactions","2000","","1","29","","10.1039/a905430h","","","0.7107","MoKα","","0.1611","0.0749","","","0.1951","0.262","","","","","","0.983","","","","has coordinates","179792","2020-10-21","18:00:00",""
"7008884","12.239","0.0003","18.049","0.0004","20.509","0.0005","66.833","0.001","85.364","0.001","76.265","0.001","4045.64","0.17","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- K10 Na O84 W20 -","- K10 Na O84 W20 -","- K20 Na2 O168 W40 -","2","1","","Dickman, Michael H.; Ozeki, Tomoji; Evans, Jr., Howard T.; Rong, Chaoying; Jameson, Geoffrey B.; Pope, Michael T.","Polyoxometalates from heteropoly “brown” precursors. A new structural class of mixed valence heteropolytungstates, [(XO4)WIV3WVI17O62Hx]n−","Journal of the Chemical Society, Dalton Transactions","2000","","2","149","","10.1039/a905539h","","","0.71073","MoKα","","0.1057","0.0751","","0.191","0.1744","","","","0.978","1.114","1.114","","","","","has coordinates","179792","2020-10-21","18:00:00",""
"7008885","26.581","0.011","7.566","0.002","25.967","0.012","90","","119.62","0.03","90","","4540","3","126","2","126","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Ni(II)TnBuOEP","(5,10,15,20-Tetra(n-butyl)-2,3,7,8,12,13,17,18- octaethylporphyrinato)nickel(II)","","- C52 H76 N4 Ni -","- C52 H76 N4 Ni -","- C208 H304 N16 Ni4 -","4","0.5","","Senge, Mathias O.; Renner, Mark W.; Kalisch, Werner W.; Fajer, Jack","Molecular structure of (5,10,15,20-tetrabutyl-2,3,7,8,12,13,17,18-octaethylporphyrinato)nickel(II)—correlation of nonplanarity with frontier orbital shifts †","Journal of the Chemical Society, Dalton Transactions","2000","","3","381","","10.1039/a905927j","","","1.54178","CuKα","","0.0603","0.0552","","","0.143","0.1469","","","","","","1.097","","","","has coordinates,has disorder","179792","2020-10-21","18:00:00",""
"7008886","9.991","0.003","13.883","0.002","10.482","0.003","90","","103.15","0.02","90","","1415.8","0.6","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C12 H12 Mn N8 -","- C12 Mn N8 -","- C48 Mn4 N32 -","4","0.5","","Hernández, Margarita L.; Barandika, M. Gotzone; Urtiaga, M. Karmele; Cortés, Roberto; Lezama, Luis; Arriortua, M. Isabel","Structural analysis and magnetic properties of the 2-D compounds [M(N3)2(bpa)]n (M = Mn, Co or Ni; bpa = 1,2-bis(4-pyridyl)ethane) †","Journal of the Chemical Society, Dalton Transactions","2000","","1","79","","10.1039/a906154a","","","0.7107","MoKα","","0.0907","0.0552","","","0.135","0.1659","","","","","","1.024","","","","has coordinates","179792","2020-10-21","18:00:00",""
"7008887","16.888","0.002","19.831","0.003","13.2864","0.0016","90","","90","","90","","4449.7","1","293","2","293","2","","","","","","","","7","P c c n","-P 2ab 2ac","56","","","","- C12 H27 Cl2 N4 Ni O8.5 S2 -","- C12 H26 Cl2 N4 Ni O8.5 S2 -","- C96 H208 Cl16 N32 Ni8 O68 S16 -","8","1","","Pavlishchuk, Vitaly V.; Kolotilov, Sergey V.; Addison, Anthony W.; Butcher, Raymond J.; Sinn, Ekkehard","Nickel(II) complexes with dithiadiiminoamine and dithiabis(thiosemicarbazone) ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","3","335","","10.1039/a906294g","","","0.71073","MoKα","","0.1116","0.0546","","","0.1092","0.1329","","","","","","1.007","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7008888","7.6487","0.0016","14.789","0.003","21.618","0.005","90","","97.399","0.016","90","","2425","0.9","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C10 H20 Cl2 N6 Ni O9 S4 -","- C10 H20 Cl2 N6 Ni O9 S4 -","- C40 H80 Cl8 N24 Ni4 O36 S16 -","4","1","","Pavlishchuk, Vitaly V.; Kolotilov, Sergey V.; Addison, Anthony W.; Butcher, Raymond J.; Sinn, Ekkehard","Nickel(II) complexes with dithiadiiminoamine and dithiabis(thiosemicarbazone) ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","3","335","","10.1039/a906294g","","","0.71073","MoKα","","0.0818","0.0508","","","0.1127","0.1281","","","","","","1.003","","","","has coordinates,has disorder","179792","2020-10-21","18:00:00",""
"7008889","8.7734","0.0008","7.7896","0.0009","25.061","0.003","90","","99.209","0.005","90","","1690.6","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H18 N6 Ni S4 -","- C10 H18 N6 Ni S4 -","- C40 H72 N24 Ni4 S16 -","4","1","","Pavlishchuk, Vitaly V.; Kolotilov, Sergey V.; Addison, Anthony W.; Butcher, Raymond J.; Sinn, Ekkehard","Nickel(II) complexes with dithiadiiminoamine and dithiabis(thiosemicarbazone) ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","3","335","","10.1039/a906294g","","","0.71073","MoKα","","0.0944","0.0445","","","0.0887","0.1101","","","","","","1.02","","","","has coordinates,has disorder","179792","2020-10-21","18:00:00",""
"7008890","22.046","0.009","11.339","0.004","21.319","0.009","90","","117.363","0.002","90","","4733","3","291.2","","291.2","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C13 H25 Cl2 N3.5 Ni O9 S2 -","- C12.5 H25 Cl2 N3.25 Ni O9 S2 -","- C100 H200 Cl16 N26 Ni8 O72 S16 -","8","1","","Pavlishchuk, Vitaly V.; Kolotilov, Sergey V.; Addison, Anthony W.; Butcher, Raymond J.; Sinn, Ekkehard","Nickel(II) complexes with dithiadiiminoamine and dithiabis(thiosemicarbazone) ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","3","335","","10.1039/a906294g","","","0.7107","MoKα","","","0.0924","","","","0.065","","","","","","2.237","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7008891","10.941","0.003","11.27","0.003","16.785","0.003","71.863","0.018","72.742","0.017","68.98","0.02","1795.6","0.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C31 H41 Hg2 N7 O4 -","- C31 H41 Hg2 N7 O4 -","- C62 H82 Hg4 N14 O8 -","2","1","","Costero, Ana M.; Monrabal, Elena; Andreu, Cecilia; Martínez-Máñez, Ramón; Soto, Juan; Padilla-Tosta, Miguel; Pardo, Teresa; Ochando, Luis E.; Amigó, José M.","Synthesis, solution and electrochemical behaviour of new aza-crown ethers derived from biphenyl","Journal of the Chemical Society, Dalton Transactions","2000","","3","361","","10.1039/a906342k","","","0.71073","MoKα","","0.0653","0.0463","","","0.1343","0.1439","","","","","","1.112","","","","has coordinates","179792","2020-10-21","18:00:00",""
"7008892","19.279","0.002","18.672","0.002","7.7598","0.0009","90.257","0.002","97.639","0.002","99.825","0.002","2726.9","0.5","293","","293","","","","","","","","","4","P -1","-P 1","2","","","","- C25 H14 O10 Ru3 -","- C25 H14 O10 Ru3 -","- C100 H56 O40 Ru12 -","4","2","","Bruce, Michael I.; Skelton, Brian W.; White, Allan H.; Zaitseva, Natasha N.","Preparation and structural characterisation of some ruthenium cluster carbonyls containing allenylidene ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","6","881","","10.1039/a906379j","","","0.71073","MoKα","","0.084","0.046","","0.054","","0.049","","","1.236","","","1.408","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7008893","20.743","0.006","11.6","0.005","19.813","0.004","90","","90","","90","","4767","3","293","","293","","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C47.554 H35.108 Cl1.108 O8 P2 Ru3 -","- C47.554 H33.108 Cl1.108 O8 P2 Ru3 -","- C190.216 H132.432 Cl4.432 O32 P8 Ru12 -","4","1","","Bruce, Michael I.; Skelton, Brian W.; White, Allan H.; Zaitseva, Natasha N.","Preparation and structural characterisation of some ruthenium cluster carbonyls containing allenylidene ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","6","881","","10.1039/a906379j","","","0.71073","MoKα","","0.075","0.053","","0.068","","0.06","","","1.298","","","1.182","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7008894","16.573","0.007","13.754","0.006","9.797","0.006","99.18","0.04","95.47","0.04","106.11","0.03","2094.9","1.9","293","","293","","","","","","","","","6","P -1","-P 1","2","compound 22","","","- C42 H25 Au O9 P Ru3 -","- C42 H25 Au O9 P Ru3 -","- C84 H50 Au2 O18 P2 Ru6 -","2","1","","Bruce, Michael I.; Skelton, Brian W.; White, Allan H.; Zaitseva, Natasha N.","Preparation and structural characterisation of some ruthenium cluster carbonyls containing allenylidene ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","6","881","","10.1039/a906379j","","","0.71073","Mo-Kα","","0.088","0.049","","0.052","0.046","","","","1.626","1.88","1.88","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7008895","10.66","0.001","14.393","0.004","34.288","0.011","90","","95.38","0.02","90","","5238","2","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C58 H42 O8 P2 Ru3 -","- C58 H42 O8 P2 Ru3 -","- C232 H168 O32 P8 Ru12 -","4","1","","Bruce, Michael I.; Skelton, Brian W.; White, Allan H.; Zaitseva, Natasha N.","Preparation and structural characterisation of some ruthenium cluster carbonyls containing allenylidene ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","6","881","","10.1039/a906379j","","","0.71073","MoKα","","0.117","0.055","","0.065","0.054","","","","1.528","1.778","1.778","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7008896","10.477","0.003","12.434","0.003","20.465","0.009","90","","105.19","0.03","90","","2572.9","1.5","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H12 O9 Ru3 -","- C24 H12 O9 Ru3 -","- C96 H48 O36 Ru12 -","4","1","","Bruce, Michael I.; Skelton, Brian W.; White, Allan H.; Zaitseva, Natasha N.","Preparation and structural characterisation of some ruthenium cluster carbonyls containing allenylidene ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","6","881","","10.1039/a906379j","","","0.71073","MoKα","","0.065","0.04","","0.041","0.037","","","","1.363","1.499","1.499","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7008897","10.3021","0.0008","10.0375","0.0008","42.729","0.003","90","","94.181","0.001","90","","4406.7","0.6","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","compound 20","","","- C48 H32 O8 P2 Ru3 -","- C48 H32 O8 P2 Ru3 -","- C192 H128 O32 P8 Ru12 -","4","1","","Bruce, Michael I.; Skelton, Brian W.; White, Allan H.; Zaitseva, Natasha N.","Preparation and structural characterisation of some ruthenium cluster carbonyls containing allenylidene ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","6","881","","10.1039/a906379j","","","0.71073","Mo-Kα","","0.058","0.049","","0.057","0.056","","","","1.801","2.039","2.039","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7008898","14.611","0.0017","16.761","0.002","17.082","0.002","88.463","0.002","65.661","0.002","66.17","0.002","3437.2","0.7","293","","293","","","","","","","","","4","P -1","-P 1","2","","","","- C12 H4 O10 Ru3 -","- C12 H2 O10 Ru3 -","- C96 H16 O80 Ru24 -","8","4","","Bruce, Michael I.; Skelton, Brian W.; White, Allan H.; Zaitseva, Natasha N.","Preparation and structural characterisation of some ruthenium cluster carbonyls containing allenylidene ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","6","881","","10.1039/a906379j","","","0.71073","MoKα","","0.104","0.062","","0.09","","0.064","","","2.039","","","2.405","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7008899","13.078","0.001","24.641","0.002","15.348","0.002","90","","96.585","0.003","90","","4913.3","0.8","293","","293","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C50.615 H37.23 Cl1.23 O8 P2 Ru3 -","- C50.615 H37.23 Cl1.23 O8 P2 Ru3 -","- C202.46 H148.92 Cl4.92 O32 P8 Ru12 -","4","1","","Bruce, Michael I.; Skelton, Brian W.; White, Allan H.; Zaitseva, Natasha N.","Preparation and structural characterisation of some ruthenium cluster carbonyls containing allenylidene ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","6","881","","10.1039/a906379j","","","0.71073","MoKα","","0.062","0.041","","0.053","","0.05","","","1.537","","","1.68","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7008900","17.766","0.007","9.446","0.002","21.693","0.006","90","","110.02","0.04","90","","3420","2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C36 H26 As2 Co2 O5 -","- C36 H26 As2 Co2 O5 -","- C144 H104 As8 Co8 O20 -","4","1","","Choi, Nick; Conole, Gráinne; King, Jason D.; Mays, Martin J.; McPartlin, Mary; Stone, Caroline L.","Reactions of diarsines with bi- and tri-metallic carbonyl complexes containing cobalt","Journal of the Chemical Society, Dalton Transactions","2000","","3","395","","10.1039/a906611j","","","0.71073","MoKα","","0.1198","0.0493","","","0.0761","0.0928","","","","","","0.952","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008901","16.843","0.004","11.199","0.003","19.844","0.005","90","","110.873","0.015","90","","3497.4","1.6","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H20 As2 Cl Co3 O8 -","- C32 H20 As2 Cl Co3 O8 -","- C128 H80 As8 Cl4 Co12 O32 -","4","1","","Choi, Nick; Conole, Gráinne; King, Jason D.; Mays, Martin J.; McPartlin, Mary; Stone, Caroline L.","Reactions of diarsines with bi- and tri-metallic carbonyl complexes containing cobalt","Journal of the Chemical Society, Dalton Transactions","2000","","3","395","","10.1039/a906611j","","","0.71073","MoKα","","0.1613","0.0697","","","0.1412","0.1792","","","","","","1.006","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008902","17.387","0.003","18.918","0.004","19.785","0.003","90","","111.142","0.007","90","","6069.8","1.9","297","2","297","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H34 As4 Co2 O4 -","- C24 H34 As4 Co2 O4 -","- C192 H272 As32 Co16 O32 -","8","2","","Choi, Nick; Conole, Gráinne; King, Jason D.; Mays, Martin J.; McPartlin, Mary; Stone, Caroline L.","Reactions of diarsines with bi- and tri-metallic carbonyl complexes containing cobalt","Journal of the Chemical Society, Dalton Transactions","2000","","3","395","","10.1039/a906611j","","","0.71073","MoKα","","0.1452","0.0699","","","0.1413","0.1601","","","","","","0.98","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008903","11.938","0.004","14.533","0.003","16.455","0.003","90","","99.94","0.02","90","","2812","1.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C27 H22 As Co Mo O9 -","- C27 H17 As Co Mo O9 -","- C108 H68 As4 Co4 Mo4 O36 -","4","1","","Choi, Nick; Conole, Gráinne; King, Jason D.; Mays, Martin J.; McPartlin, Mary; Stone, Caroline L.","Reactions of diarsines with bi- and tri-metallic carbonyl complexes containing cobalt","Journal of the Chemical Society, Dalton Transactions","2000","","3","395","","10.1039/a906611j","","","0.71073","MoKα","","0.133","0.0545","","","0.101","0.1247","","","","","","0.961","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008904","12.081","0.0017","12.489","0.002","13.65","0.003","68.551","0.018","70.462","0.013","64.379","0.012","1689.8","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C33 H23 As2 Cl0 Co3 O8 -","- C33 H23 As2 Co3 O8 -","- C66 H46 As4 Co6 O16 -","2","1","","Choi, Nick; Conole, Gráinne; King, Jason D.; Mays, Martin J.; McPartlin, Mary; Stone, Caroline L.","Reactions of diarsines with bi- and tri-metallic carbonyl complexes containing cobalt","Journal of the Chemical Society, Dalton Transactions","2000","","3","395","","10.1039/a906611j","","","0.71073","MoKα","","0.0582","0.0342","","","0.0728","0.0807","","","","","","0.99","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008905","17.125","0.007","12.45","0.005","14.184","0.004","90","","90","","90","","3024.1","1.9","296.2","","296.2","","","","","","","","","8","P n m a","-P 2ac 2n","62","","","","- C12 H38 Br3 Mo N6 O Rh2 S6 -","- C12 H36 Br3 Mo N6 O Rh2 S6 -","- C48 H144 Br12 Mo4 N24 O4 Rh8 S24 -","4","0.5","","Miyashita, Yoshitaro; Yamada, Yasunori; Fujisawa, Kiyoshi; Konno, Takumi; Kanamori, Kan; Okamoto, Ken-ichi","Stereochemistry and electrochemical properties of molybdenum ions incorporated into S-bridged polynuclear structures","Journal of the Chemical Society, Dalton Transactions","2000","","6","981","","10.1039/a906665i","","","0.7107","MoKα","","0.0557","0.0557","","","0.0703","0.0703","","","","","","1.383","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7008906","11.53","0.003","12.026","0.002","12.577","0.002","90","","90.45","0.02","90","","1743.9","0.6","296.2","","296.2","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C12 H44 Br4 Ir2 Mo N6 O4 S6 -","- C12 H36 Br4 Ir2 Mo N6 O4 S6 -","- C24 H72 Br8 Ir4 Mo2 N12 O8 S12 -","2","0.5","","Miyashita, Yoshitaro; Yamada, Yasunori; Fujisawa, Kiyoshi; Konno, Takumi; Kanamori, Kan; Okamoto, Ken-ichi","Stereochemistry and electrochemical properties of molybdenum ions incorporated into S-bridged polynuclear structures","Journal of the Chemical Society, Dalton Transactions","2000","","6","981","","10.1039/a906665i","","","0.7107","MoKα","","0.0722","0.0722","","","0.0948","0.0947","","","","","","2.289","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7008907","14.236","0.005","14.917","0.003","13.622","0.002","114.81","0.01","95.57","0.02","82.46","0.03","2600.2","1.1","296.2","","296.2","","","","","","","","","8","P -1","-P 1","2","","","","- C18 H66 Br4 Mo2 N9 O9 Rh3 S9 -","- C18 H54 Br4 Mo2 N9 O9 Rh3 S9 -","- C36 H108 Br8 Mo4 N18 O18 Rh6 S18 -","2","1","","Miyashita, Yoshitaro; Yamada, Yasunori; Fujisawa, Kiyoshi; Konno, Takumi; Kanamori, Kan; Okamoto, Ken-ichi","Stereochemistry and electrochemical properties of molybdenum ions incorporated into S-bridged polynuclear structures","Journal of the Chemical Society, Dalton Transactions","2000","","6","981","","10.1039/a906665i","","","0.7107","MoKα","","0.0434","0.0434","","","0.0553","0.0553","","","","","","1.343","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7008908","10.067","0.004","12.504","0.0019","18.897","0.004","95.471","0.015","92.5","0.02","96.038","0.018","2351.3","1.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C43 H55 Dy N13 O12.5 -","- C43 H54 Dy N13 O12.5 -","- C86 H108 Dy2 N26 O25 -","2","1","","Platas, Carlos; Avecilla, Fernando; de Blas, Andrés; Rodríguez-Blas, Teresa; Geraldes, Carlos F. G. C.; Tóth, Éva; Merbach, André E.; Bünzli, Jean-Claude G.","Mono- and bimetallic lanthanide(III) phenolic cryptates obtained by template reaction: solid state structure, photophysical properties and relaxivity †","Journal of the Chemical Society, Dalton Transactions","2000","","4","611","","10.1039/a906675f","","","0.71069","MoKα","","0.2123","0.0889","","","0.1173","0.1587","","","","","","1.005","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7008909","17.717","0.0003","17.717","0.0003","29.18","","90","0.1","90","0.1","90","","9159.4","0.2","193","2","193","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- C40 H55 Dy2 N11 O16 -","- C40 H49 Dy2 N11 O16 -","- C320 H392 Dy16 N88 O128 -","8","1","","Platas, Carlos; Avecilla, Fernando; de Blas, Andrés; Rodríguez-Blas, Teresa; Geraldes, Carlos F. G. C.; Tóth, Éva; Merbach, André E.; Bünzli, Jean-Claude G.","Mono- and bimetallic lanthanide(III) phenolic cryptates obtained by template reaction: solid state structure, photophysical properties and relaxivity †","Journal of the Chemical Society, Dalton Transactions","2000","","4","611","","10.1039/a906675f","","","0.71073","MoKα","","0.0621","0.0432","","","0.0937","0.1021","","","","","","1.043","","","","has coordinates,has disorder","179793","2020-10-21","18:00:00",""
"7008910","10.487","0.002","21.118","0.011","17.514","0.002","90","","94.56","0.02","90","","3866","2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C54 H36 Fe2 O28 S28 -","- C54 H28 Fe2 O28 S28 -","- C108 H56 Fe4 O56 S56 -","2","0.5","","Coronado, Eugenio; Galán-Mascarós, José R.; Gómez-García, Carlos J.","Charge transfer salts of tetrathiafulvalene derivatives with magnetic iron(III) oxalate complexes: [TTF]7[Fe(ox)3]2·4H2O, [TTF]5[Fe2(ox)5]·2PhMe·2H2O and [TMTTF]4[Fe2(ox)5]· PhCN·4H2O (TMTTF = tetramethyltetrathiafulvalene) †","Journal of the Chemical Society, Dalton Transactions","2000","","2","205","","10.1039/a906893g","","","0.71069","MoKα","","0.1492","0.0459","","","0.0976","0.1448","","","","","","1.017","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008911","19.777","0.005","13.9","0.005","13.457","0.005","90","0.005","107.4","0.005","90","0.005","3530","2","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C54 H40 Fe2 O22 S20 -","- C54 H30 Fe2 O22 S20 -","- C108 H60 Fe4 O44 S40 -","2","0.25","","Coronado, Eugenio; Galán-Mascarós, José R.; Gómez-García, Carlos J.","Charge transfer salts of tetrathiafulvalene derivatives with magnetic iron(III) oxalate complexes: [TTF]7[Fe(ox)3]2·4H2O, [TTF]5[Fe2(ox)5]·2PhMe·2H2O and [TMTTF]4[Fe2(ox)5]· PhCN·4H2O (TMTTF = tetramethyltetrathiafulvalene) †","Journal of the Chemical Society, Dalton Transactions","2000","","2","205","","10.1039/a906893g","","","0.71069","MoKα","","0.1861","0.0501","","","0.1347","0.1872","","","","","","0.947","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008912","11.61","0.001","14.085","0.001","14.253","0.001","118.11","0.001","90.66","0.001","114.1","0.001","1815.4","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C57 H61 Fe2 N O24 S16 -","- C57 H60 Fe2 N O24 S16 -","- C57 H60 Fe2 N O24 S16 -","1","0.5","","Coronado, Eugenio; Galán-Mascarós, José R.; Gómez-García, Carlos J.","Charge transfer salts of tetrathiafulvalene derivatives with magnetic iron(III) oxalate complexes: [TTF]7[Fe(ox)3]2·4H2O, [TTF]5[Fe2(ox)5]·2PhMe·2H2O and [TMTTF]4[Fe2(ox)5]· PhCN·4H2O (TMTTF = tetramethyltetrathiafulvalene) †","Journal of the Chemical Society, Dalton Transactions","2000","","2","205","","10.1039/a906893g","","","0.71069","MoKα","","0.0985","0.049","","","0.1154","0.1553","","","","","","1.109","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7008913","8.9575","0.001","9.4809","0.0011","11.2364","0.0013","98.377","0.002","112.958","0.002","96.817","0.002","853","0.17","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H20 Cl Si -","- C19 H20 Cl Si -","- C38 H40 Cl2 Si2 -","2","1","","Choi, Seok-Bong; Boudjouk, Philip","A novel α,ω silyl dianionic salt. The synthesis and characterization of remotely connected benzannulated silole monoanions","Journal of the Chemical Society, Dalton Transactions","2000","","6","841","","10.1039/a906915a","","","0.71073","MoKα","","0.1135","0.0696","","","0.152","0.1913","","","","","","1.052","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008914","13.271","0.0009","13.9844","0.0009","14.0125","0.0009","64.636","0.001","77.45","0.001","74.03","0.001","2244.3","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C47 H58 Li O5 Si2 -","- C47 H58 Li O5 Si2 -","- C94 H116 Li2 O10 Si4 -","2","1","","Choi, Seok-Bong; Boudjouk, Philip","A novel α,ω silyl dianionic salt. The synthesis and characterization of remotely connected benzannulated silole monoanions","Journal of the Chemical Society, Dalton Transactions","2000","","6","841","","10.1039/a906915a","","","0.71073","MoKα","","0.1085","0.0838","","","0.1967","0.2186","","","","","","1.086","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008915","10.8322","0.0005","14.8477","0.0007","19.7415","0.0009","90","","102.899","0.001","90","","3095","0.2","296","2","296","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C36 H29 Br N Ni P S -","- C36 H29 Br N Ni P S -","- C144 H116 Br4 N4 Ni4 P4 S4 -","4","1","","Nevondo, Funzani A.; Crouch, Andrew M.; Darkwa, James","Synthesis and characterisation of thiolato Schiff base nickel(II) complexes. X-Ray structures of Ni(η5-C5H5)(PPh3)(SC6H4NCHC6H4Br-4') and Ni(η5-C5H5)(PBu3)(SC6H4NCHC6H4CH3-4') ‡","Journal of the Chemical Society, Dalton Transactions","2000","","1","43","","10.1039/a906949f","","","0.71073","MoKα","","0.0847","0.0525","","0.1568","0.1363","","","","0.971","1.018","1.018","","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008916","10.809","0.0003","10.916","0.0004","14.43","0.0006","80.813","0.002","73.796","0.002","68.446","0.002","1517.53","0.1","293","","207","","","","","","","","see text","6","P -1","-P 1","2","","","","- C31 H44 N Ni P S -","- C31 H44 N Ni P S -","- C62 H88 N2 Ni2 P2 S2 -","2","1","","Nevondo, Funzani A.; Crouch, Andrew M.; Darkwa, James","Synthesis and characterisation of thiolato Schiff base nickel(II) complexes. X-Ray structures of Ni(η5-C5H5)(PPh3)(SC6H4NCHC6H4Br-4') and Ni(η5-C5H5)(PBu3)(SC6H4NCHC6H4CH3-4') ‡","Journal of the Chemical Society, Dalton Transactions","2000","","1","43","","10.1039/a906949f","","","0.7107","MoKα","","0.0765","0.0643","","","0.1727","0.1852","","","","","","0.903","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008917","12.9699","0.0009","19.961","0.002","15.784","0.002","90","","112.184","0.009","90","","3783.9","0.7","170","2","170","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H52 N4 O12 P3 Yb -","- C30 H46 N4 O12 P3 Yb -","- C120 H184 N16 O48 P12 Yb4 -","4","1","","Rohovec, Jan; Vojtíšek, Pavel; Hermann, Petr; Ludvík, Jiří; Lukeš, Ivan","Derivative of cyclen with three methylene(phenyl)phosphinic acid pendant arms. Synthesis and crystal structures of its lanthanide complexes","Journal of the Chemical Society, Dalton Transactions","2000","","2","141","","10.1039/a907018d","","","0.71073","MoKα","","0.0291","0.0247","","","0.0641","0.0667","","","","","","1.084","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008918","13.2355","0.0012","20.229","0.004","15.6591","0.0016","90","","108.221","0.008","90","","3982.4","1","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H52 La N4 O12 P3 -","- C30 H40 La N4 O11.11 P3 -","- C120 H160 La4 N16 O44.44 P12 -","4","1","","Rohovec, Jan; Vojtíšek, Pavel; Hermann, Petr; Ludvík, Jiří; Lukeš, Ivan","Derivative of cyclen with three methylene(phenyl)phosphinic acid pendant arms. Synthesis and crystal structures of its lanthanide complexes","Journal of the Chemical Society, Dalton Transactions","2000","","2","141","","10.1039/a907018d","","","0.71073","MoKα","","0.0619","0.0518","","","0.1382","0.1514","","","","","","1.105","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008919","13.2052","0.0009","19.407","0.002","16.077","0.002","90","","110.617","0.009","90","","3856.2","0.7","170","2","170","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H60 Eu N4 O13 P3 -","- C31.622 H40 Eu N4 O11.684 P3 -","- C126.488 H160 Eu4 N16 O46.736 P12 -","4","1","","Rohovec, Jan; Vojtíšek, Pavel; Hermann, Petr; Ludvík, Jiří; Lukeš, Ivan","Derivative of cyclen with three methylene(phenyl)phosphinic acid pendant arms. Synthesis and crystal structures of its lanthanide complexes","Journal of the Chemical Society, Dalton Transactions","2000","","2","141","","10.1039/a907018d","","","0.71073","MoKα","","0.0482","0.0388","","","0.1034","0.1112","","","","","","1.061","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008920","13.112","0.003","19.758","0.005","15.928","0.005","90","","109.38","0.02","90","","3892.6","1.9","170","1","170","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H54 N4 Nd O13 P3 -","- C30 H40 N4 Nd O12.1 P3 -","- C120 H160 N16 Nd4 O48.4 P12 -","4","1","","Rohovec, Jan; Vojtíšek, Pavel; Hermann, Petr; Ludvík, Jiří; Lukeš, Ivan","Derivative of cyclen with three methylene(phenyl)phosphinic acid pendant arms. Synthesis and crystal structures of its lanthanide complexes","Journal of the Chemical Society, Dalton Transactions","2000","","2","141","","10.1039/a907018d","","","0.71073","MoKα","","0.0837","0.0594","","","0.1539","0.1787","","","","","","1.118","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008921","13.047","0.003","20.238","0.006","15.841","0.004","90","","112.19","0.02","90","","3873","1.8","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H52 N4 O12 P3 Tb -","- C30 H40 N4 O12 P3 Tb -","- C120 H160 N16 O48 P12 Tb4 -","4","1","","Rohovec, Jan; Vojtíšek, Pavel; Hermann, Petr; Ludvík, Jiří; Lukeš, Ivan","Derivative of cyclen with three methylene(phenyl)phosphinic acid pendant arms. Synthesis and crystal structures of its lanthanide complexes","Journal of the Chemical Society, Dalton Transactions","2000","","2","141","","10.1039/a907018d","","","0.71073","MoKα","","0.1064","0.0913","","","0.2475","0.2677","","","","","","1.245","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008922","13.048","0.016","19.56","0.06","16.535","0.015","90","","111.32","0.09","90","","3931","14","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H50 Er N4 O11 P3 -","- C30 H40 Er N4 O10.51 P3 -","- C120 H160 Er4 N16 O42.04 P12 -","4","1","","Rohovec, Jan; Vojtíšek, Pavel; Hermann, Petr; Ludvík, Jiří; Lukeš, Ivan","Derivative of cyclen with three methylene(phenyl)phosphinic acid pendant arms. Synthesis and crystal structures of its lanthanide complexes","Journal of the Chemical Society, Dalton Transactions","2000","","2","141","","10.1039/a907018d","","","0.71073","MoKα","","0.1397","0.1008","","","0.2516","0.2947","","","","","","1.156","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008923","13.194","0.003","19.99","0.004","15.534","0.003","90","","107.21","0.03","90","","3913.6","1.5","170","1","170","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H60 Ce N4 O13 P3 -","- C30.84 H40 Ce N4 O11.46 P3 -","- C123.36 H160 Ce4 N16 O45.84 P12 -","4","1","","Rohovec, Jan; Vojtíšek, Pavel; Hermann, Petr; Ludvík, Jiří; Lukeš, Ivan","Derivative of cyclen with three methylene(phenyl)phosphinic acid pendant arms. Synthesis and crystal structures of its lanthanide complexes","Journal of the Chemical Society, Dalton Transactions","2000","","2","141","","10.1039/a907018d","","","0.71073","MoKα","","0.0851","0.0643","","","0.1654","0.2029","","","","","","1.166","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008924","9.471","0.003","23.981","0.003","17.29","0.005","90","","97.23","0.03","90","","3895.8","1.8","295","","295","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C44 H38 Cl2 N O P2 Ru -","- C44 H38 Cl2 N O P2 Ru -","- C176 H152 Cl8 N4 O4 P8 Ru4 -","4","1","","Das, Anjan Kumar; Peng, Shie-Ming; Bhattacharya, Samaresh","Ruthenium-mediated reduction of oximes to imines. Synthesis, characterization and redox properties of imine complexes of ruthenium","Journal of the Chemical Society, Dalton Transactions","2000","","2","181","","10.1039/a907021d","","","0.71073","MolybdenumKα","","0.035","0.026","","0.028","0.028","","","","","2.75","2.75","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7008925","11.115","0.003","19.187","0.004","10.573","0.003","103.58","0.02","93.9","0.02","75.67","0.02","2123.5","1","290","2","290","2","","","","","","","","5","P -1","-P 1","2","","Compound 4","","- C39 H41 Cl9 N2 Pt -","- C39 H41 Cl9 N2 Pt -","- C78 H82 Cl18 N4 Pt2 -","2","1","","Adams, Christopher J.; James, Stuart L.; Liu, Xiaoming; Raithby, Paul R.; Yellowlees, Lesley J.","Synthesis and characterisation of new platinum‒acetylide complexes containing diimine ligands","Journal of the Chemical Society, Dalton Transactions","2000","","1","63","","10.1039/a907028a","","","0.71073","MoKα","","0.0969","0.0683","","","0.1958","0.2262","","","","","","1.185","","","","has coordinates,has disorder","179793","2020-10-21","18:00:00",""
"7008926","7.5211","0.0002","17.4802","0.0005","12.5964","0.0004","90","","96.475","0.001","90","","1645.49","0.08","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C13 H15 F5 I Ir O -","- C11.83 H15 F4.15 I Ir O -","- C47.32 H60 F16.6 I4 Ir4 O4 -","4","1","","Hughes, Russell P.; Smith, Jeremy M.; Liable-Sands, Louise M.; Concolino, Thomas E.; Lam, Kin-Chung; Incarvito, Christopher; Rheingold, Arnold L.","Syntheses and crystallographic studies of [Ir(η5-C5Me5)(L)(RF)I] (L = CO, PMe3; RF = CF2CF3, CF2CF2CF3, CF2C6F5, CF(CF3)2) complexes. Cone and solid angle steric parameters for perfluoroalkyl ligands","Journal of the Chemical Society, Dalton Transactions","2000","","6","873","","10.1039/a907057e","","","0.71073","MoKα","","0.0526","0.0457","","","0.1554","0.1635","","","","","","1.349","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008927","13.373","0.004","10.85","0.003","15.33","0.006","90","","114.02","0.02","90","","2031.7","1.2","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H15 F7 I Ir O -","- C18 H15 F7 I Ir O -","- C72 H60 F28 I4 Ir4 O4 -","4","1","","Hughes, Russell P.; Smith, Jeremy M.; Liable-Sands, Louise M.; Concolino, Thomas E.; Lam, Kin-Chung; Incarvito, Christopher; Rheingold, Arnold L.","Syntheses and crystallographic studies of [Ir(η5-C5Me5)(L)(RF)I] (L = CO, PMe3; RF = CF2CF3, CF2CF2CF3, CF2C6F5, CF(CF3)2) complexes. Cone and solid angle steric parameters for perfluoroalkyl ligands","Journal of the Chemical Society, Dalton Transactions","2000","","6","873","","10.1039/a907057e","","","0.71073","MoKα","","0.08","0.0554","","","0.0625","0.0683","","","","","","1.34","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008928","8.999","0.009","14.477","0.005","13.553","0.007","90","","94.32","0.04","90","","1761","2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H15 F7 I Ir O -","- C14 H15 F7 I Ir O -","- C56 H60 F28 I4 Ir4 O4 -","4","1","","Hughes, Russell P.; Smith, Jeremy M.; Liable-Sands, Louise M.; Concolino, Thomas E.; Lam, Kin-Chung; Incarvito, Christopher; Rheingold, Arnold L.","Syntheses and crystallographic studies of [Ir(η5-C5Me5)(L)(RF)I] (L = CO, PMe3; RF = CF2CF3, CF2CF2CF3, CF2C6F5, CF(CF3)2) complexes. Cone and solid angle steric parameters for perfluoroalkyl ligands","Journal of the Chemical Society, Dalton Transactions","2000","","6","873","","10.1039/a907057e","","","0.71073","MoKα","","0.1081","0.0701","","0.1988","0.1692","","","","1.039","1.082","1.082","","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008929","16.7571","0.0002","15.8571","0.0003","16.883","0.0002","90","","118.062","0.0007","90","","3958.75","0.1","173","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C15 H24 F5 I Ir P -","- C14.54 H24 F3.85 I Ir P -","- C116.32 H192 F30.8 I8 Ir8 P8 -","8","2","","Hughes, Russell P.; Smith, Jeremy M.; Liable-Sands, Louise M.; Concolino, Thomas E.; Lam, Kin-Chung; Incarvito, Christopher; Rheingold, Arnold L.","Syntheses and crystallographic studies of [Ir(η5-C5Me5)(L)(RF)I] (L = CO, PMe3; RF = CF2CF3, CF2CF2CF3, CF2C6F5, CF(CF3)2) complexes. Cone and solid angle steric parameters for perfluoroalkyl ligands","Journal of the Chemical Society, Dalton Transactions","2000","","6","873","","10.1039/a907057e","","","0.71073","MoKα","","0.0959","0.0776","","","0.221","0.2313","","","","","","1.637","","","","has coordinates,has disorder","179793","2020-10-21","18:00:00",""
"7008930","23.0016","0.0003","23.0016","0.0003","8.1951","0.0002","90","","90","","90","","4335.81","0.13","298","2","298","2","","","","","","","","6","P 42/n :2","-P 4bc","86","","","","- C16 H24 F7 I Ir P -","- C16 H24 F7 I Ir P -","- C128 H192 F56 I8 Ir8 P8 -","8","1","","Hughes, Russell P.; Smith, Jeremy M.; Liable-Sands, Louise M.; Concolino, Thomas E.; Lam, Kin-Chung; Incarvito, Christopher; Rheingold, Arnold L.","Syntheses and crystallographic studies of [Ir(η5-C5Me5)(L)(RF)I] (L = CO, PMe3; RF = CF2CF3, CF2CF2CF3, CF2C6F5, CF(CF3)2) complexes. Cone and solid angle steric parameters for perfluoroalkyl ligands","Journal of the Chemical Society, Dalton Transactions","2000","","6","873","","10.1039/a907057e","","","0.71073","MoKα","","0.0458","0.0378","","","0.1445","0.1571","","","","","","1.288","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008931","8.68413","0.00004","13.6408","0.0002","18.0396","0.0003","90","","90","","90","","2136.94","0.05","198","2","198","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C16 H24 F7 I Ir P -","- C16 H24 F7 I Ir P -","- C64 H96 F28 I4 Ir4 P4 -","4","1","","Hughes, Russell P.; Smith, Jeremy M.; Liable-Sands, Louise M.; Concolino, Thomas E.; Lam, Kin-Chung; Incarvito, Christopher; Rheingold, Arnold L.","Syntheses and crystallographic studies of [Ir(η5-C5Me5)(L)(RF)I] (L = CO, PMe3; RF = CF2CF3, CF2CF2CF3, CF2C6F5, CF(CF3)2) complexes. Cone and solid angle steric parameters for perfluoroalkyl ligands","Journal of the Chemical Society, Dalton Transactions","2000","","6","873","","10.1039/a907057e","","","0.71073","MoKα","","0.0739","0.0651","","0.1517","0.149","","","","1.068","1.153","1.153","","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008932","8.327","0.009","10.985","0.012","11.16","0.014","93.763","0.01","94.442","0.01","101.419","0.01","994","2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H13 N6 Nd O10 -","- C15 H11 N6 Nd O10 -","- C30 H22 N12 Nd2 O20 -","2","1","","Drew, Michael G. B.; Iveson, Peter B.; Hudson, Michael J.; Liljenzin, Jan Olov; Spjuth, Lena; Cordier, Pierre-Yves; Enarsson, Åsa; Hill, Clément; Madic, Charles","Separation of americium(III) from europium(III) with tridentate heterocyclic nitrogen ligands and crystallographic studies of complexes formed by 2,2'∶6',2″-terpyridine with the lanthanides","Journal of the Chemical Society, Dalton Transactions","2000","","5","821","","10.1039/a907077j","","","0.71073","MoKα","","0.1199","0.0733","","","0.1979","0.2179","","","","","","1.037","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7008933","11.189","0.014","16.059","0.017","16.32","0.017","106.576","0.01","95.158","0.01","95.872","0.01","2774","5","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C49 H39 N17 Nd2 O18 -","- C49 H39 N17 Nd2 O18 -","- C98 H78 N34 Nd4 O36 -","2","1","","Drew, Michael G. B.; Iveson, Peter B.; Hudson, Michael J.; Liljenzin, Jan Olov; Spjuth, Lena; Cordier, Pierre-Yves; Enarsson, Åsa; Hill, Clément; Madic, Charles","Separation of americium(III) from europium(III) with tridentate heterocyclic nitrogen ligands and crystallographic studies of complexes formed by 2,2'∶6',2″-terpyridine with the lanthanides","Journal of the Chemical Society, Dalton Transactions","2000","","5","821","","10.1039/a907077j","","","0.71073","MoKα","","0.0781","0.0593","","","0.1617","0.1783","","","","","","1.091","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008934","10.518","0.012","15.595","0.017","16.116","0.017","100.722","0.01","106.149","0.01","95.784","0.01","2462","5","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C45 H33 N15 O18 -","- C45 H33 N15 O18 Sm2 -","- C90 H66 N30 O36 Sm4 -","2","1","","Drew, Michael G. B.; Iveson, Peter B.; Hudson, Michael J.; Liljenzin, Jan Olov; Spjuth, Lena; Cordier, Pierre-Yves; Enarsson, Åsa; Hill, Clément; Madic, Charles","Separation of americium(III) from europium(III) with tridentate heterocyclic nitrogen ligands and crystallographic studies of complexes formed by 2,2'∶6',2″-terpyridine with the lanthanides","Journal of the Chemical Society, Dalton Transactions","2000","","5","821","","10.1039/a907077j","","","0.71073","MoKα","","0.1879","0.08","","","0.2042","0.2471","","","","","","0.923","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008935","11.087","0.012","16.01","0.02","16.226","0.017","106.012","0.01","95.798","0.01","95.867","0.01","2729","5","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C49 H39 N17 O18 Tb2 -","- C49 H39 N17 O18 Tb2 -","- C98 H78 N34 O36 Tb4 -","2","1","","Drew, Michael G. B.; Iveson, Peter B.; Hudson, Michael J.; Liljenzin, Jan Olov; Spjuth, Lena; Cordier, Pierre-Yves; Enarsson, Åsa; Hill, Clément; Madic, Charles","Separation of americium(III) from europium(III) with tridentate heterocyclic nitrogen ligands and crystallographic studies of complexes formed by 2,2'∶6',2″-terpyridine with the lanthanides","Journal of the Chemical Society, Dalton Transactions","2000","","5","821","","10.1039/a907077j","","","0.71073","MoKα","","0.0582","0.0423","","","0.1144","0.1237","","","","","","1.052","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008936","10.452","0.013","15.531","0.017","16.107","0.019","101.062","0.01","106.144","0.01","95.838","0.01","2431","5","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C45 H33 Dy2 N15 O18 -","- C45 H33 Dy2 N15 O18 -","- C90 H66 Dy4 N30 O36 -","2","1","","Drew, Michael G. B.; Iveson, Peter B.; Hudson, Michael J.; Liljenzin, Jan Olov; Spjuth, Lena; Cordier, Pierre-Yves; Enarsson, Åsa; Hill, Clément; Madic, Charles","Separation of americium(III) from europium(III) with tridentate heterocyclic nitrogen ligands and crystallographic studies of complexes formed by 2,2'∶6',2″-terpyridine with the lanthanides","Journal of the Chemical Society, Dalton Transactions","2000","","5","821","","10.1039/a907077j","","","0.71073","MoKα","","0.1214","0.07","","","0.2","0.2306","","","","","","1.008","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7008937","10.463","0.011","15.525","0.017","16.131","0.017","100.88","0.01","106.22","0.01","95.81","0.01","2438","5","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C45 H33 Ho2 N15 O18 -","- C45 H33 Ho2 N15 O18 -","- C90 H66 Ho4 N30 O36 -","2","1","","Drew, Michael G. B.; Iveson, Peter B.; Hudson, Michael J.; Liljenzin, Jan Olov; Spjuth, Lena; Cordier, Pierre-Yves; Enarsson, Åsa; Hill, Clément; Madic, Charles","Separation of americium(III) from europium(III) with tridentate heterocyclic nitrogen ligands and crystallographic studies of complexes formed by 2,2'∶6',2″-terpyridine with the lanthanides","Journal of the Chemical Society, Dalton Transactions","2000","","5","821","","10.1039/a907077j","","","0.71073","MoKα","","0.0735","0.0452","","","0.1201","0.1405","","","","","","0.968","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7008938","9.994","0.012","14.697","0.017","14.954","0.017","70.007","0.01","78.049","0.01","79.783","0.01","2006","4","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H33 Ho N12 O10 -","- C36 H31 Ho N12 O10 -","- C72 H62 Ho2 N24 O20 -","2","1","","Drew, Michael G. B.; Iveson, Peter B.; Hudson, Michael J.; Liljenzin, Jan Olov; Spjuth, Lena; Cordier, Pierre-Yves; Enarsson, Åsa; Hill, Clément; Madic, Charles","Separation of americium(III) from europium(III) with tridentate heterocyclic nitrogen ligands and crystallographic studies of complexes formed by 2,2'∶6',2″-terpyridine with the lanthanides","Journal of the Chemical Society, Dalton Transactions","2000","","5","821","","10.1039/a907077j","","","0.71073","MoKα","","0.1258","0.0638","","","0.1623","0.1887","","","","","","0.98","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008939","10.017","0.012","14.742","0.017","14.936","0.017","69.486","0.01","78.106","0.01","79.783","0.01","2008","4","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H33 Er N12 O10 -","- C36 H31 Er N12 O10 -","- C72 H62 Er2 N24 O20 -","2","1","","Drew, Michael G. B.; Iveson, Peter B.; Hudson, Michael J.; Liljenzin, Jan Olov; Spjuth, Lena; Cordier, Pierre-Yves; Enarsson, Åsa; Hill, Clément; Madic, Charles","Separation of americium(III) from europium(III) with tridentate heterocyclic nitrogen ligands and crystallographic studies of complexes formed by 2,2'∶6',2″-terpyridine with the lanthanides","Journal of the Chemical Society, Dalton Transactions","2000","","5","821","","10.1039/a907077j","","","0.71073","MoKα","","0.0748","0.061","","","0.1941","0.21","","","","","","1.442","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7008940","10.263","0.013","14.487","0.017","14.816","0.017","64.871","0.01","73.936","0.01","78.876","0.01","1909","4","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H28 N11 O10 Tm -","- C34 H28 N11 O10 Tm -","- C68 H56 N22 O20 Tm2 -","2","1","","Drew, Michael G. B.; Iveson, Peter B.; Hudson, Michael J.; Liljenzin, Jan Olov; Spjuth, Lena; Cordier, Pierre-Yves; Enarsson, Åsa; Hill, Clément; Madic, Charles","Separation of americium(III) from europium(III) with tridentate heterocyclic nitrogen ligands and crystallographic studies of complexes formed by 2,2'∶6',2″-terpyridine with the lanthanides","Journal of the Chemical Society, Dalton Transactions","2000","","5","821","","10.1039/a907077j","","","0.71073","MoKα","","0.2745","0.0949","","","0.2208","0.2859","","","","","","0.941","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7008941","8.655","0.01","8.833","0.01","25.31","0.03","90","","90.863","0.01","90","","1935","4","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H13 N6 O10 Tm -","- C15 H11 N6 O10 Tm -","- C60 H44 N24 O40 Tm4 -","4","1","","Drew, Michael G. B.; Iveson, Peter B.; Hudson, Michael J.; Liljenzin, Jan Olov; Spjuth, Lena; Cordier, Pierre-Yves; Enarsson, Åsa; Hill, Clément; Madic, Charles","Separation of americium(III) from europium(III) with tridentate heterocyclic nitrogen ligands and crystallographic studies of complexes formed by 2,2'∶6',2″-terpyridine with the lanthanides","Journal of the Chemical Society, Dalton Transactions","2000","","5","821","","10.1039/a907077j","","","0.71073","MoKα","","0.072","0.0604","","","0.1822","0.1945","","","","","","1.071","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008942","9.09","0.009","16.693","0.017","13.636","0.015","90","","111.11","0.01","90","","1930","3","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H11 N6 O9 Yb -","- C15 H11 N6 O9 Yb -","- C60 H44 N24 O36 Yb4 -","4","1","","Drew, Michael G. B.; Iveson, Peter B.; Hudson, Michael J.; Liljenzin, Jan Olov; Spjuth, Lena; Cordier, Pierre-Yves; Enarsson, Åsa; Hill, Clément; Madic, Charles","Separation of americium(III) from europium(III) with tridentate heterocyclic nitrogen ligands and crystallographic studies of complexes formed by 2,2'∶6',2″-terpyridine with the lanthanides","Journal of the Chemical Society, Dalton Transactions","2000","","5","821","","10.1039/a907077j","","","0.71073","MoKα","","0.0797","0.0652","","","0.1852","0.2014","","","","","","1.046","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008943","10.385","0.014","41.89","0.05","10.757","0.012","90","","115.7","0.01","90","","4217","9","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H29 La N14 O21 -","- C32 H29 La N14 O21 -","- C128 H116 La4 N56 O84 -","4","1","","Drew, Michael G. B.; Iveson, Peter B.; Hudson, Michael J.; Liljenzin, Jan Olov; Spjuth, Lena; Cordier, Pierre-Yves; Enarsson, Åsa; Hill, Clément; Madic, Charles","Separation of americium(III) from europium(III) with tridentate heterocyclic nitrogen ligands and crystallographic studies of complexes formed by 2,2'∶6',2″-terpyridine with the lanthanides","Journal of the Chemical Society, Dalton Transactions","2000","","5","821","","10.1039/a907077j","","","0.71073","MoKα","","0.1372","0.1111","","","0.2245","0.2367","","","","","","1.276","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008944","11.585","0.002","16.787","0.004","18.492","0.003","95.11","0.02","106.077","0.013","94.17","0.03","3424","1.2","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","Acetato[5-phenylpyrazole][hydrido-tris-{3-pyrazol-1-yl}borato]copper(II)","","- C38 H33 B Cu N8 O2 -","- C38 H33 B Cu N8 O2 -","- C152 H132 B4 Cu4 N32 O8 -","4","2","","Chia, Li Mei Lindy; Radojevic, Sanja; Scowen, Ian J.; McPartlin, Mary; Halcrow, Malcolm A.","Steric control of the reactivity of moderately hindered tris(pyrazolyl)borates with copper(II) salts †","Journal of the Chemical Society, Dalton Transactions","2000","","2","133","","10.1039/a907258f","","","0.71073","MoKα","","0.1425","0.054","","0.1571","0.1088","","","","0.98","1.046","1.046","","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008945","11.514","0.002","18.291","0.003","12.439","0.002","90","","93.666","0.01","90","","2614.3","0.8","223","2","223","2","","","","","","","","7","P 1 21/m 1","-P 2yb","11","","Bis-[5-cyclohexylpyrazole][hydrido-tris-{3-cyclohexylpyrazol-1-yl}borato] copper(II) tetrafluoroborate chloroform solvate","","- C46 H69 B2 Cl3 Cu F4 N10 -","- C46 H69 B2 Cl3 Cu F4 N10 -","- C92 H138 B4 Cl6 Cu2 F8 N20 -","2","0.5","","Chia, Li Mei Lindy; Radojevic, Sanja; Scowen, Ian J.; McPartlin, Mary; Halcrow, Malcolm A.","Steric control of the reactivity of moderately hindered tris(pyrazolyl)borates with copper(II) salts †","Journal of the Chemical Society, Dalton Transactions","2000","","2","133","","10.1039/a907258f","","","0.71073","MoKα","","0.1456","0.0721","","0.2541","0.1676","","","","1.016","1.11","1.11","","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008946","11.4095","0.0017","21.315","0.004","18.692","0.004","90","","95.435","0.015","90","","4525.3","1.5","223","2","223","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","[5-Cyclohexylpyrazole][5-cyclohexylpyrazolato][hydrido-tris-{3-cyclohexyl- pyrazol-1-yl}borato]copper(II)","","- C45 H66 B Cu N10 -","- C45 H66 B Cu N10 -","- C180 H264 B4 Cu4 N40 -","4","1","","Chia, Li Mei Lindy; Radojevic, Sanja; Scowen, Ian J.; McPartlin, Mary; Halcrow, Malcolm A.","Steric control of the reactivity of moderately hindered tris(pyrazolyl)borates with copper(II) salts †","Journal of the Chemical Society, Dalton Transactions","2000","","2","133","","10.1039/a907258f","","","0.71073","MoKα","","0.1988","0.0734","","","0.1719","0.2647","","","","","","0.922","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008947","10.4727","0.0002","14.5022","0.0003","11.976","0.0002","90","","100.145","0.001","90","","1790.44","0.06","293","2","293","2","","","","","","","-","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H56 N2 P4 S4 Te -","- C24 H56 N2 P4 S4 Te -","- C48 H112 N4 P8 S8 Te2 -","2","0.5","","Birdsall, David J.; Novosad, Josef; Slawin, Alexandra M. Z.; Woollins, J. Derek","Synthesis and crystal structures of tellurium complexes containing imidophosphinate ligands","Journal of the Chemical Society, Dalton Transactions","2000","","4","435","","10.1039/a907336a","","","0.71073","MoKα","","0.0224","0.0196","","0.0594","0.0559","","","","0.528","0.523","0.523","","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008948","10.4307","0.0003","12.7543","0.0001","14.4033","0.0003","114.94","0.001","108.696","0.001","89.7","0.001","1626.86","0.06","293","2","293","2","","","","","","","-","7","P -1","-P 1","2","","","","- C49.5 H89.5 Cl4.5 N2 P4 S4 Te -","- C49.5 H89.5 Cl4.5 N2 P4 S4 Te -","- C49.5 H89.5 Cl4.5 N2 P4 S4 Te -","1","0.5","","Birdsall, David J.; Novosad, Josef; Slawin, Alexandra M. Z.; Woollins, J. Derek","Synthesis and crystal structures of tellurium complexes containing imidophosphinate ligands","Journal of the Chemical Society, Dalton Transactions","2000","","4","435","","10.1039/a907336a","","","0.71073","MoKα","","0.0855","0.0545","","0.184","0.1305","","","","1.047","1.052","1.052","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7008949","22.7944","0.0011","11.8286","0.0005","30.2546","0.0014","90","","103.018","0.001","90","","7947.8","0.6","293","2","293","2","","","","","","","-","7","C 1 2/c 1","-C 2yc","15","","","","- C32 H40 N2 O4 P4 S4 Te -","- C32 H40 N2 O4 P4 S4 Te -","- C256 H320 N16 O32 P32 S32 Te8 -","8","1","","Birdsall, David J.; Novosad, Josef; Slawin, Alexandra M. Z.; Woollins, J. Derek","Synthesis and crystal structures of tellurium complexes containing imidophosphinate ligands","Journal of the Chemical Society, Dalton Transactions","2000","","4","435","","10.1039/a907336a","","","0.71073","MoKα","","0.0633","0.0323","","0.0809","0.0599","","","","0.894","0.93","0.93","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7008950","9.7171","0.0007","11.943","0.0008","18.453","0.0011","90","","104.162","0.002","90","","2076.4","0.2","293","2","293","2","","","","","","","-","6","P 1 21/c 1","-P 2ybc","14","","","","- C36 H48 N2 P4 S4 Te -","- C36 H48 N2 P4 S4 Te -","- C72 H96 N4 P8 S8 Te2 -","2","0.5","","Birdsall, David J.; Novosad, Josef; Slawin, Alexandra M. Z.; Woollins, J. Derek","Synthesis and crystal structures of tellurium complexes containing imidophosphinate ligands","Journal of the Chemical Society, Dalton Transactions","2000","","4","435","","10.1039/a907336a","","","0.71073","MoKα","","0.1246","0.0474","","0.1051","0.0765","","","","0.777","0.892","0.892","","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008951","10.4104","0.0007","14.7541","0.0011","12.1815","0.0008","90","","98.739","0.002","90","","1849.3","0.2","293","2","293","2","","","","","","","-","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H56 N2 P4 Se4 Te -","- C24 H56 N2 P4 Se4 Te -","- C48 H112 N4 P8 Se8 Te2 -","2","0.5","","Birdsall, David J.; Novosad, Josef; Slawin, Alexandra M. Z.; Woollins, J. Derek","Synthesis and crystal structures of tellurium complexes containing imidophosphinate ligands","Journal of the Chemical Society, Dalton Transactions","2000","","4","435","","10.1039/a907336a","","","0.71073","MoKα","","0.0441","0.0249","","0.0525","0.0425","","","","0.911","0.98","0.98","","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008952","9.1666","0.0003","11.173","0.0004","13.5041","0.0004","90","","100.144","0.001","90","","1361.45","0.08","293","2","293","2","","","","","","","-","8","P 1 21 1","P 2yb","4","","","","- C19 H35 Cl2 N O P2 S2 Te -","- C19 H35 Cl2 N O P2 S2 Te -","- C38 H70 Cl4 N2 O2 P4 S4 Te2 -","2","1","","Birdsall, David J.; Novosad, Josef; Slawin, Alexandra M. Z.; Woollins, J. Derek","Synthesis and crystal structures of tellurium complexes containing imidophosphinate ligands","Journal of the Chemical Society, Dalton Transactions","2000","","4","435","","10.1039/a907336a","","","0.71073","MoKα","","0.0258","0.0232","","0.0758","0.0599","","","","1.055","1.052","1.052","","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008953","13.4268","0.0002","14.0714","0.0004","15.5035","0.0004","90","","90","","90","","2929.14","0.12","293","2","293","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","9","","- C25 H31 Cl2 N O P2 S2 Te -","- C25 H31 Cl2 N O P2 S2 Te -","- C100 H124 Cl8 N4 O4 P8 S8 Te4 -","4","1","","Birdsall, David J.; Novosad, Josef; Slawin, Alexandra M. Z.; Woollins, J. Derek","Synthesis and crystal structures of tellurium complexes containing imidophosphinate ligands","Journal of the Chemical Society, Dalton Transactions","2000","","4","435","","10.1039/a907336a","","","0.71073","MoKα","","0.1052","0.0573","","0.1385","0.1119","","","","0.893","0.975","0.975","","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008954","11.03","0.002","12.477","0.002","15.874","0.003","90","","90","","90","","2184.6","0.7","173","2","173","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C18 H31 Cl N4 Ni O4 S -","- C18 H31 Cl N4 Ni O4 S -","- C72 H124 Cl4 N16 Ni4 O16 S4 -","4","1","","M. Dolores Santana; Gabriel García; Antonio Rufete; M. Carmen Ramírez de Arellano; Gregorio López","Synthesis, characterization and crystal structures of the first pentacoordinate nickel(II) complexes containing N,S-donor ligands","J. Chem. Soc., Dalton Trans.","2000","","4","619","625","10.1039/a907367a","","","0.71073","MoKα","","0.1302","0.0865","","0.3368","0.2278","","","","1.075","1.117","1.117","","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008955","11.202","0.003","24.771","0.007","16.585","0.005","90","","93.1","0.02","90","","4595","2","291","2","291","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C17 H30 F6 N5 Ni P S -","- C17 H30 F6 N5 Ni P S -","- C136 H240 F48 N40 Ni8 P8 S8 -","8","2","","M. Dolores Santana; Gabriel García; Antonio Rufete; M. Carmen Ramírez de Arellano; Gregorio López","Synthesis, characterization and crystal structures of the first pentacoordinate nickel(II) complexes containing N,S-donor ligands","J. Chem. Soc., Dalton Trans.","2000","","4","619","625","10.1039/a907367a","","","0.71073","MoKα","","0.1452","0.0768","","","0.1924","0.2213","","","","","","0.889","","","","has coordinates,has disorder","179793","2020-10-21","18:00:00",""
"7008956","10.938","0.002","14.318","0.002","15.938","0.002","90","","92.728","0.012","90","","2493.2","0.7","293","2","293","2","","","","","","","slow evaporation acetone solution","7","P 1 21/c 1","-P 2ybc","14","","","","- C20 H32 F6 N5 Ni P S -","- C20 H32 F6 N5 Ni P S -","- C80 H128 F24 N20 Ni4 P4 S4 -","4","1","","M. Dolores Santana; Gabriel García; Antonio Rufete; M. Carmen Ramírez de Arellano; Gregorio López","Synthesis, characterization and crystal structures of the first pentacoordinate nickel(II) complexes containing N,S-donor ligands","J. Chem. Soc., Dalton Trans.","2000","","4","619","625","10.1039/a907367a","","","0.71073","MoKα","","0.1318","0.0673","","0.2004","0.1707","","","","0.904","1.096","1.096","","","","","has coordinates,has disorder","179793","2020-10-21","18:00:00",""
"7008957","11.3954","0.0007","14.062","0.001","22.994","0.001","90","","101.167","0.004","90","","3614.8","0.4","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H32 Cu2 N16 O16.15 -","- C24 H32 Cu2 N16 O16.15 -","- C96 H128 Cu8 N64 O64.6 -","4","1","","Xu, Zhiqiang; Thompson, Laurence K.; Matthews, Craig J.; Miller, David O.; Goeta, Andrés E.; Wilson, Claire; Howard, Judith A. K.; Ohba, Masaaki; Ōkawa, Hisashi","Dinuclear and tetranuclear copper(II) complexes with bridging (N‒N) diazine ligands: variable magnetic exchange topologies †","Journal of the Chemical Society, Dalton Transactions","2000","","1","69","","10.1039/a907390f","","","0.71073","MoKα","","0.0723","0.0476","","","0.0871","0.0982","","","","","","1.157","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008958","20.938","0.004","14.887","0.003","14.372","0.003","90","","127.43","0.03","90","","3557.4","1.9","150","2","150","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C26 H31 Cu2 N14 O15 -","- C26 H31 Cu2 N14 O15 -","- C104 H124 Cu8 N56 O60 -","4","1","","Xu, Zhiqiang; Thompson, Laurence K.; Matthews, Craig J.; Miller, David O.; Goeta, Andrés E.; Wilson, Claire; Howard, Judith A. K.; Ohba, Masaaki; Ōkawa, Hisashi","Dinuclear and tetranuclear copper(II) complexes with bridging (N‒N) diazine ligands: variable magnetic exchange topologies †","Journal of the Chemical Society, Dalton Transactions","2000","","1","69","","10.1039/a907390f","","","0.71073","MoKα","","0.0364","0.0291","","","0.0605","0.0642","","","","","","1.203","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008959","9.709","0.001","17.688","0.002","19.155","0.002","91.691","0.004","95.085","0.003","97.501","0.003","3245.7","0.6","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H25 Cu2 N14 O13.5 -","- C26 H25 Cu2 N14 O13.5 -","- C104 H100 Cu8 N56 O54 -","4","2","","Xu, Zhiqiang; Thompson, Laurence K.; Matthews, Craig J.; Miller, David O.; Goeta, Andrés E.; Wilson, Claire; Howard, Judith A. K.; Ohba, Masaaki; Ōkawa, Hisashi","Dinuclear and tetranuclear copper(II) complexes with bridging (N‒N) diazine ligands: variable magnetic exchange topologies †","Journal of the Chemical Society, Dalton Transactions","2000","","1","69","","10.1039/a907390f","","","0.71073","MoKα","","0.0595","0.0375","","","0.0795","0.091","","","","","","1.065","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7008960","17.226","0.003","12.26","0.002","14.795","0.003","90","","100.208","0.003","90","","3075.1","1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H32 Cu2 N8 O13 -","- C22 H32 Cu2 N8 O13 -","- C88 H128 Cu8 N32 O52 -","4","1","","Xu, Zhiqiang; Thompson, Laurence K.; Matthews, Craig J.; Miller, David O.; Goeta, Andrés E.; Wilson, Claire; Howard, Judith A. K.; Ohba, Masaaki; Ōkawa, Hisashi","Dinuclear and tetranuclear copper(II) complexes with bridging (N‒N) diazine ligands: variable magnetic exchange topologies †","Journal of the Chemical Society, Dalton Transactions","2000","","1","69","","10.1039/a907390f","","","0.71073","MoKα","","0.0353","0.0263","","","0.062","0.0667","","","","","","1.084","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008961","16.965","0.003","16.04","0.009","17.045","0.003","90","","100.72","0.01","90","","4557","3","299.2","","299.2","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C30 H48 Cu4 N20 O18 -","- C30 H48 Cu4 N20 O18 -","- C120 H192 Cu16 N80 O72 -","4","0.5","","Xu, Zhiqiang; Thompson, Laurence K.; Matthews, Craig J.; Miller, David O.; Goeta, Andrés E.; Wilson, Claire; Howard, Judith A. K.; Ohba, Masaaki; Ōkawa, Hisashi","Dinuclear and tetranuclear copper(II) complexes with bridging (N–N) diazine ligands: variable magnetic exchange topologies †","Journal of the Chemical Society, Dalton Transactions","2000","","1","69","","10.1039/a907390f","","","0.7107","MoKα","","0.0559","0.032","","0.033","","0.031","","","1.459","","","1.56","","","","has coordinates","277925","2022-09-16","19:05:43",""
"7008962","10.757","0.004","10.993","0.003","10.59","0.003","110.8","0.02","99.77","0.03","90.34","0.03","1150.7","0.7","299.2","","299.2","","","","","","","","","5","P -1","-P 1","2","","","","- C16 H17 Cu2 N11 O9 -","- C16 H17 Cu2 N11 O9 -","- C32 H34 Cu4 N22 O18 -","2","1","","Xu, Zhiqiang; Thompson, Laurence K.; Matthews, Craig J.; Miller, David O.; Goeta, Andrés E.; Wilson, Claire; Howard, Judith A. K.; Ohba, Masaaki; Ōkawa, Hisashi","Dinuclear and tetranuclear copper(II) complexes with bridging (N‒N) diazine ligands: variable magnetic exchange topologies †","Journal of the Chemical Society, Dalton Transactions","2000","","1","69","","10.1039/a907390f","","","0.7107","MoKα","","0.1024","0.044","","0.049","","0.043","","","1.419","","","1.62","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7008963","17.354","0.003","14.05","0.003","17.78","0.003","90","","105.45","0.01","90","","4178.5","1.4","23","","23","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","?","- C144 H76 Cu4 F96 Gd4 N8 O32 -","- C144 H76 Cu4 F96 Gd4 N8 O32 -","","","","Sasaki, Miwa; Manseki, Kazuhiro; Horiuchi, Hiroaki; Kumagai, Motoko; Sakamoto, Masatomi; Sakiyama, Hiroshi; Nishida, Yuzo; Sakai, Masahiro; Sadaoka, Yoshihiko; Ohba, Masaaki; Ōkawa, Hisashi","Synthesis, structure, and magnetic properties of discrete d–f heterodinuclear complexes designed from tetrahedrally distorted [Cu(salabza)] (H2salabza = N,N '-bis(salicylidene)-2-aminobenzylamine) and [Ln(hfac)3] (Hhfac = 1,1,1,5,5,5-hexafluoroacetylacetone, Ln = Gd or Lu)","Journal of the Chemical Society, Dalton Transactions","2000","","3","259","","10.1039/a907423f","","","0.7107","MoKalpha","","","0.034","","","0.04","","","","","1.3","1.3","","","","","has coordinates","288156","2023-12-07","18:40:59",""
"7008964","17.312","0.002","14.03","0.001","17.765","0.002","90","","106.093","0.007","90","","4145.8","0.7","23","","23","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","?","- C144 H76 Cu4 F120 Lu4 N8 O32 -","- C144 H76 Cu4 F120 Lu4 N8 O32 -","","","","Sasaki, Miwa; Manseki, Kazuhiro; Horiuchi, Hiroaki; Kumagai, Motoko; Sakamoto, Masatomi; Sakiyama, Hiroshi; Nishida, Yuzo; Sakai, Masahiro; Sadaoka, Yoshihiko; Ohba, Masaaki; Ōkawa, Hisashi","Synthesis, structure, and magnetic properties of discrete d–f heterodinuclear complexes designed from tetrahedrally distorted [Cu(salabza)] (H2salabza = N,N '-bis(salicylidene)-2-aminobenzylamine) and [Ln(hfac)3] (Hhfac = 1,1,1,5,5,5-hexafluoroacetylacetone, Ln = Gd or Lu)","Journal of the Chemical Society, Dalton Transactions","2000","","3","259","","10.1039/a907423f","","","0.7107","MoKalpha","","","0.032","","","0.026","","","","","1.43","1.43","","","","","has coordinates","288156","2023-12-07","18:40:59",""
"7008965","11.516","0.002","8.972","0.002","16.562","0.002","90","","98.86","0.01","90","","1690.8","0.5","296.2","","296.2","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H16 Cu N2 O2 -","- C21 H16 Cu N2 O2 -","- C84 H64 Cu4 N8 O8 -","4","1","","Sasaki, Miwa; Manseki, Kazuhiro; Horiuchi, Hiroaki; Kumagai, Motoko; Sakamoto, Masatomi; Sakiyama, Hiroshi; Nishida, Yuzo; Sakai, Masahiro; Sadaoka, Yoshihiko; Ohba, Masaaki; Ōkawa, Hisashi","Synthesis, structure, and magnetic properties of discrete d‒f heterodinuclear complexes designed from tetrahedrally distorted [Cu(salabza)] (H2salabza = N,N '-bis(salicylidene)-2-aminobenzylamine) and [Ln(hfac)3] (Hhfac = 1,1,1,5,5,5-hexafluoroacetylacetone, Ln = Gd or Lu)","Journal of the Chemical Society, Dalton Transactions","2000","","3","259","","10.1039/a907423f","","","0.7107","MoKα","","0","0","","","0","0.026","","","","","","1.53","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7008966","12.4137","0.001","26.0069","0.001","13.3715","0.001","90","","99.644","0.004","90","","4255.9","0.5","200","2","200","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C39 H36 F12 N8 Ni P2 S2 -","- C39 H36 F12 N8 Ni P2 S2 -","- C156 H144 F48 N32 Ni4 P8 S8 -","4","0.5","","Priimov, Gleb U.; Moore, Peter; Maritim, Philip K.; Butalanyi, Pamela K.; Alcock, Nathaniel W.","Synthesis of two covalently linked bis(2,2':6',2″-terpyridine) (terpy) chelating ligands with different length spacers, comparison of the crystal structures of their mononuclear nickel(II) complexes, and kinetic and mechanistic studies of the reaction of one ligand with [Fe(terpy)2]2+","Journal of the Chemical Society, Dalton Transactions","2000","","4","445","","10.1039/a907543g","","","0.71073","MoKα","","0.0603","0.0397","","0.1134","0.1036","","","","0.986","1.056","1.056","","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008967","26.8148","0.0003","11.2892","0.0002","14.9759","0.0002","90","","90","","90","","4533.47","0.11","200","2","200","2","","","","","","","","8","P n a 21","P 2c -2n","33","","","","- C38.5 H35 F12 N7 Ni O0.25 P2 S2 -","- C38.5 H35 F12 N7 Ni O0.25 P2 S2 -","- C154 H140 F48 N28 Ni4 O P8 S8 -","4","1","","Priimov, Gleb U.; Moore, Peter; Maritim, Philip K.; Butalanyi, Pamela K.; Alcock, Nathaniel W.","Synthesis of two covalently linked bis(2,2':6',2″-terpyridine) (terpy) chelating ligands with different length spacers, comparison of the crystal structures of their mononuclear nickel(II) complexes, and kinetic and mechanistic studies of the reaction of one ligand with [Fe(terpy)2]2+","Journal of the Chemical Society, Dalton Transactions","2000","","4","445","","10.1039/a907543g","","","0.71073","MoKα","","0.1267","0.0606","","","0.1407","0.1826","","","","","","1.057","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7008968","11.448","0.002","11.891","0.002","18.19","0.004","72.08","0.03","89.71","0.03","78.22","0.03","2302","0.9","203","2","203","2","","","","","","","","7","P -1","-P 1","2","","","","- C56 H40 Ag B F4 N4 O4 -","- C56 H40 Ag B F4 N4 O4 -","- C112 H80 Ag2 B2 F8 N8 O8 -","2","1","","Schmittel, Michael; Ganz, Andrea; Fenske, Dieter; Herderich, Markus","Heteroleptic silver(I) and zinc(II) bis(phenanthroline) complexes","Journal of the Chemical Society, Dalton Transactions","2000","","3","353","","10.1039/a907545c","","","0.71073","MoKα","","0.0506","0.0426","","0.1554","0.1214","","","","0.378","0.321","0.321","","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008969","7.603","0.006","7.256","0.006","11.538","0.008","90","","105.715","0.007","90","","612.7","0.8","293","2","293","2","","","","","","","synthetic","3","P 1 21/c 1","-P 2ybc","14","","2,2,4,4-Tetrakis(trifluormethyl)-1,3-ditelluretane","","- C6 F12 Te2 -","- C6 F12 Te2 -","- C12 F24 Te4 -","2","0.5","","Baum, Michael; Beck, Johannes; Haas, Alois; Herrendorf, Wolfgang; Monsé, Christian","Perfluoroalkyltellurocarbonyl fluorides, their cyclic dimers and perfluoroalkanetellurenyl iodides: preparation and reactivity †","Journal of the Chemical Society, Dalton Transactions","2000","","1","11","","10.1039/a907549f","","","0.71073","MoKα","","0.0397","0.0249","","0.057","0.0494","","","","1.108","1.108","1.108","","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008970","7.771","0.007","6.749","0.002","10.685","0.002","90","","105.3","0.04","90","","540.5","0.5","293","2","293","2","","","","","","","synthetic","4","P 1 21/c 1","-P 2ybc","14","","trans-2,4-Bis(trifluormethyl)-2,4-dichloro-1,3,ditelluretane","","- C4 Cl2 F6 Te2 -","- C4 Cl2 F6 Te2 -","- C8 Cl4 F12 Te4 -","2","0.5","","Baum, Michael; Beck, Johannes; Haas, Alois; Herrendorf, Wolfgang; Monsé, Christian","Perfluoroalkyltellurocarbonyl fluorides, their cyclic dimers and perfluoroalkanetellurenyl iodides: preparation and reactivity †","Journal of the Chemical Society, Dalton Transactions","2000","","1","11","","10.1039/a907549f","","","0.71073","MoKα","","0.1373","0.1254","","0.2535","0.2431","","","","1.228","1.278","1.278","","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008971","18.3692","0.0011","17.6964","0.0007","7.0048","0.0004","90","","102.902","0.002","90","","2219.6","0.2","173","2","173","2","","","","","","","synthesized by H. Grove","5","C 1 2/m 1","-C 2y","12","","","","- C18 H18 Cu2 N4 O13 -","- C18 H16 Cu2 N4 O13 -","- C72 H64 Cu8 N16 O52 -","4","0.5","","Grove, Hilde; Sletten, Jorunn; Julve, Miguel; Lloret, Francesc","Syntheses, crystal structures and magnetic properties of dinuclear copper(II) complexes with pyrazino[2,3-f ][4,7]phenanthroline (pap) as bridging ligand","Journal of the Chemical Society, Dalton Transactions","2000","","4","515","","10.1039/a907658a","","","0.71073","MoKα","","0.055","0.0403","","0.1173","0.1082","","","","1.107","1.157","1.157","","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008972","7.3457","0.0002","13.2214","0.0004","14.5128","0.0003","114.229","0.001","99.13","","90.252","0.001","1265.26","0.06","173","2","173","2","","","","","","","synthesized by H. Grove","6","P -1","-P 1","2","","","","- C14 H28 Cu2 N4 O18 S2 -","- C14 H28 Cu2 N4 O18 S2 -","- C28 H56 Cu4 N8 O36 S4 -","2","1","","Grove, Hilde; Sletten, Jorunn; Julve, Miguel; Lloret, Francesc","Syntheses, crystal structures and magnetic properties of dinuclear copper(II) complexes with pyrazino[2,3-f ][4,7]phenanthroline (pap) as bridging ligand","Journal of the Chemical Society, Dalton Transactions","2000","","4","515","","10.1039/a907658a","","","0.71073","MoKα","","0.0414","0.0293","","0.0735","0.0682","","","","1.024","1.057","1.057","","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008973","8.7332","0.0003","9.0065","0.0003","27.6888","0.0004","90","","98.149","0.002","90","","2155.89","0.11","173","2","173","2","","","","","","","synthesized by H. Grove","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H14 Cu2 N8 O15 -","- C14 H14 Cu2 N8 O15 -","- C56 H56 Cu8 N32 O60 -","4","1","","Grove, Hilde; Sletten, Jorunn; Julve, Miguel; Lloret, Francesc","Syntheses, crystal structures and magnetic properties of dinuclear copper(II) complexes with pyrazino[2,3-f ][4,7]phenanthroline (pap) as bridging ligand","Journal of the Chemical Society, Dalton Transactions","2000","","4","515","","10.1039/a907658a","","","0.71073","MoKα","","0.0605","0.0347","","0.0805","0.0703","","","","1.016","1.054","1.054","","","","","has coordinates,has disorder","179793","2020-10-21","18:00:00",""
"7008974","8.654","0.002","11.277","0.002","21.593","0.004","74.93","0.03","79.94","0.03","86.42","0.03","2003.2","0.8","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C28 H43 Cu F18 N6 O6 P3 -","- C28 H31 Cu F18 N6 O6 P3 -","- C56 H62 Cu2 F36 N12 O12 P6 -","2","1","","Turonek, Mary L.; Moore, Peter; Errington, William","Synthesis of the terpyridyl pendant-arm azamacrocycle 4'-( p-1,4,7-triazacyclonon-1-ylmethylphenyl)-2,2'∶6',2″-terpyridine (L) and complexes of L with copper(II) and nickel(II). Crystal structure of [Cu(HL)(H2O)2][PF6]3","Journal of the Chemical Society, Dalton Transactions","2000","","4","441","","10.1039/a907717k","","","0.71073","MoKα","","0.1749","0.0569","","","0.0927","0.116","","","","","","0.545","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008975","10.0293","0.0012","10.9976","0.0013","15.7176","0.0018","94.154","0.002","93.941","0.002","107.329","0.002","1643.1","0.3","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","tetramolybdenumdiniobiumoctaoxotetradecaisopropoxide","","- C42 H98 Mo4 Nb2 O22 -","- C42 H98 Mo4 Nb2 O22 -","- C42 H98 Mo4 Nb2 O22 -","1","0.5","","Johansson, Anders; Roman, Magnus; Seisenbaeva, Gulaim A.; Kloo, Lars; Szabo, Zoltan; Kessler, Vadim G.","The solution thermolysis approach to molybdenum(V) alkoxides: synthesis, solid state and solution structures of the bimetallic alkoxides of molybdenum(V) and niobium(V), tantalum(V) and tungsten(VI)","Journal of the Chemical Society, Dalton Transactions","2000","","3","387","","10.1039/a907720k","","","0.71073","MoKα","","0.1403","0.0453","","","0.0869","0.1095","","","","","","0.808","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008976","10.0444","0.0017","11.007","0.0019","15.769","0.003","94.159","0.005","94.091","0.007","107.143","0.004","1653.7","0.5","295","2","295","2","","","","","","","","5","P -1","-P 1","2","Molybdenum-tantalum oxoisopropoxide","","","- C42 H98 Mo4 O22 Ta2 -","- C21 H48 Mo2 O11 Ta -","- C42 H96 Mo4 O22 Ta2 -","2","1","","Johansson, Anders; Roman, Magnus; Seisenbaeva, Gulaim A.; Kloo, Lars; Szabo, Zoltan; Kessler, Vadim G.","The solution thermolysis approach to molybdenum(V) alkoxides: synthesis, solid state and solution structures of the bimetallic alkoxides of molybdenum(V) and niobium(V), tantalum(V) and tungsten(VI)","Journal of the Chemical Society, Dalton Transactions","2000","","3","387","","10.1039/a907720k","","","0.71073","MoKα","","0.0684","0.043","","","0.0943","0.0974","","","","","","0.737","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008977","18.8123","0.0011","18.5541","0.0011","29.0517","0.0018","90","","90","","90","","10140.4","1.1","293","2","295","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","trimolybdenumditantalumoctaoxodecaisopropoxide","","- C30 H70 Mo3 O18 Ta2 -","- C30 Mo3 O18 Ta2 -","- C240 Mo24 O144 Ta16 -","8","1","","Johansson, Anders; Roman, Magnus; Seisenbaeva, Gulaim A.; Kloo, Lars; Szabo, Zoltan; Kessler, Vadim G.","The solution thermolysis approach to molybdenum(V) alkoxides: synthesis, solid state and solution structures of the bimetallic alkoxides of molybdenum(V) and niobium(V), tantalum(V) and tungsten(VI)","Journal of the Chemical Society, Dalton Transactions","2000","","3","387","","10.1039/a907720k","","","0.71073","MoKα","","0.145","0.0507","","","0.1161","0.1535","","","","","","0.906","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008978","10","0.02","11.44","0.02","13.29","0.03","98.95","0.04","91.64","0.04","106.15","0.04","1438","5","295","2","295","2","","","","","","","","5","P -1","-P 1","2","molybdenum-tungsten oxoisopropoxide","","","- C36 H84 Mo4.96 O22 W1.04 -","- C36 H82 Mo4.96 O22 W1.034 -","- C36 H82 Mo4.96 O22 W1.034 -","1","0.5","","Johansson, Anders; Roman, Magnus; Seisenbaeva, Gulaim A.; Kloo, Lars; Szabo, Zoltan; Kessler, Vadim G.","The solution thermolysis approach to molybdenum(V) alkoxides: synthesis, solid state and solution structures of the bimetallic alkoxides of molybdenum(V) and niobium(V), tantalum(V) and tungsten(VI)","Journal of the Chemical Society, Dalton Transactions","2000","","3","387","","10.1039/a907720k","","","0.71073","MoKα","","0.1047","0.0641","","","0.1489","0.157","","","","","","0.81","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008979","9.137","0.002","9.865","0.002","12.474","0.003","111.551","0.004","98.789","0.004","104.757","0.004","972.6","0.4","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","ditantalumdimethoxooctaisopropoxide","","- C26 H62 O10 Ta2 -","- C26 H62 O10 Ta2 -","- C26 H62 O10 Ta2 -","1","0.5","","Johansson, Anders; Roman, Magnus; Seisenbaeva, Gulaim A.; Kloo, Lars; Szabo, Zoltan; Kessler, Vadim G.","The solution thermolysis approach to molybdenum(V) alkoxides: synthesis, solid state and solution structures of the bimetallic alkoxides of molybdenum(V) and niobium(V), tantalum(V) and tungsten(VI)","Journal of the Chemical Society, Dalton Transactions","2000","","3","387","","10.1039/a907720k","","","0.71073","MoKα","","0.0717","0.0422","","","0.082","0.0863","","","","","","0.798","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008980","10.242","0.009","11.447","0.006","9.725","0.008","112.13","0.05","115.65","0.06","78.56","0.06","951.2","1.4","296.2","","296.2","","","","","","","","","5","P -1","-P 1","2","","","","- C36 H52 P2 Pd2 Si2 -","- C36 H52 P2 Pd2 Si2 -","- C36 H52 P2 Pd2 Si2 -","1","0.5","","Kim, Yong-Joo; Lee, Sang-Chul; Park, Jong-Il; Osakada, Kohtaro; Choi, Jun-Chul; Yamamoto, Takakazu","Dipalladium complexes with bridging diorganosilyl ligands. Synthesis, structure, and properties of [LPd(μ-SiH(R)Ph)]2 (R = Ph or Me; L = PMe3, PEt3 or PMePh2)","Journal of the Chemical Society, Dalton Transactions","2000","","3","417","","10.1039/a907745f","","","0.7107","MoKα","","","0.038","","","","0.045","","","","","","2.57","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7008981","8.419","0.004","16.222","0.004","10.24","0.004","90","","108.58","0.03","90","","1325.6","0.9","296.2","","296.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H36 P2 Pd2 Si2 -","- C20 H36 P2 Pd2 Si2 -","- C40 H72 P4 Pd4 Si4 -","2","0.5","","Kim, Yong-Joo; Lee, Sang-Chul; Park, Jong-Il; Osakada, Kohtaro; Choi, Jun-Chul; Yamamoto, Takakazu","Dipalladium complexes with bridging diorganosilyl ligands. Synthesis, structure, and properties of [LPd(μ-SiH(R)Ph)]2 (R = Ph or Me; L = PMe3, PEt3 or PMePh2)","Journal of the Chemical Society, Dalton Transactions","2000","","3","417","","10.1039/a907745f","","","0.7107","MoKα","","","0.033","","","","0.036","","","","","","1.02","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7008982","11.186","0.001","12.432","0.001","21.441","0.003","95.13","0.02","91.7","0.02","97.48","0.02","2941.9","0.6","298.2","","298.2","","","","","","","","","6","P -1","-P 1","2","","","","- C66 H55 N2 P5 Ru S4 -","- C66 H55 N2 P5 Ru S4 -","- C132 H110 N4 P10 Ru2 S8 -","2","1","","Leung, Wa-Hung; Zheng, Hegen; Chim, Joyce L. C.; Chan, Joe; Wong, Wing-Tak; Williams, Ian D.","Ruthenium complexes with N(SPR2)2− (R = Ph or Pri)","Journal of the Chemical Society, Dalton Transactions","2000","","3","423","","10.1039/a907753g","","","0.7107","MoKalpha","","","0.0394","","","0.0334","","","","","1.067","1.067","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7008983","10.142","0.001","12.57","0.001","20.791","0.001","81.67","0.02","89.89","0.02","73.21","0.02","2508.5","0.5","298.2","","298.2","","","","","","","","","6","P -1","-P 1","2","","","","- C42 H71 N2 P5 Ru S4 -","- C42 H73 N2 P5 Ru S4 -","- C84 H146 N4 P10 Ru2 S8 -","2","1","","Leung, Wa-Hung; Zheng, Hegen; Chim, Joyce L. C.; Chan, Joe; Wong, Wing-Tak; Williams, Ian D.","Ruthenium complexes with N(SPR2)2− (R = Ph or Pri)","Journal of the Chemical Society, Dalton Transactions","2000","","3","423","","10.1039/a907753g","","","0.7107","MoKalpha","","","0.0686","","","0.0792","","","","","2.07","2.07","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7008984","47.259","0.003","11.459","0.002","26.739","0.002","90","","97.98","0.02","90","","14340","3","298.2","","298.2","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C73 H61.5 N3.5 P6 Ru S6 -","- C74 H63 N4 P6 Ru S6 -","- C592 H504 N32 P48 Ru8 S48 -","8","1","","Leung, Wa-Hung; Zheng, Hegen; Chim, Joyce L. C.; Chan, Joe; Wong, Wing-Tak; Williams, Ian D.","Ruthenium complexes with N(SPR2)2− (R = Ph or Pri)","Journal of the Chemical Society, Dalton Transactions","2000","","3","423","","10.1039/a907753g","","","0.7107","MoKalpha","","","0.0539","","","0.0569","","","","","1.481","1.481","","","","","has coordinates","277926","2022-09-16","19:24:31",""
"7008985","13.92","0.004","15.486","0.004","18.123","0.003","90","","104.1","0.02","90","","3789","1.6","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C24 H56 N2 O P4 Ru S5 -","- C24 H56 N2 O P4 Ru S5 -","- C96 H224 N8 O4 P16 Ru4 S20 -","4","1","","Leung, Wa-Hung; Zheng, Hegen; Chim, Joyce L. C.; Chan, Joe; Wong, Wing-Tak; Williams, Ian D.","Ruthenium complexes with N(SPR2)2− (R = Ph or Pri)","Journal of the Chemical Society, Dalton Transactions","2000","","3","423","","10.1039/a907753g","","","0.71073","MoKα","","0.0689","0.0407","","0.1079","0.0872","","","","1.024","1.048","1.048","","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008986","13.736","0.005","21.122","0.005","13.521","0.006","106.91","0.03","117.78","0.03","88.29","0.03","3295","2","298.2","","298.2","","","","","","","","","8","P -1","-P 1","2","","","","- C67 H57 Cl2 N2 O2 P5 Ru S5 -","- C71 H52 Cl2 N2 O2 P5 Ru S5 -","- C142 H104 Cl4 N4 O4 P10 Ru2 S10 -","2","1","","Leung, Wa-Hung; Zheng, Hegen; Chim, Joyce L. C.; Chan, Joe; Wong, Wing-Tak; Williams, Ian D.","Ruthenium complexes with N(SPR2)2− (R = Ph or Pri)","Journal of the Chemical Society, Dalton Transactions","2000","","3","423","","10.1039/a907753g","","","0.7107","MoKalpha","","","0.0937","","","0.0616","","","","","2.111","2.111","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7008987","13.064","0.001","17.607","0.002","15.498","0.002","90","","106.29","0.02","90","","3421.7","0.7","298.2","","298.2","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C30 H43 N O4 P3 Ru S3 -","- C30 H43 N O4 P3 Ru S3 -","- C120 H172 N4 O16 P12 Ru4 S12 -","4","1","","Leung, Wa-Hung; Zheng, Hegen; Chim, Joyce L. C.; Chan, Joe; Wong, Wing-Tak; Williams, Ian D.","Ruthenium complexes with N(SPR2)2− (R = Ph or Pri)","Journal of the Chemical Society, Dalton Transactions","2000","","3","423","","10.1039/a907753g","","","0.7107","MoKalpha","","","0.0593","","","0.0627","","","","","2.015","2.015","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7008988","12.382","0.003","9.993","0.004","11.931","0.004","90","","99.45","0.02","90","","1456.2","0.8","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H13 F2 P -","- C18 H13 F2 P -","- C72 H52 F8 P4 -","4","1","","Corcoran, Christopher; Fawcett, John; Friedrichs, Steffi; Holloway, John H.; Hope, Eric G.; Russell, David R.; Saunders, Graham C.; Stuart, Alison M.","Structural and electronic impact of fluorine in the ortho positions of triphenylphosphine and 1,2-bis(diphenylphosphino)ethane; a comparison of 2,6-difluorophenyl- with pentafluorophenyl-phosphines","Journal of the Chemical Society, Dalton Transactions","2000","","2","161","","10.1039/a907759f","","","0.71073","MoKα","","0.0539","0.0365","","","0.0838","0.0924","","","","","","1.027","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7008989","8.2411","0.001","14.043","0.003","27.145","0.004","90","","90","","90","","3141.5","0.9","180","2","180","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C18 H11 F4 P -","- C18 H9 F4 P -","- C144 H72 F32 P8 -","8","1","","Corcoran, Christopher; Fawcett, John; Friedrichs, Steffi; Holloway, John H.; Hope, Eric G.; Russell, David R.; Saunders, Graham C.; Stuart, Alison M.","Structural and electronic impact of fluorine in the ortho positions of triphenylphosphine and 1,2-bis(diphenylphosphino)ethane; a comparison of 2,6-difluorophenyl- with pentafluorophenyl-phosphines","Journal of the Chemical Society, Dalton Transactions","2000","","2","161","","10.1039/a907759f","","","0.71073","MoKα","","0.069","0.0428","","","0.0949","0.1026","","","","","","1.059","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008990","9.548","0.002","13.703","0.002","13.222","0.006","90","","110.23","0.03","90","","1623.2","0.9","190","2","190","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H9 F6 P -","- C18 H9 F6 P -","- C72 H36 F24 P4 -","4","1","","Corcoran, Christopher; Fawcett, John; Friedrichs, Steffi; Holloway, John H.; Hope, Eric G.; Russell, David R.; Saunders, Graham C.; Stuart, Alison M.","Structural and electronic impact of fluorine in the ortho positions of triphenylphosphine and 1,2-bis(diphenylphosphino)ethane; a comparison of 2,6-difluorophenyl- with pentafluorophenyl-phosphines","Journal of the Chemical Society, Dalton Transactions","2000","","2","161","","10.1039/a907759f","","","0.71073","MoKα","","0.0726","0.0441","","","0.0905","0.1028","","","","","","1.083","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7008991","9.984","0.002","15.583","0.004","16.459","0.004","90","","102.05","0.02","90","","2504.3","1","200","2","200","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H28 Cl2 F2 P2 Pt -","- C24 H28 Cl2 F2 P2 Pt -","- C96 H112 Cl8 F8 P8 Pt4 -","4","1","","Corcoran, Christopher; Fawcett, John; Friedrichs, Steffi; Holloway, John H.; Hope, Eric G.; Russell, David R.; Saunders, Graham C.; Stuart, Alison M.","Structural and electronic impact of fluorine in the ortho positions of triphenylphosphine and 1,2-bis(diphenylphosphino)ethane; a comparison of 2,6-difluorophenyl- with pentafluorophenyl-phosphines","Journal of the Chemical Society, Dalton Transactions","2000","","2","161","","10.1039/a907759f","","","0.71073","MoKα","","0.0726","0.0477","","0.1132","0.102","","","","1.015","1.057","1.057","","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008992","13.152","0.01","10.867","0.004","19.251","0.004","90","","103.58","0.04","90","","2674","2","190","2","190","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H26 Cl2 F4 P2 Pt -","- C24 H25.98 Cl2 F4.02 P2 Pt -","- C96 H103.92 Cl8 F16.08 P8 Pt4 -","4","1","","Corcoran, Christopher; Fawcett, John; Friedrichs, Steffi; Holloway, John H.; Hope, Eric G.; Russell, David R.; Saunders, Graham C.; Stuart, Alison M.","Structural and electronic impact of fluorine in the ortho positions of triphenylphosphine and 1,2-bis(diphenylphosphino)ethane; a comparison of 2,6-difluorophenyl- with pentafluorophenyl-phosphines","Journal of the Chemical Society, Dalton Transactions","2000","","2","161","","10.1039/a907759f","","","0.71073","MoKα","","0.0942","0.0653","","0.1918","0.1674","","","","1.027","1.054","1.054","","","","","has coordinates,has disorder","179793","2020-10-21","18:00:00",""
"7008993","13.253","0.002","10.866","0.001","19.356","0.003","90","","103.19","0.01","90","","2713.9","0.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H24 Cl2 F6 P2 Pt -","- C24 H24 Cl2 F6 P2 Pt -","- C96 H96 Cl8 F24 P8 Pt4 -","4","1","","Corcoran, Christopher; Fawcett, John; Friedrichs, Steffi; Holloway, John H.; Hope, Eric G.; Russell, David R.; Saunders, Graham C.; Stuart, Alison M.","Structural and electronic impact of fluorine in the ortho positions of triphenylphosphine and 1,2-bis(diphenylphosphino)ethane; a comparison of 2,6-difluorophenyl- with pentafluorophenyl-phosphines","Journal of the Chemical Society, Dalton Transactions","2000","","2","161","","10.1039/a907759f","","","0.71073","MoKα","","0.0622","0.0405","","0.1059","0.0934","","","","0.903","0.914","0.914","","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008994","16.194","0.007","12.255","0.005","16.621","0.007","90","","90","","90","","3299","2","190","2","190","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C37 H22 Cl F8 O P2 Rh -","- C37 H22 Cl F8 O P2 Rh -","- C148 H88 Cl4 F32 O4 P8 Rh4 -","4","0.5","","Corcoran, Christopher; Fawcett, John; Friedrichs, Steffi; Holloway, John H.; Hope, Eric G.; Russell, David R.; Saunders, Graham C.; Stuart, Alison M.","Structural and electronic impact of fluorine in the ortho positions of triphenylphosphine and 1,2-bis(diphenylphosphino)ethane; a comparison of 2,6-difluorophenyl- with pentafluorophenyl-phosphines","Journal of the Chemical Society, Dalton Transactions","2000","","2","161","","10.1039/a907759f","","","0.71073","MoKα","","0.0735","0.0467","","0.1067","0.0942","","","","1.059","1.116","1.116","","","","","has coordinates,has disorder","179793","2020-10-21","18:00:00",""
"7008995","9.5237","0.0014","13.309","0.004","13.145","0.002","90","","92.039","0.019","90","","1665.1","0.6","190","2","190","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C37 H22 Cl F8 Ir O P2 -","- C37 H22 Cl F8 Ir O P2 -","- C74 H44 Cl2 F16 Ir2 O2 P4 -","2","0.5","","Corcoran, Christopher; Fawcett, John; Friedrichs, Steffi; Holloway, John H.; Hope, Eric G.; Russell, David R.; Saunders, Graham C.; Stuart, Alison M.","Structural and electronic impact of fluorine in the ortho positions of triphenylphosphine and 1,2-bis(diphenylphosphino)ethane; a comparison of 2,6-difluorophenyl- with pentafluorophenyl-phosphines","Journal of the Chemical Society, Dalton Transactions","2000","","2","161","","10.1039/a907759f","","","0.71073","MoKα","","0.0416","0.0306","","","0.068","0.0718","","","","","","1.146","","","","has coordinates,has disorder","179793","2020-10-21","18:00:00",""
"7008996","16.159","0.002","12.536","0.003","16.644","0.003","90","","90","","90","","3371.6","1.1","190","2","190","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C37 H18 Cl F12 Ir O P2 -","- C37 H18 Cl F12 Ir O P2 -","- C148 H72 Cl4 F48 Ir4 O4 P8 -","4","0.5","","Corcoran, Christopher; Fawcett, John; Friedrichs, Steffi; Holloway, John H.; Hope, Eric G.; Russell, David R.; Saunders, Graham C.; Stuart, Alison M.","Structural and electronic impact of fluorine in the ortho positions of triphenylphosphine and 1,2-bis(diphenylphosphino)ethane; a comparison of 2,6-difluorophenyl- with pentafluorophenyl-phosphines","Journal of the Chemical Society, Dalton Transactions","2000","","2","161","","10.1039/a907759f","","","0.71073","MoKα","","0.058","0.0314","","","0.0525","0.0607","","","","","","1.04","","","","has coordinates,has disorder","179793","2020-10-21","18:00:00",""
"7008997","16.312","0.004","12.303","0.004","16.451","0.004","90","","90","","90","","3301.5","1.6","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C36 H22 Cl2 F8 P2 Pt -","- C36 H22 Cl2 F8 P2 Pt -","- C144 H88 Cl8 F32 P8 Pt4 -","4","0.5","","Corcoran, Christopher; Fawcett, John; Friedrichs, Steffi; Holloway, John H.; Hope, Eric G.; Russell, David R.; Saunders, Graham C.; Stuart, Alison M.","Structural and electronic impact of fluorine in the ortho positions of triphenylphosphine and 1,2-bis(diphenylphosphino)ethane; a comparison of 2,6-difluorophenyl- with pentafluorophenyl-phosphines","Journal of the Chemical Society, Dalton Transactions","2000","","2","161","","10.1039/a907759f","","","0.71073","MoKα","","0.1469","0.0459","","0.099","0.0723","","","","0.971","1.122","1.122","","","","","has coordinates,has disorder","179793","2020-10-21","18:00:00",""
"7008998","16.299","0.003","16.059","0.003","22.341","0.005","90","","90","","90","","5848","2","294","2","294","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C24 H42 N4 O2 Si2 W -","- C24 H42 N4 O2 Si2 W -","- C192 H336 N32 O16 Si16 W8 -","8","1","","Kay Lee, Hung; Wong, Yee-Lok; Zhou, Zhong-Yuan; Zhang, Ze-Ying; Ng, Dennis K. P.; Mak, Thomas C. W.","Synthesis and structures of dioxo-Mo(VI) and -W(VI) amides","Journal of the Chemical Society, Dalton Transactions","2000","","4","539","","10.1039/a907811h","","","0.71073","MoKα","","0.0688","0.0609","","0.1812","0.1751","","","","1.106","1.125","1.125","","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7008999","16.342","0.003","16.007","0.003","22.218","0.004","90","","90","","90","","5811.9","1.8","294","2","294","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C24 H42 Mo N4 O2 Si2 -","- C24 H42 Mo N4 O2 Si2 -","- C192 H336 Mo8 N32 O16 Si16 -","8","1","","Kay Lee, Hung; Wong, Yee-Lok; Zhou, Zhong-Yuan; Zhang, Ze-Ying; Ng, Dennis K. P.; Mak, Thomas C. W.","Synthesis and structures of dioxo-Mo(VI) and -W(VI) amides","Journal of the Chemical Society, Dalton Transactions","2000","","4","539","","10.1039/a907811h","","","0.71073","MoKα","","0.0916","0.0744","","","0.1887","0.2051","","","","","","1.095","","","","has coordinates","179793","2020-10-21","18:00:00",""
"7009000","13.965","0.003","11.848","0.002","14.239","0.003","90","","97.91","0.03","90","","2333.5","0.8","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H30 N4 O2 Si2 W -","- C18 H30 N4 O2 Si2 W -","- C72 H120 N16 O8 Si8 W4 -","4","1","","Kay Lee, Hung; Wong, Yee-Lok; Zhou, Zhong-Yuan; Zhang, Ze-Ying; Ng, Dennis K. P.; Mak, Thomas C. W.","Synthesis and structures of dioxo-Mo(VI) and -W(VI) amides","Journal of the Chemical Society, Dalton Transactions","2000","","4","539","","10.1039/a907811h","","","0.71073","MoKα","","0.0476","0.0392","","","0.1406","0.1461","","","","","","1.115","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009001","13.931","0.003","11.888","0.002","14.295","0.003","90","","97.38","0.03","90","","2347.8","0.8","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H30 Mo N4 O2 Si2 -","- C18 H30 Mo N4 O2 Si2 -","- C72 H120 Mo4 N16 O8 Si8 -","4","1","","Kay Lee, Hung; Wong, Yee-Lok; Zhou, Zhong-Yuan; Zhang, Ze-Ying; Ng, Dennis K. P.; Mak, Thomas C. W.","Synthesis and structures of dioxo-Mo(VI) and -W(VI) amides","Journal of the Chemical Society, Dalton Transactions","2000","","4","539","","10.1039/a907811h","","","0.71073","MoKα","","0.0402","0.0372","","0.139","0.1364","","","","1.095","1.099","1.099","","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009002","8.988","0.003","10.924","0.004","15.272","0.005","99.5","0.03","106.81","0.03","98.56","0.03","1384.7","0.9","298","2","298","2","","","","","","","","6","P -1","-P 1","2","[Mn2(3-Et,4-Me-pyridine)6(N3)3](PF6)","","","- C48 H66 F6 Mn2 N15 P -","- C48 H66 F6 Mn2 N15 P -","- C48 H66 F6 Mn2 N15 P -","1","0.5","","Youssef, Morsy Abu; Escuer, Albert; Goher, Mohamed A. S.; Mautner, Franz A.; Vicente, Ramon","Structure and magnetic behaviour of [{Mn2(3-Et,4-Mepy)6(μ1,1-N3)2(μ1,3-N3)}n][PF6]n and [{Mn2(3-ampy)4(μ1,1-N3)2(μ1,3-N3)(N3)(H2O)· 4H2O}n], two alternating ferro‒antiferromagnetic one-dimensional compounds","Journal of the Chemical Society, Dalton Transactions","2000","","3","413","","10.1039/a907835e","","","0.71069","MoKα","","0.1008","0.0881","","0.2356","0.2222","","","","1.173","1.234","1.234","","","","","has coordinates,has disorder","179794","2020-10-21","18:00:00",""
"7009003","16.881","0.006","12.913","0.003","15.741","0.005","90","","106.64","0.02","90","","3287.6","1.8","298","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","[Mn2(3-aminopyridine)4(N3)4(H2O)](H2O)4","","","- C20 H34 Mn2 N20 O5 -","- C20 H34 Mn2 N20 O5 -","- C80 H136 Mn8 N80 O20 -","4","0.5","","Youssef, Morsy Abu; Escuer, Albert; Goher, Mohamed A. S.; Mautner, Franz A.; Vicente, Ramon","Structure and magnetic behaviour of [{Mn2(3-Et,4-Mepy)6(μ1,1-N3)2(μ1,3-N3)}n][PF6]n and [{Mn2(3-ampy)4(μ1,1-N3)2(μ1,3-N3)(N3)(H2O)· 4H2O}n], two alternating ferro‒antiferromagnetic one-dimensional compounds","Journal of the Chemical Society, Dalton Transactions","2000","","3","413","","10.1039/a907835e","","","0.71069","MoKα","","0.0485","0.0373","","0.0875","0.0782","","","","1.084","1.078","1.078","","","","","has coordinates,has disorder","179794","2020-10-21","18:00:00",""
"7009004","8.717","0.001","11.285","0.001","15.057","0.001","99.37","0.01","94","0.03","104.04","0.03","1408.5","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C21 H33 Cl N4 O9 Zn2 -","- C21 H33 Cl N4 O9 Zn2 -","- C42 H66 Cl2 N8 O18 Zn4 -","2","1","","Erxleben, Andrea; Hermann, Jolante","Di- and poly-nuclear zinc(II) Schiff base complexes: synthesis, structural studies and reaction with an α-amino acid ester","Journal of the Chemical Society, Dalton Transactions","2000","","4","569","","10.1039/a907839h","","","0.71069","MoKα","","0.0801","0.048","","0.1581","0.1276","","","","1.042","1.153","1.153","","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009005","8.192","0.002","11.841","0.002","14.52","0.003","100.61","0.03","91.98","0.03","102.71","0.03","1346.3","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H51 N4 O26.5 Zn5 -","- C34 H34 N4 O31 Zn5 -","- C34 H34 N4 O31 Zn5 -","1","0.5","","Erxleben, Andrea; Hermann, Jolante","Di- and poly-nuclear zinc(II) Schiff base complexes: synthesis, structural studies and reaction with an α-amino acid ester","Journal of the Chemical Society, Dalton Transactions","2000","","4","569","","10.1039/a907839h","","","0.71069","MoKα","","0.1485","0.0873","","","0.2059","0.2177","","","","","","1.371","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009006","20.29","0.004","8.514","0.002","19.488","0.004","90","","108.13","0.03","90","","3199.4","1.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C13 H18 N2 O8 Zn -","- C13 H12 N2 O8 Zn -","- C104 H96 N16 O64 Zn8 -","8","1","","Erxleben, Andrea; Hermann, Jolante","Di- and poly-nuclear zinc(II) Schiff base complexes: synthesis, structural studies and reaction with an α-amino acid ester","Journal of the Chemical Society, Dalton Transactions","2000","","4","569","","10.1039/a907839h","","","0.71069","MoKα","","0.0868","0.043","","0.1189","0.088","","","","0.94","1.078","1.078","","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009007","8.951","0.011","14.694","0.012","10.715","0.01","90","","102.08","0.07","90","","1378","2","293","2","293","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","strontium nitridomolybdate oxide","tetra strontium oxonitridomolybdate (VI)","","- Mo N4 O Sr4 -","- Mo N4 O Sr4 -","- Mo8 N32 O8 Sr32 -","8","2","","Paul M. O'Meara; Marten G. Barker; Alexander J. Blake; Paul A. Cooke; Duncan H. Gregory","Synthesis and crystal structure of a new strontium nitridomolybdate oxide, Sr4[MoN4]O","J. Chem. Soc., Dalton Trans.","2000","","5","633","638","10.1039/a907843f","","","0.71073","MoKα","","0.0671","0.048","","","0.1175","0.1303","","","","","","1.057","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009008","11.837","0.002","13.342","0.007","13.729","0.003","95.32","0.07","103.28","0.02","110.28","0.03","1943.8","1.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C44 H35 F3 N2 O2 P2 Pd -","- C44 H35 F3 N2 O2 P2 Pd -","- C88 H70 F6 N4 O4 P4 Pd2 -","2","1","","Dervisi, Athanasia; Edwards, Peter G.; Newman, Paul D.; Tooze, Robert P.","Synthesis and chemistry of diphenyl-2-pyridylphosphine complexes of palladium(0). X-Ray characterisation of Pd(Ph2Ppy)2(η2-DMAD) and trans-Pd(Ph2Ppy)2(PhCCH2)(CF3CO2)","Journal of the Chemical Society, Dalton Transactions","2000","","4","523","","10.1039/a908050c","","","0.71069","MoKα","","0.112","0.0397","","0.074","0.0587","","","","0.437","0.645","0.645","","","","","has coordinates,has disorder","179794","2020-10-21","18:00:00",""
"7009009","9.265","0.0002","7.3546","0.0001","9.9178","0.0001","90","","100.613","0.001","90","","664.242","0.018","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C2 H9 N2 O5 P Ti -","- C2 H9 N2 O5 P Ti -","- C8 H36 N8 O20 P4 Ti4 -","4","1","","Kongshaug, Kjell Ove; Fjellvag, Helmer; Lillerud, Karl Petter","The synthesis and crystal structure of UiO-19; an organically templated layered titanium phosphate with the ULM-11 topology","Journal of the Chemical Society, Dalton Transactions","2000","","4","551","","10.1039/a908051a","","","0.71073","MoKα","","0.0367","0.0315","","","0.0774","0.0805","","","","","","1.058","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009010","14.46","0.004","22.065","0.01","16.364","0.005","90","","101.81","0.01","90","","5111","3","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H27 I3 O7 -","- C20 H24 I3 O7 -","- C160 H192 I24 O56 -","8","2","","Kloo, Lars; Svensson, Per H.; Taylor, Michael J.","Investigations of the polyiodides H3O·Ix (x = 3, 5 or 7) as dibenzo-18-crown-6 complexes","Journal of the Chemical Society, Dalton Transactions","2000","","7","1061","","10.1039/a908053h","","","0.7107","MoKalpha","","","0.0415","","","0.0432","","","","","1.781","1.781","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009011","8.2508","0.0008","24.949","0.005","14.224","0.006","90","","97.59","0.02","90","","2902.3","1.4","273.2","","293","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C20 H27 I5 O7 -","- C20 H24 I5 O7 -","- C80 H96 I20 O28 -","4","1","","Kloo, Lars; Svensson, Per H.; Taylor, Michael J.","Investigations of the polyiodides H3O·Ix (x = 3, 5 or 7) as dibenzo-18-crown-6 complexes","Journal of the Chemical Society, Dalton Transactions","2000","","7","1061","","10.1039/a908053h","","","0.7107","MoKalpha","","","0.039","","","0.0374","","","","","1.559","1.559","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7009012","9.653","0.002","9.754","0.002","9.848","0.002","89.02","0.03","80.92","0.03","66.11","0.03","836.1","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H21 Fe N2 O4 -","- C17 H21 Fe N2 O4 -","- C34 H42 Fe2 N4 O8 -","2","1","","Neves, Ademir; Rossi, Liane M.; Vencato, Ivo; Haase, Wolfgang; Werner, Rüdiger","A new bis(μ-alkoxo) diiron(III) complex and its implications regarding the number of Fe(III)‒phenolate bonds and the redox potential in uteroferrin","Journal of the Chemical Society, Dalton Transactions","2000","","5","707","","10.1039/a908062g","","","0.71073","MoKα","","0.1065","0.0487","","","0.0843","0.1128","","","","","","1.154","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009013","9.087","0.009","9.859","0.01","6.87","0.01","108.65","0.08","96.21","0.05","97.77","0.09","570.2","1.2","173","1","173","1","","","","","","","","6","P -1","-P 1","2","","[Zn(maleic)(thiourea)(H2O)]2.4H2O","","- C5 H12 N2 O7 S Zn -","- C5 H8 N2 O7 S Zn -","- C10 H16 N4 O14 S2 Zn2 -","2","1","","Zhang, Yugen; Jianmin, Li; Nishiura, Masayoshi; Hou, Hongyi; Deng, Wei; Imamoto, Tsuneo","Thermodynamically controlled products: novel motif of metallohelicates stabilized by inter- and intra-helix hydrogen bonds","Journal of the Chemical Society, Dalton Transactions","2000","","3","293","","10.1039/a908070h","","","0.7107","MoKα","","","0.072","","","","0.119","","","","","","2.95","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009014","14.48","0.01","15.64","0.01","10.957","0.006","90","","90","","90","","2481","3","173","1","173","1","","","","","","","","6","P b c a","-P 2ac 2ab","61","","[Zn(maleic)(thiourea)2]n","","- C6 H10 N4 O4 S2 Zn -","- C6 H10 N4 O4 S2 Zn -","- C48 H80 N32 O32 S16 Zn8 -","8","1","","Zhang, Yugen; Jianmin, Li; Nishiura, Masayoshi; Hou, Hongyi; Deng, Wei; Imamoto, Tsuneo","Thermodynamically controlled products: novel motif of metallohelicates stabilized by inter- and intra-helix hydrogen bonds","Journal of the Chemical Society, Dalton Transactions","2000","","3","293","","10.1039/a908070h","","","0.7107","MoKα","","","0.052","","","","0.079","","","","","","1.48","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009015","5.804","0.002","24.97","0.02","6.19","0.005","90","","92.9","0.06","90","","895.9","1.1","173.2","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H16 Cd N4 O10 S2 -","- C10 H16 Cd N4 O10 S2 -","- C20 H32 Cd2 N8 O20 S4 -","2","0.5","","Zhang, Yugen; Jianmin, Li; Nishiura, Masayoshi; Hou, Hongyi; Deng, Wei; Imamoto, Tsuneo","Thermodynamically controlled products: novel motif of metallohelicates stabilized by inter- and intra-helix hydrogen bonds","Journal of the Chemical Society, Dalton Transactions","2000","","3","293","","10.1039/a908070h","","","0.7107","MoKα","","","0.0653","","","","0.0995","","","","","","1.788","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009016","8.238","0.006","8.134","0.006","34.57","0.05","90","","92.51","0.05","90","","2314","4","173.2","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C11 H20 Cd2 N6 O10 S3 -","- C11 H20 Cd2 N6 O10 S3 -","- C44 H80 Cd8 N24 O40 S12 -","4","1","","Zhang, Yugen; Jianmin, Li; Nishiura, Masayoshi; Hou, Hongyi; Deng, Wei; Imamoto, Tsuneo","Thermodynamically controlled products: novel motif of metallohelicates stabilized by inter- and intra-helix hydrogen bonds","Journal of the Chemical Society, Dalton Transactions","2000","","3","293","","10.1039/a908070h","","","0.7107","MoKα","","","0.0512","","","","0.0832","","","","","","1.892","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009017","12.828","0.003","13.487","0.003","9.04","0.002","92.49","0.02","105.25","0.02","61.77","0.02","1323.4","0.6","25","","298","","","","","","","","","5","P -1","-P 1","2","","","","- C29.5 H29.5 Cl Mn N5.5 -","- C30 H27 Cl Mn N5 -","- C60 H54 Cl2 Mn2 N10 -","2","1","","Franceschi, Federico; Hesschenbrouck, Joëlle; Solari, Euro; Floriani, Carlo; Re, Nazzareno; Rizzoli, Corrado; Chiesi-Villa, Angiola","The reactivity of dibenzotetramethyltetraaza[14]annulene-Mn(II): functionalisation of manganese in a macrocyclic environment","Journal of the Chemical Society, Dalton Transactions","2000","","4","593","","10.1039/a908121f","","","1.54178","CuKα","","0.1547","0.0635","","0.2521","0.1744","","","","1.022","1.158","1.158","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009018","12.26","0.002","16.785","0.002","11.637","0.001","99.11","0.02","91.6","0.02","81.55","0.02","2338.8","0.5","25","","143","","","","","","","","","6","P -1","-P 1","2","","","","- C54 H62 B Mn N4 O4 -","- C54 H62 B Mn N4 O4 -","- C108 H124 B2 Mn2 N8 O8 -","2","1","","Franceschi, Federico; Hesschenbrouck, Joëlle; Solari, Euro; Floriani, Carlo; Re, Nazzareno; Rizzoli, Corrado; Chiesi-Villa, Angiola","The reactivity of dibenzotetramethyltetraaza[14]annulene-Mn(II): functionalisation of manganese in a macrocyclic environment","Journal of the Chemical Society, Dalton Transactions","2000","","4","593","","10.1039/a908121f","","","1.54178","CuKα","","0.1391","0.0738","","0.3055","0.2019","","","","1.085","1.175","1.175","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009019","10.892","0.002","13.884","0.002","16.057","0.002","90","0","103.89","0.01","90","0","2357.2","0.6","25","","143","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H30 Mn N5 O2 -","- C26 H30 Mn N5 O2 -","- C104 H120 Mn4 N20 O8 -","4","1","","Franceschi, Federico; Hesschenbrouck, Joëlle; Solari, Euro; Floriani, Carlo; Re, Nazzareno; Rizzoli, Corrado; Chiesi-Villa, Angiola","The reactivity of dibenzotetramethyltetraaza[14]annulene-Mn(II): functionalisation of manganese in a macrocyclic environment","Journal of the Chemical Society, Dalton Transactions","2000","","4","593","","10.1039/a908121f","","","1.54178","CuKα","","0.2015","0.0853","","0.375","0.2255","","","","1.063","1.215","1.215","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009020","10.593","0.003","19.228","0.005","15.663","0.005","90","0","107.71","0.03","90","0","3039.1","1.6","25","","143","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C60 H82 Mn2 N8 Na2 O5 -","- C60 H82 Mn2 N8 Na2 O5 -","- C120 H164 Mn4 N16 Na4 O10 -","2","0.5","","Franceschi, Federico; Hesschenbrouck, Joëlle; Solari, Euro; Floriani, Carlo; Re, Nazzareno; Rizzoli, Corrado; Chiesi-Villa, Angiola","The reactivity of dibenzotetramethyltetraaza[14]annulene-Mn(II): functionalisation of manganese in a macrocyclic environment","Journal of the Chemical Society, Dalton Transactions","2000","","4","593","","10.1039/a908121f","","","0.71069","MoKα","","0.2783","0.0641","","0.2877","0.1598","","","","0.955","1.199","1.199","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009021","14.64","0.003","15.823","0.003","16.375","0.003","97.72","0.03","102.28","0.03","101.94","0.03","3562.6","1.4","25","","223","","","","","","","","","6","P -1","-P 1","2","","","","- C68 H92 Mn2 N8 Na4 O6 -","- C68 H92 Mn2 N8 Na4 O6 -","- C136 H184 Mn4 N16 Na8 O12 -","2","1","","Franceschi, Federico; Hesschenbrouck, Joëlle; Solari, Euro; Floriani, Carlo; Re, Nazzareno; Rizzoli, Corrado; Chiesi-Villa, Angiola","The reactivity of dibenzotetramethyltetraaza[14]annulene-Mn(II): functionalisation of manganese in a macrocyclic environment","Journal of the Chemical Society, Dalton Transactions","2000","","4","593","","10.1039/a908121f","","","0.71069","MoKα","","0.1895","0.077","","0.3672","0.2191","","","","1.469","1.092","1.092","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009022","9.568","0.001","12.333","0.001","15.507","0.001","91.7","","95.32","","100.31","","1790.6","0.3","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C19 H27 Cl13 N8 Si -","- C19 H27 Cl13 N8 Si -","- C38 H54 Cl26 N16 Si2 -","2","1","","Hensen, Karl; Mayr-Stein, Ralf; Stumpf, Thorsten; Pickel, Peter; Bolte, Michael; Fleischer, Holger","Halogen exchange and expulsion: ligand stabilized dihalogen silicon dications","Journal of the Chemical Society, Dalton Transactions","2000","","4","473","","10.1039/a908134h","","","0.71073","MoKα","","0.0618","0.046","","0.1109","0.102","","","","1.03","1.062","1.062","","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009023","9.653","0.001","12.55","0.001","15.709","0.002","92.37","0.01","94.74","0.01","99.17","0.01","1869.4","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C19 H27 Br2 Cl11 N8 Si -","- C19 H27 Br2 Cl11 N8 Si -","- C38 H54 Br4 Cl22 N16 Si2 -","2","1","","Hensen, Karl; Mayr-Stein, Ralf; Stumpf, Thorsten; Pickel, Peter; Bolte, Michael; Fleischer, Holger","Halogen exchange and expulsion: ligand stabilized dihalogen silicon dications","Journal of the Chemical Society, Dalton Transactions","2000","","4","473","","10.1039/a908134h","","","0.71073","MoKα","","0.0526","0.0349","","","0.0724","0.0798","","","","","","1.028","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009024","7.978","0.001","18.955","0.001","9.5847","0.001","90","","100.39","0.01","90","","1425.7","0.2","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H30 Br2 Cl2 N10 Si -","- C20 H30 Br2 Cl2 N10 Si -","- C40 H60 Br4 Cl4 N20 Si2 -","2","0.5","","Hensen, Karl; Mayr-Stein, Ralf; Stumpf, Thorsten; Pickel, Peter; Bolte, Michael; Fleischer, Holger","Halogen exchange and expulsion: ligand stabilized dihalogen silicon dications","Journal of the Chemical Society, Dalton Transactions","2000","","4","473","","10.1039/a908134h","","","0.71073","MoKα","","0.1022","0.0582","","","0.1255","0.1461","","","","","","1.061","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009025","25.308","0.001","12.229","0.001","11.336","0.001","90","","90","","90","","3508.4","0.4","130","2","130","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C19 H29 Cl11 N8 Si -","- C19 H29 Cl11 N8 Si -","- C76 H116 Cl44 N32 Si4 -","4","0.5","","Hensen, Karl; Mayr-Stein, Ralf; Stumpf, Thorsten; Pickel, Peter; Bolte, Michael; Fleischer, Holger","Halogen exchange and expulsion: ligand stabilized dihalogen silicon dications","Journal of the Chemical Society, Dalton Transactions","2000","","4","473","","10.1039/a908134h","","","0.71073","MoKα","","0.0809","0.0503","","0.1396","0.1147","","","","1.051","1.057","1.057","","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009026","9.5765","0.001","8.9186","0.0008","11.8001","0.0009","90","","99.43","0.01","90","","994.22","0.16","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","mer-cis-trichloro diammine dimethylsulfide osmium(III)","","- C2 H12 Cl3 N2 Os S -","- C2 H12 Cl3 N2 Os S -","- C8 H48 Cl12 N8 Os4 S4 -","4","1","","da Silva, M. Fátima C. Guedes; Pombeiro, Armando J. L.; Geremia, Silvano; Zangrando, Ennio; Calligaris, Mario; Zinchenko, Andrey V.; Kukushkin, Vadim Yu.","Unusual pathways for the reaction between [MCl2(Me2SO)4] (M = Os, Ru) and hydrazine dihydrochloride: deoxygenation of sulfoxides vs. coordination of hydrazinium","Journal of the Chemical Society, Dalton Transactions","2000","","8","1363","","10.1039/a908170d","","","0.71073","MoKα","","0.0336","0.0291","","0.0787","0.0771","","","","1.059","1.099","1.099","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7009027","9.0951","0.0007","9.0951","0.0007","11.1941","0.0015","90","","90","","90","","925.99","0.16","293","2","293","2","","","","","","","","6","I 4/m","-I 4","87","","trans dichloro tetrakis(dimethylsulfoxide) osmium(II)","","- C8 H24 Cl2 O4 Os S4 -","- C8 H24 Cl2 O4 Os S4 -","- C16 H48 Cl4 O8 Os2 S8 -","2","0.125","","da Silva, M. Fátima C. Guedes; Pombeiro, Armando J. L.; Geremia, Silvano; Zangrando, Ennio; Calligaris, Mario; Zinchenko, Andrey V.; Kukushkin, Vadim Yu.","Unusual pathways for the reaction between [MCl2(Me2SO)4] (M = Os, Ru) and hydrazine dihydrochloride: deoxygenation of sulfoxides vs. coordination of hydrazinium","Journal of the Chemical Society, Dalton Transactions","2000","","8","1363","","10.1039/a908170d","","","0.71073","MoKα","","0.0163","0.0163","","0.0433","0.0433","","","","1.126","1.126","1.126","","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"7009028","26.202","0.004","8.455","0.001","12.918","0.002","90","","106.55","0.01","90","","2743.3","0.7","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","mer-cis-trichloro dis(dimethylsulfoxide) hydrazinium ruthenium(II)","","- C4 H17 Cl3 N2 O2 Ru S2 -","- C4 H17 Cl3 N2 O2 Ru S2 -","- C32 H136 Cl24 N16 O16 Ru8 S16 -","8","1","","da Silva, M. Fátima C. Guedes; Pombeiro, Armando J. L.; Geremia, Silvano; Zangrando, Ennio; Calligaris, Mario; Zinchenko, Andrey V.; Kukushkin, Vadim Yu.","Unusual pathways for the reaction between [MCl2(Me2SO)4] (M = Os, Ru) and hydrazine dihydrochloride: deoxygenation of sulfoxides vs. coordination of hydrazinium","Journal of the Chemical Society, Dalton Transactions","2000","","8","1363","","10.1039/a908170d","","","0.71073","MoKα","","0.0266","0.0247","","","0.0703","0.0715","","","","","","1.09","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009029","14.495","0.003","17.395","0.002","16.334","0.002","90","","100.98","0.01","90","","4043.1","1.1","293.2","","293.2","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C45 H44 Cu4 N8 O6 -","- C45 H42 Cu4 N8 O6 -","- C180 H168 Cu16 N32 O24 -","4","0.5","","Kruger, Paul E.; Moubaraki, Boujemaa; Fallon, Gary D.; Murray, Keith S.","Tetranuclear copper(II) complexes incorporating short and long metal‒metal separations: synthesis, structure and magnetism †","Journal of the Chemical Society, Dalton Transactions","2000","","5","713","","10.1039/a908177a","","","1.5418","CuKα","","0.0568","0.0388","","0.0655","","0.0478","","","1.806","","","1.536","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009030","18.63","0.002","12.459","0.001","9.319","0.001","81.546","0.008","86.965","0.006","76.897","0.008","2083.4","0.4","293.2","","293.2","","","","","","","","","5","P -1","-P 1","2","","","","- C44 H42 Cu4 N8 O6 -","- C44 H40 Cu4 N8 O6 -","- C88 H80 Cu8 N16 O12 -","2","1","","Kruger, Paul E.; Moubaraki, Boujemaa; Fallon, Gary D.; Murray, Keith S.","Tetranuclear copper(II) complexes incorporating short and long metal‒metal separations: synthesis, structure and magnetism †","Journal of the Chemical Society, Dalton Transactions","2000","","5","713","","10.1039/a908177a","","","1.5418","CuKα","","0.0555","0.0388","","0.0641","","0.0492","","","1.761","","","1.578","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009031","14.852","0.003","8.05","0.002","25.395","0.005","90","","103.18","0.03","90","","2956.2","1.2","293","2","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H13 Cu N5 O6 -","- C12 H13 Cu N5 O6 -","- C96 H104 Cu8 N40 O48 -","8","1","","Palaniandavar, Mallayan; Mahadevan, Sethuraman; Köckerling, Martin; Henkel, Gerald","The structural pathways of (dipicolylamine)dinitratocopper(II): an example of the uncommon see-saw stereochemistry","Journal of the Chemical Society, Dalton Transactions","2000","","7","1151","","10.1039/a908185b","","","0.71073","MoKα","","","0.0573","","","0.0613","","","","","","","1.052","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009032","9.9213","0.0005","15.3887","0.0008","18.1315","0.0009","90","","100.632","0.001","90","","2720.7","0.2","298.2","","298.2","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C56 H74 N2 O2 P2 Pt -","- C58 H64 N2 O2 P2 Pt -","- C116 H128 N4 O4 P4 Pt2 -","2","0.5","","Wong, Wai-Yeung; Choi, Ka-Ho; Cheah, Kwok-Wai","Novel blue luminescent platinum acetylide materials with a 9-acridone or a dansyl group [dansyl = 5-(dimethylamino)naphthalene-1-sulfonyl]","Journal of the Chemical Society, Dalton Transactions","2000","","2","113","","10.1039/a908198d","","","0.7107","MoKalpha","","","0.0337","","","0.0404","","","","","1.109","1.109","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009033","9.959","0.001","12.718","0.001","13.04","0.002","102.72","0.01","102.27","0.01","101.84","0.01","1518.3","0.3","298.2","","298.2","","","","","","","","","7","P -1","-P 1","2","","","","- C54 H84 N4 O4 P2 Pt S2 -","- C54 H84 N4 O4 P2 Pt S2 -","- C54 H84 N4 O4 P2 Pt S2 -","1","0.5","","Wong, Wai-Yeung; Choi, Ka-Ho; Cheah, Kwok-Wai","Novel blue luminescent platinum acetylide materials with a 9-acridone or a dansyl group [dansyl = 5-(dimethylamino)naphthalene-1-sulfonyl]","Journal of the Chemical Society, Dalton Transactions","2000","","2","113","","10.1039/a908198d","","","0.7107","MoKalpha","","","0.0521","","","0.0733","","","","","1.922","1.922","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009034","17.272","0.003","17.272","","17.272","","90","","90","","90","","5152.6","0.9","295.2","","295.2","","","","","","","","","9","P 21 3","P 2ac 2ab 3","198","","","","- C9 H14 B0.67 Cl2 I0.33 N4 O0.67 S2 Tl0.33 -","- C9 H12 B1.33333 Cl2 I0.333333 N4 O0.666667 S2 Tl0.333333 -","- C108 H144 B16 Cl24 I4 N48 O8 S24 Tl4 -","12","1","","Slavin, Paul A.; Reglinski, John; Spicer, Mark D.; Kennedy, Alan R.","Preparation and crystal structure of the [bis{hydrotris(methimazolyl)borato}thallium(III)] cation: modulated chemistry resulting from the use of soft and hard tripodal ligands","Journal of the Chemical Society, Dalton Transactions","2000","","3","239","","10.1039/a908236k","","","0.7107","MoKalpha","","0.085","0.0712","","0.0812","0.0748","","","","","2.514","2.514","","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009035","10.468","0.002","10.543","0.002","10.62","0.002","87.41","0.02","88.53","0.01","86.64","0.01","1168.5","0.4","203.2","","203.2","","","","","","","","","7","P -1","-P 1","2","","","","- C12 H16 B I2 N6 S3 Tl -","- C12 H16 B I2 N6 S3 Tl -","- C24 H32 B2 I4 N12 S6 Tl2 -","2","1","","Slavin, Paul A.; Reglinski, John; Spicer, Mark D.; Kennedy, Alan R.","Preparation and crystal structure of the [bis{hydrotris(methimazolyl)borato}thallium(III)] cation: modulated chemistry resulting from the use of soft and hard tripodal ligands","Journal of the Chemical Society, Dalton Transactions","2000","","3","239","","10.1039/a908236k","","","0.7107","MoKalpha","","0.0718","","","0.141","0.1328","","","","1.044","1.088","1.088","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009036","23.8997","0.0005","11.2289","0.0001","25.5004","0.0005","90","","93.34","0.0009","90","","6831.9","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diiodotris(bisdiphenylstibinomethane)ruthenium(II)","","- C75 H66 I2 Ru Sb6 -","- C75 H66 I2 Ru Sb6 -","- C300 H264 I8 Ru4 Sb24 -","4","1","","Even, Tina; Genge, Anthony R. J.; Hill, Angela M.; Holmes, Nicholas J.; Levason, William; Webster, Michael","Synthesis, properties and structures of complexes of platinum metal halides and Group 11 metals with two distibinomethane ligands, R2SbCH2SbR2 (R = Me or Ph)","Journal of the Chemical Society, Dalton Transactions","2000","","5","655","","10.1039/a908296d","","","0.71073","MoKα","","0.1208","0.0474","","","0.0869","0.1209","","","","","","0.967","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009037","15.953","0.005","17","0.004","11.943","0.003","109.18","0.02","109.95","0.02","79.65","0.02","2867.2","1.4","150","","150","","","","","","","","","6","P -1","-P 1","2","","Tetrabromodi(μ-bisdiphenylstibinomethane)dipalladium(II).2dichloromethane","","- C52 H48 Br4 Cl4 Pd2 Sb4 -","- C51.072 Br4 Cl2.144 Pd2 Sb4 -","- C102.144 Br8 Cl4.288 Pd4 Sb8 -","2","1","","Even, Tina; Genge, Anthony R. J.; Hill, Angela M.; Holmes, Nicholas J.; Levason, William; Webster, Michael","Synthesis, properties and structures of complexes of platinum metal halides and Group 11 metals with two distibinomethane ligands, R2SbCH2SbR2 (R = Me or Ph)","Journal of the Chemical Society, Dalton Transactions","2000","","5","655","","10.1039/a908296d","","","0.71073","MoKα","","0.0651","0.0651","","0.0762","","0.0762","","","2.469","","","2.469","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009038","18.964","0.006","12.729","0.004","23.09","0.004","90","","107.5","0.02","90","","5316","3","150","","150","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Tetrachlorobis(μ-bisdiphenylstibinomethane)diplatinum(II).acetone","","- C53 H50 Cl4 O Pt2 Sb4 -","- C53 H50 Cl4 O Pt2 Sb4 -","- C212 H200 Cl16 O4 Pt8 Sb16 -","4","1","","Even, Tina; Genge, Anthony R. J.; Hill, Angela M.; Holmes, Nicholas J.; Levason, William; Webster, Michael","Synthesis, properties and structures of complexes of platinum metal halides and Group 11 metals with two distibinomethane ligands, R2SbCH2SbR2 (R = Me or Ph)","Journal of the Chemical Society, Dalton Transactions","2000","","5","655","","10.1039/a908296d","","","0.71073","MoKα","","0.0549","0.0549","","0.0615","","0.0615","","","2.325","","","2.325","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009039","26.004","0.002","14.641","0.0009","13.6091","0.0009","90","","117.987","0.002","90","","4575.4","0.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C20 H18.79 Cl Mn N2 O4.39 -","- C20 H18 Cl Mn N2 O4.395 -","- C160 H144 Cl8 Mn8 N16 O35.16 -","8","1","","Das, Debasis; Pyeng Cheng, Cheu","Synthesis and characterization of mono- and bi-metallic Mn(III) complexes containing salen type ligands","Journal of the Chemical Society, Dalton Transactions","2000","","7","1081","","10.1039/a908304i","","","0.71073","MoKα","","0.1201","0.0622","","","0.2032","0.2342","","","","","","1.012","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009040","8.784","0.002","20.684","0.006","14.325","0.003","90","","100.24","0.02","90","","2561.2","1.1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H6 Fe5 O14 -","- C20 H6 Fe5 O14 -","- C80 H24 Fe20 O56 -","4","1","","Brait, Sabrina; Gervasio, Giuliana; Marabello, Domenica; Sappa, Enrico","Metal fragment condensation and carbon‒carbon bond cleavage in reactions of [Fe3(CO)12] with internal propargyl alcohols. Structures of the “bow tie” acetylide complexes [Fe5(CO)14(C2R)2] (R =Me or Et)","Journal of the Chemical Society, Dalton Transactions","2000","","6","989","","10.1039/a908308a","","","0.71073","MoKα","","0.0921","0.0417","","0.0796","0.0656","","","","1.036","1.104","1.104","","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009041","9.009","0.005","9.949","0.005","15.673","0.008","88.53","0.04","84.83","0.04","76.67","0.04","1361.4","1.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H10 Fe5 O14 -","- C22 H10 Fe5 O14 -","- C44 H20 Fe10 O28 -","2","1","","Brait, Sabrina; Gervasio, Giuliana; Marabello, Domenica; Sappa, Enrico","Metal fragment condensation and carbon‒carbon bond cleavage in reactions of [Fe3(CO)12] with internal propargyl alcohols. Structures of the “bow tie” acetylide complexes [Fe5(CO)14(C2R)2] (R =Me or Et)","Journal of the Chemical Society, Dalton Transactions","2000","","6","989","","10.1039/a908308a","","","0.71073","MoKα","","0.1219","0.0532","","0.1168","0.0946","","","","1.043","1.12","1.12","","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009042","10.402","0.003","13.806","0.003","18.819","0.005","83.85","0.04","77.08","0.04","70.04","0.03","2474.5","1.3","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H32 F24 N4 Na4 O8 -","- C32 H32 F24 N4 Na4 O8 -","- C64 H64 F48 N8 Na8 O16 -","2","1","","Chi, Yun; Ranjan, Sudhir; Chung, Po-Wen; Liu, Chao-Shiuan; Peng, Shie-Ming; Lee, Gene-Hsiang","Synthesis and characterization of two novel tetranuclear sodium ketoiminate complexes; structural evidence for formation of dative Na · · · F and Na‒C (olefin) bonding interactions","Journal of the Chemical Society, Dalton Transactions","2000","","3","343","","10.1039/a908328f","","","0.71073","MoKα","","0.145","0.0716","","0.2469","0.2107","","","","1.032","1.377","1.377","","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009043","13.6765","0.0002","21.6103","0.0002","16.0552","0.0003","90","","113.605","0.001","90","","4348.13","0.12","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H24 F24 N4 Na4 O4 -","- C32 H24 F24 N4 Na4 O4 -","- C128 H96 F96 N16 Na16 O16 -","4","1","","Chi, Yun; Ranjan, Sudhir; Chung, Po-Wen; Liu, Chao-Shiuan; Peng, Shie-Ming; Lee, Gene-Hsiang","Synthesis and characterization of two novel tetranuclear sodium ketoiminate complexes; structural evidence for formation of dative Na · · · F and Na‒C (olefin) bonding interactions","Journal of the Chemical Society, Dalton Transactions","2000","","3","343","","10.1039/a908328f","","","0.71073","MoKα","","0.088","0.0564","","0.1374","0.1222","","","","1.035","1.12","1.12","","","","","has coordinates,has disorder","179794","2020-10-21","18:00:00",""
"7009044","7.511","0.002","11.616","0.004","19.228","0.006","90","","90","","90","","1677.6","0.9","203","2","203","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","2-{[1,2-ethanediyilbis(nitrilomethyllidyne)]-2'dichlorophenolate) benzenethiolate}nickel(II)","","- C17 H14 Cl2 N2 Ni O S -","- C17 H14 Cl2 N2 Ni O S -","- C68 H56 Cl8 N8 Ni4 O4 S4 -","4","1","","Gomes, Lígia; Pereira, Eulália; de Castro, Baltazar","Nickel(II) complexes with N2OS and N2S2 co-ordination spheres: reduction and spectroscopic study of the corresponding Ni(I) complexes","Journal of the Chemical Society, Dalton Transactions","2000","","8","1373","","10.1039/a908330h","","","0.71069","MoKa","","0.1109","0.0656","","0.2009","0.1562","","","","1.034","1.057","1.057","","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009045","15.53","0.005","13.77","0.007","12.697","0.005","115.93","0.03","101.53","0.03","105.48","0.03","2190.7","1.9","293","","293","","","","","","","","","5","P -1","-P 1","2","","","","- C18 H27 Cl3 Cr N3 -","- C18 H27 Cl3 Cr N3 -","- C72 H108 Cl12 Cr4 N12 -","4","2","","Baker, Murray V.; Brown, David H.; Skelton, Brian W.; White, Allan H.","Group 6 metal complexes of 1,3,5-tri(4-pentynyl)-1,3,5-triazacyclohexane","Journal of the Chemical Society, Dalton Transactions","2000","","5","763","","10.1039/a908349i","","","0.71073","Mo-Kα","","0.101","0.048","","0.067","","0.056","","","1.284","","","1.421","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009046","15.476","0.002","12.1587","0.001","7.0261","0.0008","90","","90","","90","","1322.1","0.3","293","","293","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C6 H15 Br3 Cr N3 -","- C6 H15 Br3 Cr N3 -","- C24 H60 Br12 Cr4 N12 -","4","0.5","","Baker, Murray V.; Brown, David H.; Skelton, Brian W.; White, Allan H.","Group 6 metal complexes of 1,3,5-tri(4-pentynyl)-1,3,5-triazacyclohexane","Journal of the Chemical Society, Dalton Transactions","2000","","5","763","","10.1039/a908349i","","","0.71073","MoKα","","0.04","0.031","","0.045","","0.044","","","1.489","","","1.585","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009047","10.12","0.002","14.269","0.002","16.788","0.003","90","","101.31","0.02","90","","2377.1","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H35 N5 O2 Sn -","- C18 H31 N5 O2 Sn -","- C72 H124 N20 O8 Sn4 -","4","1","","Bhandari, Sonali; Frost, Christopher G.; Hague, Catherine E.; Mahon, Mary F.; Molloy, Kieran C.","Synthesis of functionalised (triorganostannyl)tetrazoles: supramolecular structures of n-[2-(triorganostannyl)tetrazol-5-yl]pyridine (n = 2, 3 or 4)†","Journal of the Chemical Society, Dalton Transactions","2000","","5","663","","10.1039/a908380d","","","0.7093","","","0.1165","0.0491","","0.142","0.1079","","","","1.134","1.201","1.201","","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009048","8.263","0.001","8.263","0.001","38.991","0.006","90","","90","","120","","2305.5","0.5","293","2","293","2","","","","","","","","4","P 61","P 61","169","","","","- C12 H19 N5 Sn -","- C12 H19 N5 Sn -","- C72 H114 N30 Sn6 -","6","1","","Bhandari, Sonali; Frost, Christopher G.; Hague, Catherine E.; Mahon, Mary F.; Molloy, Kieran C.","Synthesis of functionalised (triorganostannyl)tetrazoles: supramolecular structures of n-[2-(triorganostannyl)tetrazol-5-yl]pyridine (n = 2, 3 or 4)†","Journal of the Chemical Society, Dalton Transactions","2000","","5","663","","10.1039/a908380d","","","0.7093","","","0.0284","0.0188","","0.0467","0.0426","","","","1.132","1.107","1.107","","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009049","13.781","0.002","14.764","0.002","16.227","0.003","90","","90","","90","","3301.6","0.9","293","2","293","2","","","","","","","","5","P b n a","-P 2ac 2b","60","","","","- C12 H21 N5 O Sn -","- C12 H21 N5 O Sn -","- C96 H168 N40 O8 Sn8 -","8","1","","Bhandari, Sonali; Frost, Christopher G.; Hague, Catherine E.; Mahon, Mary F.; Molloy, Kieran C.","Synthesis of functionalised (triorganostannyl)tetrazoles: supramolecular structures of n-[2-(triorganostannyl)tetrazol-5-yl]pyridine (n = 2, 3 or 4)†","Journal of the Chemical Society, Dalton Transactions","2000","","5","663","","10.1039/a908380d","","","0.7093","","","0.0797","0.045","","0.1351","0.1097","","","","1.135","1.116","1.116","","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009050","7.5661","0.0005","20.7403","0.0014","7.3572","0.0005","90","","90","0.001","90","","1154.52","0.13","223","2","223","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H13 N2 S -","- C12 H13 N2 S -","- C48 H52 N8 S4 -","4","1","","Kimblin, Clare; Bridgewater, Brian M.; Hascall, Tony; Parkin, Gerard","The synthesis and structural characterization of bis(mercaptoimidazolyl)hydroborato complexes of lithium, thallium and zinc †","Journal of the Chemical Society, Dalton Transactions","2000","","6","891","","10.1039/a908411h","","","0.71073","MoKα","","0.0456","0.0394","","","0.1119","0.1162","","","","","","1.04","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7009051","24.777","0.005","9.4508","0.0016","18.736","0.004","90","","90","","90","","4387.3","1.5","223","2","223","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C42 H46 B N5 O3 S2 Zn -","- C42 H46 B N5 O3 S2 Zn -","- C168 H184 B4 N20 O12 S8 Zn4 -","4","1","","Kimblin, Clare; Bridgewater, Brian M.; Hascall, Tony; Parkin, Gerard","The synthesis and structural characterization of bis(mercaptoimidazolyl)hydroborato complexes of lithium, thallium and zinc †","Journal of the Chemical Society, Dalton Transactions","2000","","6","891","","10.1039/a908411h","","","0.71073","MoKα","","0.2641","0.0788","","","0.0822","0.1085","","","","","","1.004","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009052","8.135","0.0012","16.526","0.003","20.404","0.003","106.379","0.003","101.143","0.003","97.605","0.002","2530.8","0.7","213","2","213","2","","","","","","","","6","P -1","-P 1","2","","","","- C48 H56 B2 Li2 N8 S4 -","- C48 H56 B2 Li2 N8 S4 -","- C96 H112 B4 Li4 N16 S8 -","2","1","","Kimblin, Clare; Bridgewater, Brian M.; Hascall, Tony; Parkin, Gerard","The synthesis and structural characterization of bis(mercaptoimidazolyl)hydroborato complexes of lithium, thallium and zinc †","Journal of the Chemical Society, Dalton Transactions","2000","","6","891","","10.1039/a908411h","","","0.71073","MoKα","","0.187","0.0718","","","0.1194","0.1464","","","","","","1.038","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009053","9.3268","0.0013","14.3927","0.0019","18.52","0.003","90","","93.811","0.002","90","","2480.6","0.6","228","2","228","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H24 B2 N8 S4 Zn -","- C16 H24 B2 N8 S4 Zn -","- C64 H96 B8 N32 S16 Zn4 -","4","1","","Kimblin, Clare; Bridgewater, Brian M.; Hascall, Tony; Parkin, Gerard","The synthesis and structural characterization of bis(mercaptoimidazolyl)hydroborato complexes of lithium, thallium and zinc †","Journal of the Chemical Society, Dalton Transactions","2000","","6","891","","10.1039/a908411h","","","0.71073","MoKα","","0.0906","0.0416","","","0.0919","0.1052","","","","","","1","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009054","8.5696","0.0004","14.1642","0.0007","11.3006","0.0005","90","","111.966","0.001","90","","1272.11","0.1","203","2","203","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H24 B2 N8 S4 Tl2 -","- C16 H24 B2 N8 S4 Tl2 -","- C32 H48 B4 N16 S8 Tl4 -","2","0.5","","Kimblin, Clare; Bridgewater, Brian M.; Hascall, Tony; Parkin, Gerard","The synthesis and structural characterization of bis(mercaptoimidazolyl)hydroborato complexes of lithium, thallium and zinc †","Journal of the Chemical Society, Dalton Transactions","2000","","6","891","","10.1039/a908411h","","","0.71073","MoKα","","0.0359","0.0292","","0.0644","0.0616","","","","1.128","1.146","1.146","","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009055","11.362","0.002","9.937","0.002","13.483","0.003","90","","110.31","0.02","90","","1427.6","0.5","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C8 H12 B I N4 S2 Zn -","- C8 H12 B I N4 S2 Zn -","- C32 H48 B4 I4 N16 S8 Zn4 -","4","1","","Kimblin, Clare; Bridgewater, Brian M.; Hascall, Tony; Parkin, Gerard","The synthesis and structural characterization of bis(mercaptoimidazolyl)hydroborato complexes of lithium, thallium and zinc †","Journal of the Chemical Society, Dalton Transactions","2000","","6","891","","10.1039/a908411h","","","0.71073","MoKα","","0.0528","0.0353","","0.0879","0.0799","","","","1.042","1.089","1.089","","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009056","7.652","0.001","13.822","0.003","13.469","0.002","90","","102.588","0.007","90","","1390.3","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C9 H15 B N4 S2 Zn -","- C9 H15 B N4 S2 Zn -","- C36 H60 B4 N16 S8 Zn4 -","4","1","","Kimblin, Clare; Bridgewater, Brian M.; Hascall, Tony; Parkin, Gerard","The synthesis and structural characterization of bis(mercaptoimidazolyl)hydroborato complexes of lithium, thallium and zinc †","Journal of the Chemical Society, Dalton Transactions","2000","","6","891","","10.1039/a908411h","","","0.71073","MoKα","","0.1344","0.0579","","0.1481","0.1164","","","","1.014","1.111","1.111","","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009057","10.3676","0.0013","12.905","0.0016","11.6964","0.0015","90","","90","","90","","1564.9","0.3","158","","158","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- C18 H23 Dy -","- C18 H23 Dy -","- C72 H92 Dy4 -","4","0.5","","Evans, William J.; Johnston, Matthew A.; Clark, Robert D.; Ziller, Joseph W.","Variability of (ring centroid)‒Ln‒(ring centroid) angles in the mixed ligand C5Me5/C8H8 complexes (C5Me5)Ln(C8H8) and [(C5Me5)Yb(THF)](μ-η8∶η8-C8H8)[Yb(C5Me5)]","Journal of the Chemical Society, Dalton Transactions","2000","","10","1609","","10.1039/a908412f","","","0.71073","MoKα","","0.0362","0.0277","","","0.0769","0.0967","","","","","","1.112","","","","has coordinates,has disorder","179794","2020-10-21","18:00:00",""
"7009058","16.7103","0.0008","14.8166","0.0007","25.1683","0.0012","90","","90","","90","","6231.4","0.5","158","","158","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C32 H46 O Yb2 -","- C32 H46 O Yb2 -","- C256 H368 O8 Yb16 -","8","1","","Evans, William J.; Johnston, Matthew A.; Clark, Robert D.; Ziller, Joseph W.","Variability of (ring centroid)‒Ln‒(ring centroid) angles in the mixed ligand C5Me5/C8H8 complexes (C5Me5)Ln(C8H8) and [(C5Me5)Yb(THF)](μ-η8∶η8-C8H8)[Yb(C5Me5)]","Journal of the Chemical Society, Dalton Transactions","2000","","10","1609","","10.1039/a908412f","","","0.71073","MoKα","","0.067","0.0404","","0.1085","0.0998","","","","1.063","1.155","1.155","","","","","has coordinates,has disorder","179794","2020-10-21","18:00:00",""
"7009059","10.3018","0.0005","13.0166","0.0006","11.6035","0.0006","90","","90","","90","","1555.96","0.13","158","","158","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- C18 H23 Yb -","- C18 Yb -","- C72 Yb4 -","4","0.5","","Evans, William J.; Johnston, Matthew A.; Clark, Robert D.; Ziller, Joseph W.","Variability of (ring centroid)‒Ln‒(ring centroid) angles in the mixed ligand C5Me5/C8H8 complexes (C5Me5)Ln(C8H8) and [(C5Me5)Yb(THF)](μ-η8∶η8-C8H8)[Yb(C5Me5)]","Journal of the Chemical Society, Dalton Transactions","2000","","10","1609","","10.1039/a908412f","","","0.71073","MoKα","","0.0237","0.022","","0.0623","0.0616","","","","1.112","1.134","1.134","","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009060","10.441","0.0006","12.8707","0.0008","11.7331","0.0007","90","","90","","90","","1576.73","0.16","158","","158","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- C18 H23 Sm -","- C18 H23 Sm -","- C72 H92 Sm4 -","4","0.5","","Evans, William J.; Johnston, Matthew A.; Clark, Robert D.; Ziller, Joseph W.","Variability of (ring centroid)‒Ln‒(ring centroid) angles in the mixed ligand C5Me5/C8H8 complexes (C5Me5)Ln(C8H8) and [(C5Me5)Yb(THF)](μ-η8∶η8-C8H8)[Yb(C5Me5)]","Journal of the Chemical Society, Dalton Transactions","2000","","10","1609","","10.1039/a908412f","","","0.71073","MoKα","","0.044","0.0266","","0.0524","0.0485","","","","1.115","1.213","1.213","","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009061","8.036","0.002","9.853","0.001","12.361","0.002","80.611","0.009","89.472","0.01","68.47","0.007","896.9","0.3","150","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C36 H69 In P2 -","- C36 H66 In P2 -","- C36 H66 In P2 -","1","0.5","","Cole, Marcus L.; Hibbs, David E.; Jones, Cameron; Smithies, Neil A.","Phosphine and phosphido indium hydride complexes and their use in inorganic synthesis","Journal of the Chemical Society, Dalton Transactions","2000","","4","545","","10.1039/a908418e","","","0.71073","MoKα","","0.0373","0.0275","","","0.0731","0.0754","","","","","","1.055","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009062","10.3689","0.001","12.0296","0.0019","15.862","0.002","85.164","0.009","82.62","0.02","72.022","0.01","1864.2","0.4","150","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H48 In P Te3 -","- C36 H48 In P Te3 -","- C72 H96 In2 P2 Te6 -","2","1","","Cole, Marcus L.; Hibbs, David E.; Jones, Cameron; Smithies, Neil A.","Phosphine and phosphido indium hydride complexes and their use in inorganic synthesis","Journal of the Chemical Society, Dalton Transactions","2000","","4","545","","10.1039/a908418e","","","0.71073","MoKα","","0.1498","0.0653","","","0.1487","0.17","","","","","","1.28","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009063","10.2825","0.0009","30.403","0.002","13.5672","0.001","90","","94.14","0.02","90","","4230.3","0.6","150","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C36 H72 In3 P3 -","- C36 H72 In3 P3 -","- C144 H288 In12 P12 -","4","1","","Cole, Marcus L.; Hibbs, David E.; Jones, Cameron; Smithies, Neil A.","Phosphine and phosphido indium hydride complexes and their use in inorganic synthesis","Journal of the Chemical Society, Dalton Transactions","2000","","4","545","","10.1039/a908418e","","","0.71073","MoKα","","0.044","0.0281","","","0.0665","0.0698","","","","","","1.033","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009064","11.665","0.001","33.359","0.002","19.122","0.002","90","","107.258","0.01","90","","7106","1.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H48 In P S3 -","- C36 H48 In P S3 -","- C288 H384 In8 P8 S24 -","8","2","","Cole, Marcus L.; Hibbs, David E.; Jones, Cameron; Smithies, Neil A.","Phosphine and phosphido indium hydride complexes and their use in inorganic synthesis","Journal of the Chemical Society, Dalton Transactions","2000","","4","545","","10.1039/a908418e","","","0.71073","MoKα","","0.0816","0.0352","","","0.0822","0.0954","","","","","","1","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009065","10.4085","0.0007","11.6417","0.0009","15.5724","0.0011","85.84","0.03","82.96","0.03","70.98","0.03","1769.4","0.4","150","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H48 In P Se3 -","- C36 H48 In P Se3 -","- C72 H96 In2 P2 Se6 -","2","1","","Cole, Marcus L.; Hibbs, David E.; Jones, Cameron; Smithies, Neil A.","Phosphine and phosphido indium hydride complexes and their use in inorganic synthesis","Journal of the Chemical Society, Dalton Transactions","2000","","4","545","","10.1039/a908418e","","","0.71073","MoKα","","0.0623","0.03","","","0.0676","0.0755","","","","","","1.002","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009066","11.9409","0.001","30.824","0.003","10.4671","0.0004","90","","94.297","0.005","90","","3841.8","0.5","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C45 H42 Cl3 N3 O3 -","- C45 H42 Cl3 N3 O3 -","- C180 H168 Cl12 N12 O12 -","4","1","","Thuéry, Pierre; Nierlich, Martine; Vicens, Jacques; Takemura, Hiroyuki","Crystal structure of p-chloro-N-benzylhexahomotriazacalix[3]arene and of the complex of its zwitterionic form with neodymium(III) nitrate","Journal of the Chemical Society, Dalton Transactions","2000","","3","279","","10.1039/a908423a","","","0.71073","MoKα","","0.1069","0.067","","","0.1444","0.1672","","","","","","0.99","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7009067","12.8151","0.0006","14.1674","0.0009","27.8909","0.0018","90","","98.938","0.003","90","","5002.3","0.5","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C50 H47 Cl3 N7 Nd O12 -","- C50 H45 Cl3 N7 Nd O12 -","- C200 H180 Cl12 N28 Nd4 O48 -","4","1","","Thuéry, Pierre; Nierlich, Martine; Vicens, Jacques; Takemura, Hiroyuki","Crystal structure of p-chloro-N-benzylhexahomotriazacalix[3]arene and of the complex of its zwitterionic form with neodymium(III) nitrate","Journal of the Chemical Society, Dalton Transactions","2000","","3","279","","10.1039/a908423a","","","0.71073","MoKα","","0.0852","0.0593","","","0.1234","0.1338","","","","","","1.048","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009068","8.726","0.001","15.024","0.003","17.649","0.003","90","","100.18","0.03","90","","2277.3","0.7","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C44 H50 Cu2 N14 Ni2 O10 -","- C44 H50 Cu2 N14 Ni2 O10 -","- C88 H100 Cu4 N28 Ni4 O20 -","2","0.5","","Verani, Cláudio Nazari; Rentschler, Eva; Weyhermüller, Thomas; Bill, Eckhard; Chaudhuri, Phalguni","Exchange coupling in a bis(heterodinuclear) [CuIINiII]2 and a linear heterotrinuclear complex CoIIICuIINiII. Synthesis, structures and properties","Journal of the Chemical Society, Dalton Transactions","2000","","3","251","","10.1039/a908426f","","","0.71073","MoKα","","0.0357","0.0275","","0.0698","0.0657","","","","1.034","1.057","1.057","","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009069","7.443","0.001","14.281","0.002","21.582","0.003","104.04","0.02","96.9","0.02","104.31","0.02","2116.5","0.6","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C30.75 H52.5 Cl2 Co Cu N7 Ni O17.5 -","- C30.75 H41 Cl2 Co Cu N7 Ni O17.5 -","- C61.5 H82 Cl4 Co2 Cu2 N14 Ni2 O35 -","2","1","","Verani, Cláudio Nazari; Rentschler, Eva; Weyhermüller, Thomas; Bill, Eckhard; Chaudhuri, Phalguni","Exchange coupling in a bis(heterodinuclear) [CuIINiII]2 and a linear heterotrinuclear complex CoIIICuIINiII. Synthesis, structures and properties","Journal of the Chemical Society, Dalton Transactions","2000","","3","251","","10.1039/a908426f","","","0.71073","MoKα","","0.0835","0.0623","","0.1635","0.1495","","","","1.076","1.125","1.125","","","","","has coordinates,has disorder","179794","2020-10-21","18:00:00",""
"7009070","15.716","0.002","22.22","0.004","13.616","0.002","90","","95.69","0.01","90","","4731.4","1.3","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","[Cu(PPh3)3O2CH].HCO2H","","- C56 H48 Cu O4 P3 -","- C56 H48 Cu O4 P3 -","- C224 H192 Cu4 O16 P12 -","4","1","","Bowmaker, Graham A.; Hanna, John V.; Healy, Peter C.; Reid, Jason C.; Rickard, Clifton E. F.; White, Allan H.","Crystal structures and vibrational and solid-state (CPMAS) NMR spectroscopic studies in the tris(triphenylphosphine)-copper(I) and -silver(I) formate systems","Journal of the Chemical Society, Dalton Transactions","2000","","5","753","","10.1039/a908427d","","","0.71073","MoKα","","0.0884","0.0635","","","0.1392","0.1554","","","","","","1.104","","","","has coordinates,has disorder","179794","2020-10-21","18:00:00",""
"7009071","15.675","0.001","22.4545","0.001","13.935","","90","0.001","93.57","","90","","4895.2","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","[Cu(PPh3)3O2CH].0.5EtOH","","- C56 H49 Cu O2.5 P3 -","- C56 H49 Cu O2.5 P3 -","- C224 H196 Cu4 O10 P12 -","4","1","","Bowmaker, Graham A.; Hanna, John V.; Healy, Peter C.; Reid, Jason C.; Rickard, Clifton E. F.; White, Allan H.","Crystal structures and vibrational and solid-state (CPMAS) NMR spectroscopic studies in the tris(triphenylphosphine)-copper(I) and -silver(I) formate systems","Journal of the Chemical Society, Dalton Transactions","2000","","5","753","","10.1039/a908427d","","","0.70173","","","0.0967","0.075","","","0.2159","0.2394","","","","","","1.085","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7009072","15.96","0.01","22.24","0.02","13.881","0.006","90","","94.93","0.04","90","","4909","6","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C56 H48 Ag O4 P3 -","- C56 H48 Ag O4 P3 -","- C224 H192 Ag4 O16 P12 -","4","1","","Bowmaker, Graham A.; Hanna, John V.; Healy, Peter C.; Reid, Jason C.; Rickard, Clifton E. F.; White, Allan H.","Crystal structures and vibrational and solid-state (CPMAS) NMR spectroscopic studies in the tris(triphenylphosphine)-copper(I) and -silver(I) formate systems","Journal of the Chemical Society, Dalton Transactions","2000","","5","753","","10.1039/a908427d","","","0.71073","MoKα","","0.129","0.058","","0.072","","0.058","","","1.392","","","1.838","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009073","15.894","0.002","22.028","0.003","13.715","0.002","90","","94.906","0.002","90","","4784.2","1.1","153","","153","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C56 H48 Ag O4 P3 -","- C56 H48 Ag O4 P3 -","- C224 H192 Ag4 O16 P12 -","4","1","","Bowmaker, Graham A.; Hanna, John V.; Healy, Peter C.; Reid, Jason C.; Rickard, Clifton E. F.; White, Allan H.","Crystal structures and vibrational and solid-state (CPMAS) NMR spectroscopic studies in the tris(triphenylphosphine)-copper(I) and -silver(I) formate systems","Journal of the Chemical Society, Dalton Transactions","2000","","5","753","","10.1039/a908427d","","","0.71073","MoKα","","0.059","0.039","","0.051","","0.049","","","1.5","","","1.641","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009074","17.294","0.003","6.122","0.001","17.833","0.004","90","","108.36","0.03","90","","1791.9","0.7","203","2","203","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H23 Cl3 O Ti -","- C15 H23 Cl3 O Ti -","- C60 H92 Cl12 O4 Ti4 -","4","1","","Nielson, Alastair J.; Schwerdtfeger, Peter; Waters, Joyce M.","Trichloro monophenoxide complexes of titanium(IV)","Journal of the Chemical Society, Dalton Transactions","2000","","4","529","","10.1039/a908435e","","","0.71073","MoKα","","0.0466","0.0358","","0.1024","0.0875","","","","1.155","1.077","1.077","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7009075","10.743","0.0006","11.0134","0.0005","14.134","0.0006","75.342","0.004","81.431","0.004","79.665","0.004","1582.16","0.14","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C27 H43 Cl2 N8 O0.5 Pd -","- C27 H42.5 Cl2 N8 O0.5 Pd -","- C54 H85 Cl4 N16 O Pd2 -","2","1","","Szłyk, Edward; Grodzicki, Antoni; Pazderski, Leszek; Wojtczak, Andrzej; Chatłas, Janusz; Wrzeszcz, Grzegorz; Sitkowski, Jerzy; Kamieński, Bohdan","Palladium(II) chloride complexes with 1,2,4-triazolo[1,5-a]pyrimidines: X-ray, 15N‒1H NMR and 15N CP MAS studies","Journal of the Chemical Society, Dalton Transactions","2000","","6","867","","10.1039/a908469j","","","1.54178","CuKα","","0.0583","0.0403","","","0.098","0.1082","","","","","","1.058","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009076","11.592","0.006","12.226","0.006","14.737","0.005","102.78","0.04","101.86","0.04","109.95","0.05","1822.4","1.8","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H42 Cu2 Fe N13 O6.5 -","- C30 H29 Cu2 Fe N13 O6.5 -","- C60 H58 Cu4 Fe2 N26 O13 -","2","1","","Colacio, Enrique; Domínguez-Vera, José Manuel; Ghazi, Mustapha; Kivekäs, Raikko; María Moreno, José; Pajunen, Aarne","Structure and magnetic properties of two cyanide-bridged one-dimensional M‒CuII (M = FeIII or FeII) bimetallic assemblies from ferricyanide and CuN42+ (N4 = 1,4,8,11-tetraazacyclotetradecane and N,N '-bis(2-pyridylmethylene)-1,3-propanediamine) building blocks","Journal of the Chemical Society, Dalton Transactions","2000","","4","505","","10.1039/a908485a","","","0.71073","MoKα","","0.1129","0.0671","","","0.1296","0.1434","","","","","","1.026","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009077","14.405","0.003","12.284","0.003","9.836","0.002","90","","131.59","0.03","90","","1301.7","0.8","293","2","293","2","","","","","","","","7","C 1 2/m 1","-C 2y","12","","","","- C16 H32 Cu Fe K N10 O4 -","- C16 H24 Cu Fe K N10 O4 -","- C32 H48 Cu2 Fe2 K2 N20 O8 -","2","0.25","","Colacio, Enrique; Domínguez-Vera, José Manuel; Ghazi, Mustapha; Kivekäs, Raikko; María Moreno, José; Pajunen, Aarne","Structure and magnetic properties of two cyanide-bridged one-dimensional M‒CuII (M = FeIII or FeII) bimetallic assemblies from ferricyanide and CuN42+ (N4 = 1,4,8,11-tetraazacyclotetradecane and N,N '-bis(2-pyridylmethylene)-1,3-propanediamine) building blocks","Journal of the Chemical Society, Dalton Transactions","2000","","4","505","","10.1039/a908485a","","","0.71073","MoKα","","0.1071","0.0819","","","0.2355","0.2595","","","","","","1.135","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009078","14.646","0.001","15.501","0.001","15.429","0.001","90","","99.583","0.002","90","","3453.9","0.4","293","2","150","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C38 H32 O2 P2 Pb S2 -","- C38 H31 O2 P2 Pb S2 -","- C152 H124 O8 P8 Pb4 S8 -","4","1","","Pérez-Lourido, Paulo; Romero, Jaime; García-Vázquez, José A.; Sousa, Antonio; Zheng, Yifan; Dilworth, Jonathan R.; Zubieta, Jon","Lead(II) complexes with phosphorylthiolato and thiophosphorylthiolato ligands","Journal of the Chemical Society, Dalton Transactions","2000","","5","769","","10.1039/a908496g","","","0.71073","MoKα","","0.0371","0.0341","","","0.0884","0.09","","","","","","1.058","","","","has coordinates","205752","2020-10-21","18:00:00",""
"7009079","15.556","0.001","15.612","0.001","15.052","0.001","90","","100.455","0.002","90","","3594.8","0.4","150","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C38 H32 P2 Pb S4 -","- C38 H32 P2 Pb S4 -","- C152 H128 P8 Pb4 S16 -","4","1","","Pérez-Lourido, Paulo; Romero, Jaime; García-Vázquez, José A.; Sousa, Antonio; Zheng, Yifan; Dilworth, Jonathan R.; Zubieta, Jon","Lead(II) complexes with phosphorylthiolato and thiophosphorylthiolato ligands","Journal of the Chemical Society, Dalton Transactions","2000","","5","769","","10.1039/a908496g","","","0.71073","MoKα","","0.0497","0.0475","","","0.1164","0.1183","","","","","","1.121","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009080","16.212","0.003","14.4198","0.001","25.146","0.003","90","","92.014","0.014","90","","5874.8","1.4","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C64 H54 P4 Pb S6 -","- C64 H54 P4 Pb S6 -","- C256 H216 P16 Pb4 S24 -","4","1","","Pérez-Lourido, Paulo; Romero, Jaime; García-Vázquez, José A.; Sousa, Antonio; Zheng, Yifan; Dilworth, Jonathan R.; Zubieta, Jon","Lead(II) complexes with phosphorylthiolato and thiophosphorylthiolato ligands","Journal of the Chemical Society, Dalton Transactions","2000","","5","769","","10.1039/a908496g","","","0.71073","MoKα","","0.0927","0.0362","","0.1003","0.0849","","","","1.035","1.126","1.126","","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009081","13.529","0.003","30.221","0.005","13.998","0.004","90","0","103.76","0.02","90","0","5559","2","120","","173","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C58 H86 Cl Cr O7 -","- C66 H107 Cl Cr O8 -","- C264 H428 Cl4 Cr4 O32 -","4","1","","Hesschenbrouck, Joëlle; Solari, Euro; Floriani, Carlo; Re, Nazzareno; Rizzoli, Corrado; Chiesi-Villa, Angiola","Chromium-(II) and -(III) over a planar oxo surface modelled by calix[4]arene anions: redox chemistry and formation of Cr‒C functionalities","Journal of the Chemical Society, Dalton Transactions","2000","","2","191","","10.1039/a908499a","","","0.71069","MoKα","","0.2185","0.07","","0.4244","0.1814","","","","2.051","1.067","1.067","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009082","15.408","0.003","23.553","0.005","16.322","0.003","90","0","109.26","0.02","90","0","5592","2","150","","185","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C61 H73 Cl Cr N3 O4 -","- C61 H73 Cl Cr N3 O4 -","- C244 H292 Cl4 Cr4 N12 O16 -","4","1","","Hesschenbrouck, Joëlle; Solari, Euro; Floriani, Carlo; Re, Nazzareno; Rizzoli, Corrado; Chiesi-Villa, Angiola","Chromium-(II) and -(III) over a planar oxo surface modelled by calix[4]arene anions: redox chemistry and formation of Cr‒C functionalities","Journal of the Chemical Society, Dalton Transactions","2000","","2","191","","10.1039/a908499a","","","0.71069","MoKα","","0.1532","0.0645","","0.3196","0.1625","","","","1.719","1.04","1.04","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009083","13.542","0.002","15.295","0.002","15.682","0.002","81.43","0.02","81.68","0.02","69.06","0.02","2985","0.8","85","","143","","","","","","","","","4","P -1","-P 1","2","","","","- C69 H85 Cr O4 -","- C89 H119 Cr O4 -","- C178 H238 Cr2 O8 -","2","1","","Hesschenbrouck, Joëlle; Solari, Euro; Floriani, Carlo; Re, Nazzareno; Rizzoli, Corrado; Chiesi-Villa, Angiola","Chromium-(II) and -(III) over a planar oxo surface modelled by calix[4]arene anions: redox chemistry and formation of Cr‒C functionalities","Journal of the Chemical Society, Dalton Transactions","2000","","2","191","","10.1039/a908499a","","","0.71069","MoKα","","0.0876","0.0673","","0.1994","0.166","","","","1.051","0.974","0.974","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009084","12.526","0.002","19.174","0.002","21.933","0.002","90","0","90","0","90","0","5267.7","1.1","85","","143","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C58 H82 Cr O7 -","- C58 H82 Cr O7 -","- C232 H328 Cr4 O28 -","4","1","","Hesschenbrouck, Joëlle; Solari, Euro; Floriani, Carlo; Re, Nazzareno; Rizzoli, Corrado; Chiesi-Villa, Angiola","Chromium-(II) and -(III) over a planar oxo surface modelled by calix[4]arene anions: redox chemistry and formation of Cr‒C functionalities","Journal of the Chemical Society, Dalton Transactions","2000","","2","191","","10.1039/a908499a","","","0.71069","MoKα","","0.0882","0.0611","","0.1759","0.1419","","","","1.157","1.047","1.047","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009085","14.605","0.003","18.269","0.004","17.875","0.004","90","0","93.85","0.03","90","0","4758.6","1.8","63","","143","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C52 H72 Cr O5 -","- C63 H100 Cr O5 -","- C252 H400 Cr4 O20 -","4","1","","Hesschenbrouck, Joëlle; Solari, Euro; Floriani, Carlo; Re, Nazzareno; Rizzoli, Corrado; Chiesi-Villa, Angiola","Chromium-(II) and -(III) over a planar oxo surface modelled by calix[4]arene anions: redox chemistry and formation of Cr‒C functionalities","Journal of the Chemical Society, Dalton Transactions","2000","","2","191","","10.1039/a908499a","","","0.71069","MoKα","","0.1259","0.0657","","0.2145","0.1653","","","","1.057","1.106","1.106","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009086","10.692","0.004","10.746","0.004","15.212","0.004","90","","98.56","0.02","90","","1728.3","1","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C36 H41 Fe2 N O9 -","- C36 H41 Fe2 N O9 -","- C72 H82 Fe4 N2 O18 -","2","1","","Kerr, Joy L.; Landells, John S.; Larsen, David S.; Robinson, Brian H.; Simpson, Jim","Synthesis and structure of N-ferrocenylglycosylamines; redox chemistry of O-ferrocenylglycosides † and N-ferrocenylglycosylamines","Journal of the Chemical Society, Dalton Transactions","2000","","9","1411","","10.1039/a908513k","","","0.71073","MoKα","","0.0682","0.0433","","","0.094","0.106","","","","","","0.985","","","","has coordinates,has disorder","179794","2020-10-21","18:00:00",""
"7009087","14.592","0.003","18.645","0.004","37.561","0.008","90","","90","","90","","10219","4","293","2","293","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C28 H64 Cu4 N6 S8 Se4 W -","- C28 H64 Cu4 N6 S8 Se4 W -","- C224 H512 Cu32 N48 S64 Se32 W8 -","8","1","","Zhang, Qian-Feng; Bao, Mo-Tai; Hong, Mao-Chun; Cao, Rong; Song, Ying-Lin; Xin, Xin-Quan","Syntheses, crystal structures and non-linear optical responses of two new heteroselenometallic cluster compounds containing dithiocarbamate ligands","Journal of the Chemical Society, Dalton Transactions","2000","","4","605","","10.1039/a908524f","","","0.71073","MoKα","","0.1059","0.0815","","0.1542","0.1446","","","","1.23","1.291","1.291","","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009088","12.974","0.002","13.358","0.002","29.736","0.003","90","","90","","90","","5153.4","1.2","293","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C31 H70 Cu3 N5 S6 Se4 W -","- C30.7 H65.1 Cu3 N5 S6 Se4 W -","- C122.8 H260.4 Cu12 N20 S24 Se16 W4 -","4","1","","Zhang, Qian-Feng; Bao, Mo-Tai; Hong, Mao-Chun; Cao, Rong; Song, Ying-Lin; Xin, Xin-Quan","Syntheses, crystal structures and non-linear optical responses of two new heteroselenometallic cluster compounds containing dithiocarbamate ligands","Journal of the Chemical Society, Dalton Transactions","2000","","4","605","","10.1039/a908524f","","","0.71073","MoKα","","0.0795","0.0617","","0.1448","0.1308","","","","1.067","1.069","1.069","","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009089","7.623","0.009","15.203","0.015","23.029","0.02","90","","95.08","0.07","90","","2658","5","150","2","150","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C17 H20 Zr -","- C17 H20 Zr -","- C136 H160 Zr8 -","8","2","","Green, Jennifer C.; Green, Malcolm L. H.; Taylor, Grant C.; Saunders, John","Studies on ansa-zirconocene‒butadiene derivatives","Journal of the Chemical Society, Dalton Transactions","2000","","3","317","","10.1039/a908532g","","","0.71073","MoKα","","0.0917","0.0363","","0.0967","0.0638","","","","0.686","0.837","0.837","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009090","6.688","0.002","7.534","0.001","16.993","0.003","93.686","0.006","95.98","0.007","111.58","0.002","787","0.3","0","","0","","","","","","","","","3","P -1","-P 1","2","","","","- C19 H24 Zr -","- C19 H24 Zr -","- C38 H48 Zr2 -","2","1","","Green, Jennifer C.; Green, Malcolm L. H.; Taylor, Grant C.; Saunders, John","Studies on ansa-zirconocene‒butadiene derivatives","Journal of the Chemical Society, Dalton Transactions","2000","","3","317","","10.1039/a908532g","","","0.71073","MoKα","","","0.0346","","","0.0342","","","","","1.0237","1.0237","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7009091","16.106","0.003","8.853","0.002","21.598","0.004","90","","104.83","0.03","90","","2977","1.1","150","2","150","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H38 Cl2 O2 Zr2 -","- C30 H38 Cl2 O2 Zr2 -","- C120 H152 Cl8 O8 Zr8 -","4","1","","Green, Jennifer C.; Green, Malcolm L. H.; Taylor, Grant C.; Saunders, John","Studies on ansa-zirconocene‒butadiene derivatives","Journal of the Chemical Society, Dalton Transactions","2000","","3","317","","10.1039/a908532g","","","0.71073","MoKα","","0.0717","0.0426","","0.1342","0.0985","","","","0.876","1.075","1.075","","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009092","35.771","0.002","10.379","0.002","24.403","0.002","90","","116.94","0.05","90","","8077","4","150","2","150","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C42 H45 B F15 O P Zr -","- C42 H29 B F15 O P Zr -","- C336 H232 B8 F120 O8 P8 Zr8 -","8","1","","Green, Jennifer C.; Green, Malcolm L. H.; Taylor, Grant C.; Saunders, John","Studies on ansa-zirconocene‒butadiene derivatives","Journal of the Chemical Society, Dalton Transactions","2000","","3","317","","10.1039/a908532g","","","0.71073","MoKα","","0.0992","0.0556","","0.1381","0.1274","","","","0.9","1.129","1.129","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009093","11.724","0.002","17.331","0.006","22.963","0.009","90","","91.884","0.002","90","","4663","3","0","","0","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C48 H41 B F15 N O2 Zr -","- C48 H41 B F15 N O2 Zr -","- C192 H164 B4 F60 N4 O8 Zr4 -","4","1","","Green, Jennifer C.; Green, Malcolm L. H.; Taylor, Grant C.; Saunders, John","Studies on ansa-zirconocene‒butadiene derivatives","Journal of the Chemical Society, Dalton Transactions","2000","","3","317","","10.1039/a908532g","","","0.71073","MoKα","","","0.0612","","","0.0719","","","","","1.6037","1.6037","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7009094","13.125","0.002","13.125","0.002","19.049","0.003","90","","90","","90","","3281.5","0.9","293","1","293","1","","","","","","","","6","I 4/m","-I 4","87","","Chloro(N1,N1,N4,N7,N7-pentamethyldiethylenetriamine)platinum(II) perchlorate","","- C9 H23 Cl2 N3 O4 Pt -","- C9 H24 Cl2 N3 O4 Pt -","- C72 H192 Cl16 N24 O32 Pt8 -","8","0.5","","Michelle L. Styles; Richard A. J. O'Hair; W. David McFadyen; Lily Tannous; Rodney J. Holmes; Robert W. Gable","Formation and gas phase fragmentation reactions of ligand substitution products of platinum(II) complexes via electrospray ionization tandem mass spectrometry","J. Chem. Soc., Dalton Trans.","2000","","1","93","100","10.1039/a908536j","","","0.71073","MoKα","","0.0405","0.0339","","","0.0896","0.0927","","","","","","1.047","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009095","18.422","0.003","18.422","0.003","10.405","0.002","90","","90","","120","","3058.1","0.9","293","2","293","2","","","","","","","","3","P 3 1 c","P 3 -2c","159","Barium molybdenum nitride","tribarium molybdenum(VI) tetranitride","","- Ba3 Mo N4 -","- Ba3 Mo N4 -","- Ba54 Mo18 N72 -","18","3","","Francesconi, M. Grazia; Barker, Marten G.; Cooke, Paul A.; Blake, Alexander J.","Preparation and structural characterisation of the trigonal nitridometalate Ba3MoN4","Journal of the Chemical Society, Dalton Transactions","2000","","11","1709","","10.1039/a908546g","","","0.71073","MoKα","","0.0538","0.0493","","","0.1271","0.1293","","","","","","1.074","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009096","9.218","0.005","11.182","0.006","15.967","0.008","108.44","0.02","90.46","0.02","108.01","0.02","1474.6","1.4","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","","","- C10.5 H25.5 As0.5 Li0.5 N1.5 P1.5 -","- C10.5 H25.5 As0.5 Li0.5 N1.5 P1.5 -","- C42 H102 As2 Li2 N6 P6 -","4","2","","Bashall, Alan; Beswick, Michael A.; Choi, Nick; Hopkins, Alexander D.; Kidd, Sara J.; Lawson, Yvonne G.; Mosquera, Marta E. G.; McPartlin, Mary; Raithby, Paul R.; Wheatley, Andrew A. E. H.; Wood, Jody A.; Wright, Dominic S.","A synthetic and structural study of the formation of cyclic [(RP)nE]− anions and Zintl compounds using E(NMe2)3 (E = As, Sb)","Journal of the Chemical Society, Dalton Transactions","2000","","4","479","","10.1039/a908552a","","","0.71073","MoKα","","0.0629","0.0445","","","0.0986","0.1104","","","","","","1.095","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009097","11.651","0.002","12.638","0.003","13.991","0.003","71.11","0.03","73.79","0.03","64.61","0.03","1737","0.8","180","2","180","2","","","","","","","","7","P -1","-P 1","2","","","","- C28 H59 As Li N4 O P3 -","- C28 H59 As Li N4 O P3 -","- C56 H118 As2 Li2 N8 O2 P6 -","2","1","","Bashall, Alan; Beswick, Michael A.; Choi, Nick; Hopkins, Alexander D.; Kidd, Sara J.; Lawson, Yvonne G.; Mosquera, Marta E. G.; McPartlin, Mary; Raithby, Paul R.; Wheatley, Andrew A. E. H.; Wood, Jody A.; Wright, Dominic S.","A synthetic and structural study of the formation of cyclic [(RP)nE]− anions and Zintl compounds using E(NMe2)3 (E = As, Sb)","Journal of the Chemical Society, Dalton Transactions","2000","","4","479","","10.1039/a908552a","","","0.71073","MoKα","","0.0559","0.0362","","0.1173","0.0901","","","","1.082","0.937","0.937","","","","","has coordinates","179794","2020-10-21","18:00:00",""
"7009098","12.518","0.006","17.347","0.004","11.166","0.004","100.07","0.02","112.31","0.03","79.9","0.03","2192.8","1.5","180","2","180","2","","","","","","","","7","P -1","-P 1","2","","","","- C43.5 H73 As Li N2 O P3 -","- C43.5 H73 As Li N2 O P3 -","- C87 H146 As2 Li2 N4 O2 P6 -","2","1","","Bashall, Alan; Beswick, Michael A.; Choi, Nick; Hopkins, Alexander D.; Kidd, Sara J.; Lawson, Yvonne G.; Mosquera, Marta E. G.; McPartlin, Mary; Raithby, Paul R.; Wheatley, Andrew A. E. H.; Wood, Jody A.; Wright, Dominic S.","A synthetic and structural study of the formation of cyclic [(RP)nE]− anions and Zintl compounds using E(NMe2)3 (E = As, Sb)","Journal of the Chemical Society, Dalton Transactions","2000","","4","479","","10.1039/a908552a","","","0.71069","MoKα","","0.0763","0.0518","","","0.1205","0.1328","","","","","","1.037","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7009099","17.0665","0.0008","19.0941","0.0009","19.2877","0.001","90","","115.138","0.001","90","","5690","0.5","173","2","173","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C56 H44 B Cl4 F4 P4 Pd0.5 S4 -","- C56.06 H44.48 B Cl4 F4 P4 Pd0.5 S4 -","- C224.24 H177.92 B4 Cl16 F16 P16 Pd2 S16 -","4","1","","Smucker, Bradley W.; Dunbar, Kim R.","Homoleptic complexes of Ag(I), Cu(I), Pd(II) and Pt(II) with tetrathiafulvalene-functionalized phosphine ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","8","1309","","10.1039/a908559i","","","0.71073","MoKα","","0.123","0.0651","","","0.1524","0.1801","","","","","","1.042","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7009100","22.527","0.004","16.736","0.003","17.944","0.004","90","","112.4","0.03","90","","6255","3","173","2","173","2","","","","","","","","8","C 1 2/m 1","-C 2y","12","","","","- C276 H232 B4 Cl8 F16 P16 Pd2 S16 -","- C278 H234 B4 Cl8 F16 P16 Pd2 S16 -","- C278 H234 B4 Cl8 F16 P16 Pd2 S16 -","1","0.125","","Smucker, Bradley W.; Dunbar, Kim R.","Homoleptic complexes of Ag(I), Cu(I), Pd(II) and Pt(II) with tetrathiafulvalene-functionalized phosphine ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","8","1309","","10.1039/a908559i","","","0.71073","MoKα","","0.1552","0.0764","","","0.1593","0.1959","","","","","","1.017","","","","has coordinates,has disorder","179795","2020-10-21","18:00:00",""
"7009101","17.109","0.003","19.069","0.004","19.339","0.004","90","","115.17","0.03","90","","5710","2","173","2","173","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C56 H44 B Cl4 F4 P4 Pt0.5 S4 -","- C56 H44 B Cl4 F4 P4 Pt0.5 S4 -","- C224 H176 B4 Cl16 F16 P16 Pt2 S16 -","4","1","","Smucker, Bradley W.; Dunbar, Kim R.","Homoleptic complexes of Ag(I), Cu(I), Pd(II) and Pt(II) with tetrathiafulvalene-functionalized phosphine ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","8","1309","","10.1039/a908559i","","","0.71073","MoKα","","0.0983","0.0533","","","0.1285","0.1508","","","","","","0.953","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009102","22.54","0.004","16.739","0.003","17.929","0.004","90","","112.35","0.03","90","","6256","3","173","2","173","2","","","","","","","","8","C 1 2/m 1","-C 2y","12","","","","- C276 H232 B4 Cl8 F16 P16 Pt2 S16 -","- C276 H234 B4 Cl8 F16 P16 Pt2 S16 -","- C276 H234 B4 Cl8 F16 P16 Pt2 S16 -","1","0.125","","Smucker, Bradley W.; Dunbar, Kim R.","Homoleptic complexes of Ag(I), Cu(I), Pd(II) and Pt(II) with tetrathiafulvalene-functionalized phosphine ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","8","1309","","10.1039/a908559i","","","0.71073","MoKα","","0.0769","0.0574","","","0.1316","0.1458","","","","","","0.918","","","","has coordinates,has disorder","179795","2020-10-21","18:00:00",""
"7009103","25.569","0.005","21.376","0.004","27.209","0.005","90","","112.75","0.03","90","","13714","5","173","2","173","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C67.65 H57.53 Ag B Cl0.48 F4 N1.68 P4 S8 -","- C67.636 H57.516 Ag B Cl0.494 F4 N1.674 P4 S8 -","- C541.088 H460.128 Ag8 B8 Cl3.952 F32 N13.392 P32 S64 -","8","2","","Smucker, Bradley W.; Dunbar, Kim R.","Homoleptic complexes of Ag(I), Cu(I), Pd(II) and Pt(II) with tetrathiafulvalene-functionalized phosphine ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","8","1309","","10.1039/a908559i","","","0.71073","MoKα","","0.0701","0.0409","","","0.1171","0.1345","","","","","","0.9","","","","has coordinates,has disorder","179795","2020-10-21","18:00:00",""
"7009104","17.788","0.004","20.676","0.004","18.183","0.004","90","","90.83","0.03","90","","6687","2","110","2","110","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C68 H58 B Cu F4 N2 P4 S8 -","- C68 H58 B Cu F4 N2 P4 S8 -","- C272 H232 B4 Cu4 F16 N8 P16 S32 -","4","1","","Smucker, Bradley W.; Dunbar, Kim R.","Homoleptic complexes of Ag(I), Cu(I), Pd(II) and Pt(II) with tetrathiafulvalene-functionalized phosphine ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","8","1309","","10.1039/a908559i","","","0.71073","MoKα","","0.0938","0.0436","","","0.0798","0.0927","","","","","","0.862","","","","has coordinates","205752","2020-10-21","18:00:00",""
"7009105","7.066","0.0005","17.4656","0.0014","10.5602","0.0008","90","","102.007","0.002","90","","1274.74","0.17","142","2","142","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H20 Cu2 I2 N10 O2 -","- C18 H20 Cu2 I2 N10 O2 -","- C36 H40 Cu4 I4 N20 O4 -","2","0.5","","Brook, David J. R.; Fornell, Spring; Noll, Bruce; Yee, Gordon T.; Koch, Tad H.","Synthesis and structure of di-μ-bromo-bis[(1,5-dimethyl-6-oxo-3-(2-pyridyl)verdazyl)copper(I)] †","Journal of the Chemical Society, Dalton Transactions","2000","","13","2019","","10.1039/a908563g","","","0.71073","MoKα","","0.1162","0.0584","","","0.087","0.1054","","","","","","1.06","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009106","7.125","0.005","11.794","0.004","13.524","0.008","90","","103.08","0.03","90","","1107","1.1","100","","100","","","","","","","","?","4","P 1 21/n 1","-P 2yn","14","","","","- C13 H14 Cl Re -","- C13 H14 Cl Re -","- C52 H56 Cl4 Re4 -","4","1","","Conway, Stephen L. J.; Doerrer, Linda H.; Green, Jennifer C.; Green, Malcolm L. H.; Scottow, Adrian; Stephens, Adam H. H.","Synthesis, structure and density functional study of the ansa-rhenocene complex [Re{(η-C5H4)CMe2(η-C5H4)}Cl] †","Journal of the Chemical Society, Dalton Transactions","2000","","3","329","","10.1039/a908619f","","","0.71073","MoKα","","","0.0345","","","0.0395","","","","","1.1089","1.1089","","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009107","8.47","0.004","10.106","0.004","13.403","0.003","80.26","0.03","74.88","0.03","67.53","0.02","1020.4","0.7","125","","125","","","","","","","","?","6","P -1","-P 1","2","","","","- C22 H12 B Cl F10 W -","- C22 H12 B Cl F10 W -","- C44 H24 B2 Cl2 F20 W2 -","2","1","","Doerrer, Linda H.; Graham, Andrew J.; Haussinger, Daniel; Green, Malcolm L. H.","Electrophilic addition reactions of the Lewis acids B(C6F5)2R [R = C6F5, Ph, H or Cl] with the metallocene hydrides [M(η-C5H5)2H2] (M = Mo or W), [Re(η-C5H5)2H] and [Ta(η-C5H5)2H3]","Journal of the Chemical Society, Dalton Transactions","2000","","5","813","","10.1039/a908623d","","","0.71073","MoKα","","","0.0264","","","","0.0296","","","","","","1.0594","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009108","15.427","0.003","15.619","0.004","19.877","0.002","90","","90","","90","","4789.4","1.6","125","","125","","","","","","","","?","5","P b c a","-P 2ac 2ab","61","","","","- C28 H9 B F15 Re -","- C28 H9 B F15 Re -","- C224 H72 B8 F120 Re8 -","8","1","","Doerrer, Linda H.; Graham, Andrew J.; Haussinger, Daniel; Green, Malcolm L. H.","Electrophilic addition reactions of the Lewis acids B(C6F5)2R [R = C6F5, Ph, H or Cl] with the metallocene hydrides [M(η-C5H5)2H2] (M = Mo or W), [Re(η-C5H5)2H] and [Ta(η-C5H5)2H3]","Journal of the Chemical Society, Dalton Transactions","2000","","5","813","","10.1039/a908623d","","","0.71073","MoKα","","","0.0238","","","","0.0247","","","","","","1.0402","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009109","25.189","0.007","25.189","0.007","18.061","0.006","90","","90","","120","","9924","5","295","","295","","","","","","","","","6","R -3 :H","-R 3","148","","","","- C20.33 H24 Cl2 Fe N2 O5 -","- C20.3333 H24 Cl2.33333 Fe N2 O5 -","- C366 H432 Cl42 Fe18 N36 O90 -","18","1","","Shyu, Huey-Lih; Wei, Ho-Hsiang; Lee, Gene-Hsaing; Wang, Yu","Structure, magnetic properties and epoxidation activity of iron(III) salicylaldimine complexes","Journal of the Chemical Society, Dalton Transactions","2000","","6","915","","10.1039/a908648j","","","0.71073","MolybdenumKα","","0.145","0.069","","0.074","0.07","","","","","2.97","2.97","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009110","14.701","0.004","13.552","0.004","19.941","0.003","90","","90","","90","","3972.8","1.7","295","","295","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C20 H21 Cl Fe N3 O2 -","- C20 H21 Cl Fe N3 O2 -","- C160 H168 Cl8 Fe8 N24 O16 -","8","1","","Shyu, Huey-Lih; Wei, Ho-Hsiang; Lee, Gene-Hsaing; Wang, Yu","Structure, magnetic properties and epoxidation activity of iron(III) salicylaldimine complexes","Journal of the Chemical Society, Dalton Transactions","2000","","6","915","","10.1039/a908648j","","","0.71073","MolybdenumKα","","0.16","0.049","","0.062","0.049","","","","","1.48","1.48","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009111","12.799","0.003","10.504","0.001","16.973","0.004","90","","93.38","0.01","90","","2277.9","0.8","293","2","293","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","[Au(Hdamp-C1)Cl(Hsaltsc)]PF6","[Au(Hdamp-C1)Cl(Hsaltsc)]PF6","","- C17 H21 Au Cl F6 N4 O P S -","- C17 H21 Au Cl F6 N4 O P S -","- C68 H84 Au4 Cl4 F24 N16 O4 P4 S4 -","4","1","","Abram, Ulrich; Ortner, Kirstin; Gust, Ronald; Sommer, Klaus","Gold complexes with thiosemicarbazones: reactions of bi- and tridentate thiosemicarbazones with dichloro[2-(dimethylaminomethyl)phenyl-C 1,N ]gold(III), [Au(damp-C 1,N )Cl2]","Journal of the Chemical Society, Dalton Transactions","2000","","5","735","","10.1039/a908712e","","","0.71073","MoKα","","0.0916","0.0389","","","0.0743","0.0862","","","","","","0.978","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009112","12.8583","0.0014","12.559","0.003","12.904","0.002","90","","97.206","0.017","90","","2067.4","0.6","208","2","208","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[Au(Hdamp-C1)Cl(mepyrtsc)]Cl","(2-(N,N-dimethylammoniummethyl)phenyl-C)(N-methylpyrrol-2-carboxaldehydetsc) (Cl)Au(III))Cl","","- C16 H22 Au Cl2 N5 S -","- C16 H22 Au Cl2 N5 S -","- C64 H88 Au4 Cl8 N20 S4 -","4","1","","Abram, Ulrich; Ortner, Kirstin; Gust, Ronald; Sommer, Klaus","Gold complexes with thiosemicarbazones: reactions of bi- and tridentate thiosemicarbazones with dichloro[2-(dimethylaminomethyl)phenyl-C 1,N ]gold(III), [Au(damp-C 1,N )Cl2]","Journal of the Chemical Society, Dalton Transactions","2000","","5","735","","10.1039/a908712e","","","0.71073","MoKα","","0.1295","0.0494","","","0.0772","0.093","","","","","","1.005","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009113","7.7002","0.0007","8.05","0.0009","12.461","0.001","74.076","0.009","75.846","0.008","64.49","0.008","663.22","0.12","213","2","213","2","","","","","","","","6","P -1","-P 1","2","H2pydoxmetsc x HCl","Pyridoxalmethylthiosemicarbazone hydrochloride","","- C10 H15 Cl N4 O2 S -","- C10 H15 Cl N4 O2 S -","- C20 H30 Cl2 N8 O4 S2 -","2","1","","Abram, Ulrich; Ortner, Kirstin; Gust, Ronald; Sommer, Klaus","Gold complexes with thiosemicarbazones: reactions of bi- and tridentate thiosemicarbazones with dichloro[2-(dimethylaminomethyl)phenyl-C 1,N ]gold(III), [Au(damp-C 1,N )Cl2]","Journal of the Chemical Society, Dalton Transactions","2000","","5","735","","10.1039/a908712e","","","1.54184","CuKα","","0.0661","0.0539","","","0.1927","0.2058","","","","","","1.24","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7009114","9.736","0.002","11.18","0.001","13.085","0.002","77.352","0.007","84.752","0.009","82.996","0.007","1376.3","0.4","153","2","153","2","","","","","","","","7","P -1","-P 1","2","[Au(Hdamp-C1)Cl(H2pydoxmetsc)l]Cl2*MeOH","[Au(Hdamp-C1)Cl(H2pydoxmetsc)C]Cl2*MeOH","","- C20 H31 Au Cl3 N5 O3 S -","- C20 H31 Au Cl3 N5 O3 S -","- C40 H62 Au2 Cl6 N10 O6 S2 -","2","1","","Abram, Ulrich; Ortner, Kirstin; Gust, Ronald; Sommer, Klaus","Gold complexes with thiosemicarbazones: reactions of bi- and tridentate thiosemicarbazones with dichloro[2-(dimethylaminomethyl)phenyl-C 1,N ]gold(III), [Au(damp-C 1,N )Cl2]","Journal of the Chemical Society, Dalton Transactions","2000","","5","735","","10.1039/a908712e","","","0.71073","MoKα","","0.062","0.0613","","","0.1234","0.1238","","","","","","1.27","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009115","16.596","0.003","11.2571","0.0006","18.363","0.003","90","","94.803","0.014","90","","3418.6","0.9","208","2","208","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","[Au(Hdamp-C1)(Ptsc)]Cl2 * 1.5 CH3OH","","- C30.5 H36 Au Cl2 N4 O1.5 P S -","- C30.5 H36 Au Cl2 N4 O1.5 P S -","- C122 H144 Au4 Cl8 N16 O6 P4 S4 -","4","1","","Abram, Ulrich; Ortner, Kirstin; Gust, Ronald; Sommer, Klaus","Gold complexes with thiosemicarbazones: reactions of bi- and tridentate thiosemicarbazones with dichloro[2-(dimethylaminomethyl)phenyl-C 1,N ]gold(III), [Au(damp-C 1,N )Cl2]","Journal of the Chemical Society, Dalton Transactions","2000","","5","735","","10.1039/a908712e","","","0.71073","MoKα","","0.0682","0.0362","","","0.0804","0.0887","","","","","","1.063","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009116","13.943","0.003","13.41","0.004","15.292","0.003","90","","100.05","0.02","90","","2815.4","1.2","208","2","208","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","[Au(Hdamp-C1)(apphtsc)]Cl2 x 2MeOH","[Au(Hdamp-C1)(2-AcetylpyridinPhenyltsc)]Cl2*2MeOH","","- C25 H34 Au Cl2 N5 O2 S -","- C25 H34 Au Cl2 N5 O2 S -","- C100 H136 Au4 Cl8 N20 O8 S4 -","4","1","","Abram, Ulrich; Ortner, Kirstin; Gust, Ronald; Sommer, Klaus","Gold complexes with thiosemicarbazones: reactions of bi- and tridentate thiosemicarbazones with dichloro[2-(dimethylaminomethyl)phenyl-C 1,N ]gold(III), [Au(damp-C 1,N )Cl2]","Journal of the Chemical Society, Dalton Transactions","2000","","5","735","","10.1039/a908712e","","","0.71073","MoKα","","0.0764","0.0423","","","0.0969","0.1078","","","","","","1.097","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009117","11.363","0.002","12.633","0.003","17.013","0.003","90","","93.8","0.03","90","","2436.8","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H26 Co N8 O7 -","- C18 H26 Co N8 O7 -","- C72 H104 Co4 N32 O28 -","4","1","","Kurdziel, Krystyna; Głowiak, Tadeusz; Jezierska, Julia","Complexes of some transition metal ions with 2-methyl-1-vinylimidazole in aqueous solution and the solid state","Journal of the Chemical Society, Dalton Transactions","2000","","7","1095","","10.1039/a908718d","","","0.71069","MoK\α","","0.0901","0.0353","","0.0993","0.084","","","","0.959","1.103","1.103","","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009118","7.261","0.001","7.931","0.002","14.743","0.003","103.78","0.03","95.39","0.03","94.78","0.03","816","0.3","100","1","100","1","","","","","","","","5","P -1","-P 1","2","","","","- C12 H16 Cu N6 O6 -","- C12 H16 Cu N6 O6 -","- C24 H32 Cu2 N12 O12 -","2","1","","Kurdziel, Krystyna; Głowiak, Tadeusz; Jezierska, Julia","Complexes of some transition metal ions with 2-methyl-1-vinylimidazole in aqueous solution and the solid state","Journal of the Chemical Society, Dalton Transactions","2000","","7","1095","","10.1039/a908718d","","","0.71073","MoK\α","","0.0322","0.0313","","","0.0776","0.0787","","","","","","1.058","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009119","10.1175","0.0011","12.9778","0.0014","20.112","0.002","99.688","0.008","90.217","0.008","91.558","0.009","2602","0.5","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","","","- C55 H58 Cd Cl3 F6 N4 P -","- C55 H58 Cd Cl3 F6 N4 P -","- C110 H116 Cd2 Cl6 F12 N8 P2 -","2","1","","Al Shihadeh, Youseff; Benito, Angel; Lloris, José Manuel; Martínez-Máñez, Ramón; Pardo, Teresa; Soto, Juan; Marcos, M. Dolores","Polyaza and azaoxa macrocyclic receptors functionalised with fluorescent subunits; Hg2+ selective signalling","Journal of the Chemical Society, Dalton Transactions","2000","","7","1199","","10.1039/a908762a","","","0.71073","MoKα","","0.0736","0.0544","","0.1734","0.154","","","","1.225","1.25","1.25","","","","","has coordinates,has disorder","179795","2020-10-21","18:00:00",""
"7009120","13.085","0.008","15.847","0.004","6.161","0.002","90","","102.07","0.01","90","","1249.3","0.9","295","2","295","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C3 H11 Cd0.5 N2 O10 V4 -","- C3 H11 Cd0.5 N2 O10 V4 -","- C12 H44 Cd2 N8 O40 V16 -","4","0.5","","Zhang, Lirong; Shi, Zhan; Yang, Guoyu; Chen, Xiaoming; Feng, Shouhua","Hydrothermal synthesis and crystal structure of a layered vanadium oxide with an interlayer metal co-ordination complex: Cd[C3N2H11]2[V8O20]","Journal of the Chemical Society, Dalton Transactions","2000","","3","275","","10.1039/a908773g","","","0.71073","MoKα","","0.04","0.0358","","","0.0907","0.093","","","","","","1.166","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009121","8.3292","0.0005","8.3292","0.0005","8.3292","0.0005","77.833","0.007","77.833","0.007","77.833","0.007","543.74","0.06","293","2","293","2","","","","","","","","6","R -3 :R","-P 3*","148","","","","- C12 H24.6 Mo2 N2 O0.3 S7 -","- C12 H24 Mo2 N2 O0.3 S7 -","- C12 H24 Mo2 N2 O0.3 S7 -","1","0.166667","","Davies, Sian C.; Hughes, David L.; Richards, Raymond L.; Sanders, J. Roger","Molybdenum and tungsten complexes of the N(CH2CH2S)33− (NS3) ligand with oxide, sulfide, diazenide, hydrazide and nitrosyl co-ligands","Journal of the Chemical Society, Dalton Transactions","2000","","5","719","","10.1039/a908777j","","","0.71069","MoKα","","0.0276","0.0242","","0.0741","0.0723","","","","1.147","1.187","1.187","","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009122","8.4093","0.0007","10.5438","0.001","14.0272","0.0013","90","","90","","90","","1243.74","0.19","293","2","293","2","","","","","","","","5","P m c n","-P 2n 2a","62","","","","- C7 H15 Mo N3 S3 -","- C7 H15 Mo N3 S3 -","- C28 H60 Mo4 N12 S12 -","4","0.5","","Davies, Sian C.; Hughes, David L.; Richards, Raymond L.; Sanders, J. Roger","Molybdenum and tungsten complexes of the N(CH2CH2S)33− (NS3) ligand with oxide, sulfide, diazenide, hydrazide and nitrosyl co-ligands","Journal of the Chemical Society, Dalton Transactions","2000","","5","719","","10.1039/a908777j","","","0.71069","MoKα","","0.0212","0.0182","","0.0497","0.0475","","","","1.126","1.133","1.133","","","","","has coordinates,has disorder","179795","2020-10-21","18:00:00",""
"7009123","15.1833","0.0014","12.2873","0.0014","16.861","0.002","90","0.009","90","0.008","90","0.008","3145.6","0.6","293","2","293","2","","","","","","","","5","P c a b","-P 2bc 2ac","61","","","","- C12 H17 Mo N3 S3 -","- C12 H16 Mo N3 S3 -","- C96 H128 Mo8 N24 S24 -","8","1","","Davies, Sian C.; Hughes, David L.; Richards, Raymond L.; Sanders, J. Roger","Molybdenum and tungsten complexes of the N(CH2CH2S)33− (NS3) ligand with oxide, sulfide, diazenide, hydrazide and nitrosyl co-ligands","Journal of the Chemical Society, Dalton Transactions","2000","","5","719","","10.1039/a908777j","","","0.71069","MoKα","","0.103","0.0383","","0.1137","0.0852","","","","0.994","1.142","1.142","","","","","has coordinates,has disorder","179795","2020-10-21","18:00:00",""
"7009124","10.52","0.0013","13.435","0.002","7.9567","0.0008","90.41","0.009","101.23","0.01","96.569","0.01","1095.3","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C6 H12 Mo N2 O S3 -","- C6 H12 Mo N2 O S3 -","- C24 H48 Mo4 N8 O4 S12 -","4","2","","Davies, Sian C.; Hughes, David L.; Richards, Raymond L.; Sanders, J. Roger","Molybdenum and tungsten complexes of the N(CH2CH2S)33− (NS3) ligand with oxide, sulfide, diazenide, hydrazide and nitrosyl co-ligands","Journal of the Chemical Society, Dalton Transactions","2000","","5","719","","10.1039/a908777j","","","0.71069","MoKα","","0.0401","0.0294","","0.0774","0.0708","","","","1.06","1.092","1.092","","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009125","12.2952","0.0014","13.9137","0.0015","11.6072","0.0014","90","","107.072","0.01","90","","1898.2","0.4","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C24 H52 N4 S12 W2 -","- C24 H48 N4 S12 W2 -","- C48 H96 N8 S24 W4 -","2","0.5","","Davies, Sian C.; Hughes, David L.; Richards, Raymond L.; Sanders, J. Roger","Molybdenum and tungsten complexes of the N(CH2CH2S)33− (NS3) ligand with oxide, sulfide, diazenide, hydrazide and nitrosyl co-ligands","Journal of the Chemical Society, Dalton Transactions","2000","","5","719","","10.1039/a908777j","","","0.71069","MoKα","","0.0714","0.0478","","0.1304","0.1126","","","","1","1.043","1.043","","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"7009126","10.354","0.002","25.041","0.005","11.332","0.002","90","","107.87","0.03","90","","2796.4","1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C29 H30 P2 Pd S2 -","- C29 H26 P2 Pd S2 -","- C116 H104 P8 Pd4 S8 -","4","1","","Su, Weiping; Cao, Rong; Hong, Maochun; Wu, Daxu; Lu, Jiaxi","A new access to palladium‒phosphine chemistry. Formation of polynuclear palladium compounds via the oxidation of ligands in simple palladium(II) complexes","Journal of the Chemical Society, Dalton Transactions","2000","","9","1527","","10.1039/a908788e","","","0.71073","MoKα","","0.0488","0.0357","","0.1024","0.1006","","","","1.056","1.143","1.143","","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009127","15.905","0.003","22.848","0.005","18.904","0.004","90","","90","","90","","6870","2","293","2","293","2","","","","","","","","7","A b a 2","A 2 -2ab","41","","","","- C31 H35 Cl0 O4.5 P2 Pd2 S4 -","- C31 H34 O4.5 P2 Pd2 S4 -","- C248 H272 O36 P16 Pd16 S32 -","8","","","Su, Weiping; Cao, Rong; Hong, Maochun; Wu, Daxu; Lu, Jiaxi","A new access to palladium‒phosphine chemistry. Formation of polynuclear palladium compounds via the oxidation of ligands in simple palladium(II) complexes","Journal of the Chemical Society, Dalton Transactions","2000","","9","1527","","10.1039/a908788e","","","0.71073","MoKα","","0.0587","0.0469","","0.0827","0.0795","","","","1.362","1.414","1.414","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009128","10.506","0.002","16.789","0.003","10.837","0.002","90","","99.83","0.03","90","","1883.4","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H38 O Pd6 S12 -","- C18 H36 O Pd6 S12 -","- C36 H72 O2 Pd12 S24 -","2","0.5","","Su, Weiping; Cao, Rong; Hong, Maochun; Wu, Daxu; Lu, Jiaxi","A new access to palladium‒phosphine chemistry. Formation of polynuclear palladium compounds via the oxidation of ligands in simple palladium(II) complexes","Journal of the Chemical Society, Dalton Transactions","2000","","9","1527","","10.1039/a908788e","","","0.71073","MoKα","","0.1011","0.0643","","0.1687","0.1512","","","","1.134","1.205","1.205","","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009129","22.5683","0.0007","11.6585","0.0004","20.5798","0.0005","90","","97.905","0.001","90","","5363.3","0.3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C57 H58 Cl2 P4 Pd2 S2 -","- C57 H58 Cl2 P4 Pd2 S2 -","- C228 H232 Cl8 P16 Pd8 S8 -","4","0.5","","Su, Weiping; Cao, Rong; Hong, Maochun; Wu, Daxu; Lu, Jiaxi","A new access to palladium‒phosphine chemistry. Formation of polynuclear palladium compounds via the oxidation of ligands in simple palladium(II) complexes","Journal of the Chemical Society, Dalton Transactions","2000","","9","1527","","10.1039/a908788e","","","0.71073","MoKα","","0.0833","0.0478","","0.0759","0.0695","","","","1.187","1.306","1.306","","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009130","27.118","0.005","14.987","0.003","20.477","0.004","90","","126.65","0.03","90","","6677","3","293","2","293","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C63 H74 Cl2 N O3 P4 Pd3 S4 -","- C63 H66 Cl2 N O3 P4 Pd3 S4 -","- C252 H264 Cl8 N4 O12 P16 Pd12 S16 -","4","0.5","","Su, Weiping; Cao, Rong; Hong, Maochun; Wu, Daxu; Lu, Jiaxi","A new access to palladium‒phosphine chemistry. Formation of polynuclear palladium compounds via the oxidation of ligands in simple palladium(II) complexes","Journal of the Chemical Society, Dalton Transactions","2000","","9","1527","","10.1039/a908788e","","","0.71073","MoKα","","0.1466","0.0678","","0.1634","0.1277","","","","1.044","1.152","1.152","","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009131","17.768","0.007","7.368","0.004","21.404","0.008","90","","92.78","0.018","90","","2799","2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C52 H64 Mn N18 O8 -","- C52 H64 Mn N18 O8 -","- C104 H128 Mn2 N36 O16 -","2","0.5","","Dasna, Iwayan; Golhen, Stéphane; Ouahab, Lahcène; Peña, Octavio; Guillevic, Joseph; Fettouhi, Mohammed","1-D mixed stack of coordinated and uncoordinated radicals in MnII(NITpPy)4[N(CN)2]2 (NITpPy = nitronyl nitroxide radical)","Journal of the Chemical Society, Dalton Transactions","2000","","2","129","","10.1039/a908891a","","","0.71073","MoKα","","0.28","0.0662","","","0.1082","0.1517","","","","","","0.927","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009132","7.511","0.002","32.346","0.006","10.526","0.003","90","","104.78","0.02","90","","2472.7","1.1","295","","295","","","","","","","","chemical synthesis","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H56 Cl2 Mn N18 O21 -","- C30 H54 Cl2 Mn N18 O21 -","- C60 H108 Cl4 Mn2 N36 O42 -","2","0.5","","De Munno, Giovanni; Medaglia, Marcella; Armentano, Donatella; Anastassopoulou, Jane; Theophanides, Theophilos","New supramolecular complexes of manganese(II) and cobalt(II) with nucleic bases. Crystal structures of [M(H2O)6(1-Mecyt)6][ClO4]2·H2O, [Co(1-Mecyt)4][ClO4]2 and [M(H2O)4(cyt)2][ClO4]2·2cyt·2H2O [M = CoII or MnII; cyt = cytosine; 1-Mecyt = 1-methylcytosine]","Journal of the Chemical Society, Dalton Transactions","2000","","10","1625","","10.1039/a908901b","","","0.71073","MoKα","","11.58","5.53","","7.37","6.33","","","","","1.4","1.4","","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009133","7.674","0.003","31.939","0.006","10.363","0.002","90","","103.96","0.02","90","","2465","1.2","295","","295","","","","","","","","chemical synthesis","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H56 Cl2 Co N18 O21 -","- C30 H54 Cl2 Co N18 O21 -","- C60 H108 Cl4 Co2 N36 O42 -","2","0.5","","De Munno, Giovanni; Medaglia, Marcella; Armentano, Donatella; Anastassopoulou, Jane; Theophanides, Theophilos","New supramolecular complexes of manganese(II) and cobalt(II) with nucleic bases. Crystal structures of [M(H2O)6(1-Mecyt)6][ClO4]2·H2O, [Co(1-Mecyt)4][ClO4]2 and [M(H2O)4(cyt)2][ClO4]2·2cyt·2H2O [M = CoII or MnII; cyt = cytosine; 1-Mecyt = 1-methylcytosine]","Journal of the Chemical Society, Dalton Transactions","2000","","10","1625","","10.1039/a908901b","","","0.71073","MoKα","","9.32","4.92","","7.75","6.41","","","","","1.41","1.41","","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009134","13.737","0.002","13.737","0.002","16.131","0.003","90","","90","","90","","3044","0.8","295","","295","","","","","","","","chemical synthesis","6","I 41/a :2","-I 4ad","88","","","","- C20 H28 Cl2 Co N12 O12 -","- C20 H28 Cl2 Co N12 O12 -","- C80 H112 Cl8 Co4 N48 O48 -","4","0.25","","De Munno, Giovanni; Medaglia, Marcella; Armentano, Donatella; Anastassopoulou, Jane; Theophanides, Theophilos","New supramolecular complexes of manganese(II) and cobalt(II) with nucleic bases. Crystal structures of [M(H2O)6(1-Mecyt)6][ClO4]2·H2O, [Co(1-Mecyt)4][ClO4]2 and [M(H2O)4(cyt)2][ClO4]2·2cyt·2H2O [M = CoII or MnII; cyt = cytosine; 1-Mecyt = 1-methylcytosine]","Journal of the Chemical Society, Dalton Transactions","2000","","10","1625","","10.1039/a908901b","","","0.71073","MoKα","","5.98","4.69","","7.96","6.8","","","","","1.29","1.29","","","","","has coordinates","206958","2020-10-21","18:00:00",""
"7009135","6.829","0.005","9.997","0.004","12.911","0.005","71.65","0.03","87.33","0.05","72.19","0.05","795.3","0.8","295","","295","","","","","","","","chemical synthesis","6","P -1","-P 1","2","","","","- C16 H32 Cl2 Mn N12 O18 -","- C16 H36 Cl2 Mn N12 O26 -","- C16 H36 Cl2 Mn N12 O26 -","1","0.5","","De Munno, Giovanni; Medaglia, Marcella; Armentano, Donatella; Anastassopoulou, Jane; Theophanides, Theophilos","New supramolecular complexes of manganese(II) and cobalt(II) with nucleic bases. Crystal structures of [M(H2O)6(1-Mecyt)6][ClO4]2·H2O, [Co(1-Mecyt)4][ClO4]2 and [M(H2O)4(cyt)2][ClO4]2·2cyt·2H2O [M = CoII or MnII; cyt = cytosine; 1-Mecyt = 1-methylcytosine]","Journal of the Chemical Society, Dalton Transactions","2000","","10","1625","","10.1039/a908901b","","","0.71073","MoKα","","6.87","6.86","","9.18","9.17","","","","","1.91","1.91","","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009136","6.756","0.002","9.985","0.002","12.837","0.003","72.16","0.02","87.78","0.02","72.19","0.02","783.4","0.4","295","","295","","","","","","","","chemical synthesis","6","P -1","-P 1","2","","","","- C16 H32 Cl2 Co N12 O18 -","- C16 H32 Cl2 Co N12 O24 -","- C16 H32 Cl2 Co N12 O24 -","1","0.5","","De Munno, Giovanni; Medaglia, Marcella; Armentano, Donatella; Anastassopoulou, Jane; Theophanides, Theophilos","New supramolecular complexes of manganese(II) and cobalt(II) with nucleic bases. Crystal structures of [M(H2O)6(1-Mecyt)6][ClO4]2·H2O, [Co(1-Mecyt)4][ClO4]2 and [M(H2O)4(cyt)2][ClO4]2·2cyt·2H2O [M = CoII or MnII; cyt = cytosine; 1-Mecyt = 1-methylcytosine]","Journal of the Chemical Society, Dalton Transactions","2000","","10","1625","","10.1039/a908901b","","","0.71073","MoKα","","9.78","6.09","","12.46","9.55","","","","","1.69","1.69","","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009137","8.806","0.001","9.043","0.001","10.255","0.001","90","","91.49","0.01","90","","816.36","0.15","295","2","295","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C7 H9 Ag0.5 N2.5 O1.5 -","- C7 H9 Ag0.5 N2.5 O1.5 -","- C28 H36 Ag2 N10 O6 -","4","1","","Fei, Bao-Li; Sun, Wei-Yin; Yu, Kai-Bei; Tang, Wen-Xia","Construction of co-ordination networks of 1,6-bis(4'-pyridyl)-2,5-diazahexane with silver(I) and copper(I). Structural diversity through change in metal ions and counter ions","Journal of the Chemical Society, Dalton Transactions","2000","","5","805","","10.1039/a908910a","","","0.71073","MoKα","","0.057","0.0354","","","0.0795","0.0858","","","","","","0.892","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7009138","14.22","0.002","7.082","0.001","19.914","0.003","90","","94.33","0.01","90","","1999.7","0.5","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H21 Ag Cl N5 O4 -","- C16 H21 Ag Cl N5 O4 -","- C64 H84 Ag4 Cl4 N20 O16 -","4","1","","Fei, Bao-Li; Sun, Wei-Yin; Yu, Kai-Bei; Tang, Wen-Xia","Construction of co-ordination networks of 1,6-bis(4'-pyridyl)-2,5-diazahexane with silver(I) and copper(I). Structural diversity through change in metal ions and counter ions","Journal of the Chemical Society, Dalton Transactions","2000","","5","805","","10.1039/a908910a","","","0.71073","MoKα","","0.0603","0.0417","","","0.1094","0.1163","","","","","","1.03","","","","has coordinates,has disorder","179795","2020-10-21","18:00:00",""
"7009139","9.055","0.002","10.734","0.002","18.338","0.003","90","","90","","90","","1782.4","0.6","296","2","296","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C14 H16 Cl Cu N4 O4 -","- C14 H16 Cl Cu N4 O4 -","- C56 H64 Cl4 Cu4 N16 O16 -","4","1","","Fei, Bao-Li; Sun, Wei-Yin; Yu, Kai-Bei; Tang, Wen-Xia","Construction of co-ordination networks of 1,6-bis(4'-pyridyl)-2,5-diazahexane with silver(I) and copper(I). Structural diversity through change in metal ions and counter ions","Journal of the Chemical Society, Dalton Transactions","2000","","5","805","","10.1039/a908910a","","","0.71073","MoKα","","0.1021","0.0426","","0.1004","0.0868","","","","0.801","1.063","1.063","","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009140","19.691","0.004","19.747","0.004","24.343","0.007","96.82","0.03","94.56","0.03","119.71","0.02","8057","4","160","2","160","2","","","","","","","","5","P -1","-P 1","2","","","","- C46 H44 Cd N6 O4 -","- C46 H44 Cd N6 O4 -","- C368 H352 Cd8 N48 O32 -","8","4","","Pettinari, Claudio; Marchetti, Fabio; Cingolani, Augusto; Pettinari, Riccardo; Troyanov, Sergei I.; Drozdov, Andrei","Novel bis(acylpyrazolonato)cadmium(II) derivatives and their reactivity toward aromatic and aliphatic N2-donor ligands","Journal of the Chemical Society, Dalton Transactions","2000","","5","831","","10.1039/a908913f","","","0.71073","MoKα","","0.1984","0.0902","","","0.2004","0.2366","","","","","","0.826","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009141","8.992","0.002","10.358","0.003","10.678","0.003","85.69","0.03","71.72","0.03","74.19","0.03","908.6","0.5","170","2","170","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H50 Cd N4 O6 -","- C36 H50 Cd N4 O6 -","- C36 H50 Cd N4 O6 -","1","0.5","","Pettinari, Claudio; Marchetti, Fabio; Cingolani, Augusto; Pettinari, Riccardo; Troyanov, Sergei I.; Drozdov, Andrei","Novel bis(acylpyrazolonato)cadmium(II) derivatives and their reactivity toward aromatic and aliphatic N2-donor ligands","Journal of the Chemical Society, Dalton Transactions","2000","","5","831","","10.1039/a908913f","","","0.71073","MoKα","","0.0404","0.0347","","0.1101","0.0892","","","","1.14","1.151","1.151","","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009142","23.324","0.006","7.577","0.002","21.702","0.006","90","","97","0.03","90","","3806.7","1.8","180","2","180","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C38 H54 Cd N6 O4 -","- C38 H54 Cd N6 O4 -","- C152 H216 Cd4 N24 O16 -","4","0.5","","Pettinari, Claudio; Marchetti, Fabio; Cingolani, Augusto; Pettinari, Riccardo; Troyanov, Sergei I.; Drozdov, Andrei","Novel bis(acylpyrazolonato)cadmium(II) derivatives and their reactivity toward aromatic and aliphatic N2-donor ligands","Journal of the Chemical Society, Dalton Transactions","2000","","5","831","","10.1039/a908913f","","","0.71073","MoKα","","0.0603","0.0444","","0.1188","0.1047","","","","1.026","1.055","1.055","","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009143","10.359","0.002","13.218","0.003","14.597","0.003","63.28","0.03","71.03","0.03","75.74","0.03","1676.4","0.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C34.5 H19 Cl5 N2 O2 Pd -","- C34.25 H18 Cl5 N2 O2 Pd -","- C68.5 H36 Cl10 N4 O4 Pd2 -","2","1","","Zhou, Xiang-Ge; Huang, Jie-Sheng; Yu, Xiao-Qi; Zhou, Zhong-Yuan; Che, Chi-Ming","Binaphthyl Schiff base complexes of palladium(II). Structures and reactivities toward alkene epoxidation","Journal of the Chemical Society, Dalton Transactions","2000","","7","1075","","10.1039/a908917i","","","0.71073","MoKα","","0.0949","0.0733","","","0.1925","0.1997","","","","","","1.165","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7009144","10.317","0.002","13.332","0.003","13.668","0.003","98.88","0.03","93.85","0.03","102","0.03","1807.3","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H34 Cl4 N2 O4 Pd -","- C38 H34 Cl4 N2 O4 Pd -","- C76 H68 Cl8 N4 O8 Pd2 -","2","1","","Zhou, Xiang-Ge; Huang, Jie-Sheng; Yu, Xiao-Qi; Zhou, Zhong-Yuan; Che, Chi-Ming","Binaphthyl Schiff base complexes of palladium(II). Structures and reactivities toward alkene epoxidation","Journal of the Chemical Society, Dalton Transactions","2000","","7","1075","","10.1039/a908917i","","","0.71073","MoKα","","0.0876","0.0788","","","0.1789","0.2344","","","","","","1.28","","","","has coordinates,has disorder","179795","2020-10-21","18:00:00",""
"7009145","6.4302","0.0001","10.3539","0.0004","12.302","0.0004","95.305","0.002","99.351","0.002","101.149","0.002","786.38","0.04","273.2","","273.2","","","","","","","","","4","P -1","-P 1","2","","","","- C44 H28 Li N4 -","- C44 H28 Li N4 -","- C44 H28 Li N4 -","1","0.5","","Gebauer, Andreas; Dawson, Denisha Y.; Arnold, John","Neutral π-radicals of lithium porphyrins: synthesis and characterization","Journal of the Chemical Society, Dalton Transactions","2000","","2","111","","10.1039/a908956j","","","0.7107","MoKα","","","0.0493","","","0.0534","","","","","2.196","2.196","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009146","22.871","0.004","13.852","0.003","18.117","0.003","90","","93.104","0.012","90","","5731.2","1.9","153","2","153","2","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C60 H80 Cl2 N O4 P Pd -","- C60 H80 Cl2 N O4 P Pd -","- C240 H320 Cl8 N4 O16 P4 Pd4 -","4","1","","Cobley, Christopher J.; Ellis, Dianne D.; Orpen, A. Guy; Pringle, Paul G.","Calix[4]arene derived phosphites: their hydrolytic stability and complexes with gold(I), platinum(II,0), palladium(II) and iridium(I)","Journal of the Chemical Society, Dalton Transactions","2000","","7","1101","","10.1039/a908960h","","","0.71073","MoKα","","0.0459","0.0447","","0.1182","0.1163","","","","1.029","1.024","1.024","","","","","has coordinates,has disorder","179795","2020-10-21","18:00:00",""
"7009147","13.312","0.003","13.923","0.003","16.352","0.003","106.68","0.03","95.68","0.03","107.47","0.03","2711.9","1.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C94 H112 Cl24 O8 P2 Pd2 -","- C94 H112 Cl24 O8 P2 Pd2 -","- C94 H112 Cl24 O8 P2 Pd2 -","1","0.5","","Cobley, Christopher J.; Ellis, Dianne D.; Orpen, A. Guy; Pringle, Paul G.","Calix[4]arene derived phosphites: their hydrolytic stability and complexes with gold(I), platinum(II,0), palladium(II) and iridium(I)","Journal of the Chemical Society, Dalton Transactions","2000","","7","1101","","10.1039/a908960h","","","0.71073","MoKα","","0.0758","0.0507","","0.1482","0.126","","","","1.09","1.09","1.09","","","","","has coordinates,has disorder","179795","2020-10-21","18:00:00",""
"7009148","8.914","0.002","10.115","0.002","18.556","0.003","82.27","0.02","84.47","0.02","71.912","0.014","1573.3","0.6","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C39 H36 Cl Ir O4 P -","- C39 H36 Cl Ir O4 P -","- C78 H72 Cl2 Ir2 O8 P2 -","2","1","","Cobley, Christopher J.; Ellis, Dianne D.; Orpen, A. Guy; Pringle, Paul G.","Calix[4]arene derived phosphites: their hydrolytic stability and complexes with gold(I), platinum(II,0), palladium(II) and iridium(I)","Journal of the Chemical Society, Dalton Transactions","2000","","7","1101","","10.1039/a908960h","","","0.71073","MoKα","","0.0335","0.0288","","0.0724","0.0672","","","","1.152","1.109","1.109","","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009149","13.6605","0.0014","13.821","0.002","14.66","0.002","104.27","0.011","101.943","0.012","104.796","0.008","2483.6","0.6","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C98 H120 Cl12 O8 P2 Pt2 -","- C98 H114 Cl12 O8 P2 Pt2 -","- C98 H114 Cl12 O8 P2 Pt2 -","1","0.5","","Cobley, Christopher J.; Ellis, Dianne D.; Orpen, A. Guy; Pringle, Paul G.","Calix[4]arene derived phosphites: their hydrolytic stability and complexes with gold(I), platinum(II,0), palladium(II) and iridium(I)","Journal of the Chemical Society, Dalton Transactions","2000","","7","1101","","10.1039/a908960h","","","0.71073","MoKα","","0.0745","0.0476","","0.1096","0.1037","","","","0.789","0.996","0.996","","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009150","15.276","0.002","18.109","0.003","21.303","0.003","94.378","0.01","93.617","0.01","96.183","0.013","5826.6","1.5","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C58.75 H78 Cl3 O7 P Rh -","- C58.75 H75 Cl3 O7 P Rh -","- C235 H300 Cl12 O28 P4 Rh4 -","4","2","","Cobley, Christopher J.; Ellis, Dianne D.; Orpen, A. Guy; Pringle, Paul G.","Rhodium(I) complexes of robust phosphites derived from calix[4]arenes and their application in the hydroformylation of 1-hexene","Journal of the Chemical Society, Dalton Transactions","2000","","7","1109","","10.1039/a908961f","","","0.71073","MoKα","","0.0869","0.0621","","0.1612","0.1352","","","","1.113","1.121","1.121","","","","","has coordinates,has disorder","179795","2020-10-21","18:00:00",""
"7009151","13.773","0.005","14.778","0.007","24.121","0.02","86.31","0.05","89.32","0.04","77.3","0.05","4779","5","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C93 H109 Cl11 O10 P2 Rh2 -","- C93 H109 Cl11 O10 P2 Rh2 -","- C186 H218 Cl22 O20 P4 Rh4 -","2","1","","Cobley, Christopher J.; Ellis, Dianne D.; Orpen, A. Guy; Pringle, Paul G.","Rhodium(I) complexes of robust phosphites derived from calix[4]arenes and their application in the hydroformylation of 1-hexene","Journal of the Chemical Society, Dalton Transactions","2000","","7","1109","","10.1039/a908961f","","","0.71073","MoKα","","0.251","0.1448","","0.362","0.2836","","","","1.537","1.742","1.742","","","","","has coordinates,has disorder","179795","2020-10-21","18:00:00",""
"7009152","8.5253","0.0012","9.4993","0.0017","25.999","0.004","90","","90","","90","","2105.5","0.6","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C22 H24 O3 P2 -","- C22 H24 O3 P2 -","- C88 H96 O12 P8 -","4","1","","Dianne D. Ellis; Gayle Harrison; A. Guy Orpen; Hirihattaya Phetmung; Paul G. Pringle; Johannes G. deVries; Henk Oevering","Platinum(II), palladium(II) and rhodium(I) complexes of o-, m- and p-Ph2PC6H4PO(OEt)2. PtCl2‒SnCl2 Hydroformylation catalysts modified with phosphonated triarylphosphines","J. Chem. Soc., Dalton Trans.","2000","","5","671","675","10.1039/a908963b","","","0.71073","MoKα","","0.0605","0.0485","","","0.1163","0.128","","","","","","1.085","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7009153","9.2995","0.001","11.724","0.0011","13.483","0.003","64.608","0.012","76.108","0.006","72.66","0.007","1256.9","0.4","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C50 H60 Cl2 O8 P4 Pt -","- C50 H60 Cl2 O8 P4 Pt -","- C50 H60 Cl2 O8 P4 Pt -","1","0.5","","Dianne D. Ellis; Gayle Harrison; A. Guy Orpen; Hirihattaya Phetmung; Paul G. Pringle; Johannes G. deVries; Henk Oevering","Platinum(II), palladium(II) and rhodium(I) complexes of o-, m- and p-Ph2PC6H4PO(OEt)2. PtCl2‒SnCl2 Hydroformylation catalysts modified with phosphonated triarylphosphines","J. Chem. Soc., Dalton Trans.","2000","","5","671","675","10.1039/a908963b","","","0.71073","MoKα","","0.0209","0.0203","","0.0451","0.0449","","","","0.999","1.007","1.007","","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009154","14.1615","0.0003","9.5735","0.0002","16.0291","0.0004","90","","90.905","0.002","90","","2172.88","0.08","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Tri(tert.butyl)gallium-triethylantimon-adduct","","- C18 H42 Ga Sb -","- C18 H42 Ga Sb -","- C72 H168 Ga4 Sb4 -","4","1","","Schulz, Stephan; Nieger, Martin","Synthesis and structural characterization of the first completely alkyl-substituted Ga‒Sb Lewis acid‒base adducts †","Journal of the Chemical Society, Dalton Transactions","2000","","5","639","","10.1039/a908969a","","","0.71073","MoKα","","0.0435","0.041","","","0.1127","0.114","","","","","","1.148","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009155","13.6128","0.0002","9.0089","0.0002","20.0307","0.0002","90","","91.75","0.001","90","","2455.35","0.07","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Tri(tert.butyl)gallium-tri(isopropyl)antimon-adduct","","- C21 H48 Ga Sb -","- C21 H48 Ga Sb -","- C84 H192 Ga4 Sb4 -","4","1","","Schulz, Stephan; Nieger, Martin","Synthesis and structural characterization of the first completely alkyl-substituted Ga‒Sb Lewis acid‒base adducts †","Journal of the Chemical Society, Dalton Transactions","2000","","5","639","","10.1039/a908969a","","","0.71073","MoKα","","0.0214","0.0198","","","0.0482","0.0488","","","","","","1.082","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009156","11.0292","0.0002","14.1653","0.0003","28.2016","0.0005","90","","101.015","0.001","90","","4324.82","0.14","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C45 H44 Cl2 F6 N2 P3 Rh -","- C45 H44 Cl2 F6 N2 P3 Rh -","- C180 H176 Cl8 F24 N8 P12 Rh4 -","4","1","","Bookham, Jonathan L.; Smithies, Darren M.; Pett, Mark Thornton","Dynamic coordinative exchange in rhodium(I) complexes of chiral diphosphines bearing pendant pyridyl donor groups","Journal of the Chemical Society, Dalton Transactions","2000","","6","975","","10.1039/a908984e","","","0.71073","MoKα","","0.0475","0.0433","","","0.1143","0.1178","","","","","","1.063","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009157","8.612","0.002","11.776","0.002","13.374","0.003","115.11","0.02","86.44","0.02","66.25","0.02","1078.8","0.5","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C19 H23 Cl N2 O2 Pt S2 -","- C19 H23 Cl N2 O2 Pt S2 -","- C38 H46 Cl2 N4 O4 Pt2 S4 -","2","1","","Sacht, Cheryl; Datt, Michael S.; Otto, Stefanus; Roodt, Andreas","Chiral and achiral platinum(II) complexes for potential use as chemotherapeutic agents: crystal and molecular structures of cis-[Pt(L1)2] and [Pt(L1)Cl(MPSO)] [HL1 = N,N-diethyl-N '-benzoylthiourea]","Journal of the Chemical Society, Dalton Transactions","2000","","5","727","","10.1039/a908985c","","","0.71073","MoKα","","0.062","0.0613","","0.1587","0.1535","","","","1.12","1.12","1.12","","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009158","9.926","0.002","12.265","0.003","21.168","0.005","90","","91","0.02","90","","2576.7","1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H30 N4 O2 Pt S2 -","- C24 H30 N4 O2 Pt S2 -","- C96 H120 N16 O8 Pt4 S8 -","4","1","","Sacht, Cheryl; Datt, Michael S.; Otto, Stefanus; Roodt, Andreas","Chiral and achiral platinum(II) complexes for potential use as chemotherapeutic agents: crystal and molecular structures of cis-[Pt(L1)2] and [Pt(L1)Cl(MPSO)] [HL1 = N,N-diethyl-N '-benzoylthiourea]","Journal of the Chemical Society, Dalton Transactions","2000","","5","727","","10.1039/a908985c","","","0.71073","MoKα","","0.0359","0.0355","","0.0925","0.0918","","","","1.13","1.13","1.13","","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009159","19.6398","","19.6398","","31.8342","0.0004","90","","90","","90","","12279.1","0.15","298","2","298","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","","","- C4 H12 In10 N S18 -","- C4 H12 In10 N S18 -","- C32 H96 In80 N8 S144 -","8","1","","Cahill, Christopher L.; Parise, J. B.","On the formation of framework indium sulfides","Journal of the Chemical Society, Dalton Transactions","2000","","9","1475","","10.1039/a909005c","","","0.71073","MoKα","","0.0655","0.0454","","0.074","0.071","","","","1.015","1.131","1.131","","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009160","11.7958","","11.7958","","47.0929","0.0002","90","","90","","90","","6552.55","0.03","298","2","298","2","","","","","","","","2","I 41/a m d :2","-I 4bd 2","141","","","","- In10 S18 -","- In10 S18 -","- In40 S72 -","4","0.125","","Cahill, Christopher L.; Parise, J. B.","On the formation of framework indium sulfides","Journal of the Chemical Society, Dalton Transactions","2000","","9","1475","","10.1039/a909005c","","","0.71073","MoKα","","0.0653","0.0453","","0.1254","0.1204","","","","0.947","1.118","1.118","","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009161","10.322","0.002","30.803","0.006","15.861","0.003","90","","105.75","0.03","90","","4853.6","1.8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H64 In4 N4 S10 -","- C12 H30 In4 N2 S10 -","- C48 H120 In16 N8 S40 -","4","0.5","","Cahill, Christopher L.; Parise, J. B.","On the formation of framework indium sulfides","Journal of the Chemical Society, Dalton Transactions","2000","","9","1475","","10.1039/a909005c","","","0.643","synchrotron","","0.1329","0.0812","","","0.2581","0.2703","","","","","","1.367","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009162","11.505","0.001","28.708","0.001","26.24","0.001","90","","101.95","0.01","90","","8478.9","0.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C52 H56 In9 N8 S17 -","- C52 H53 In9 N8 S17 -","- C208 H212 In36 N32 S68 -","4","1","","Cahill, Christopher L.; Parise, J. B.","On the formation of framework indium sulfides","Journal of the Chemical Society, Dalton Transactions","2000","","9","1475","","10.1039/a909005c","","","0.643","synchrotron","","0.0983","0.0611","","","0.1704","0.2163","","","","","","0.83","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009163","20.669","0.003","23.43","0.005","7.533","0.001","90","","104.61","0.01","90","","3530.1","1","296.2","","296.2","","","","","","","","","7","C 1 2/m 1","-C 2y","12","","","","- C50 H48 Cd2 F12 N12 O10 P2 -","- C50 H48 Cd2 F12 N12 O10 P2 -","- C100 H96 Cd4 F24 N24 O20 P4 -","2","0.25","","Dong, Yu-Bin; Smith, Mark D.; Layland, Ralph C.; zur Loye, Hans-Conrad","Novel hydrogen-bonded two- and three-dimensional networks generated from the reaction of metal nitrate hydrates (M = Cd, Co) with the bidentate linear ligand 4,4'-bipyridine","Journal of the Chemical Society, Dalton Transactions","2000","","5","775","","10.1039/a909014b","","","0.7107","MoKα","","0.0599","0.0599","","0.0822","","0.0822","","","2.437","","","2.437","","","","has coordinates","210357","2020-10-21","18:00:00",""
"7009164","17.918","0.002","11.397","0.001","23.071","0.002","90","","101.286","0.009","90","","4620.3","0.8","296.2","","296.2","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C40 H40 Co F12 N8 O4 P2 -","- C40 H40 Co F12 N8 O4 P2 -","- C160 H160 Co4 F48 N32 O16 P8 -","4","0.5","","Dong, Yu-Bin; Smith, Mark D.; Layland, Ralph C.; zur Loye, Hans-Conrad","Novel hydrogen-bonded two- and three-dimensional networks generated from the reaction of metal nitrate hydrates (M = Cd, Co) with the bidentate linear ligand 4,4'-bipyridine","Journal of the Chemical Society, Dalton Transactions","2000","","5","775","","10.1039/a909014b","","","0.7107","MoKα","","0.0519","0.0519","","0.0621","","0.0621","","","2.718","","","2.718","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009165","8.4837","0.0002","8.7611","0.0003","11.1271","0.0001","86.308","0.002","86.622","0.002","78.476","0.002","807.79","0.03","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H54 Cu2 N8 O14 -","- C18 H54 Cu2 N8 O14 -","- C18 H54 Cu2 N8 O14 -","1","0.5","","Zhang, Jian-Jun; Luo, Qin-Hui; Long, De-Liang; Chen, Jiu-Tong; Li, Feng-Mei; Liu, An-Dong","A superoxide dismutase mimic with high activity: crystal structure, solution equilibrium and pulse radiolysis","Journal of the Chemical Society, Dalton Transactions","2000","","12","1893","","10.1039/a909018e","","","0.71073","MoKα","","0.0566","0.0475","","0.1175","0.1121","","","","1.053","1.084","1.084","","","","","has coordinates","193981","2020-10-21","18:00:00",""
"7009166","9.495","0.002","15.506","0.003","26.159","0.005","90","","96.587","0.004","90","","3826","1.3","153","","153","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C45 H33 N6 Tl3 -","- C45 H33 N6 Tl3 -","- C180 H132 N24 Tl12 -","4","1","","Deacon, Glen B.; Delbridge, Ewan E.; Forsyth, Craig M.; Skelton, Brian W.; White, Allan H.","Novel pyrazolate coordination modes and unusual Tl · · · Tl or Tl-π-(phenyl) interactions in the crystal structures of [{Tl3(Ph2pz)3}n], [{Tl4(Ph2pz)4}n], [{Tl4(Ph2pz)3(OH)}2] and [{Tl4(MePhpz)3(OH)}n] (Ph2pz = 3,5-diphenylpyrazolate; MePhpz = 3-methyl-5-phenylpyrazolate)","Journal of the Chemical Society, Dalton Transactions","2000","","5","745","","10.1039/a909048g","","","0.71073","MoKα","","0.125","0.064","","0.076","","0.071","","","1.443","","","1.742","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009167","11.367","0.002","17.566","0.004","28.465","0.006","90","","93.37","0.03","90","","5674","2","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","[(3,5-diphenylpyrazolato)thallium(I)].1,2-dimethoxyethane","","- C64 H54 N8 O2 Tl4 -","- C64 H54 N8 O2 Tl4 -","- C256 H216 N32 O8 Tl16 -","4","1","","Deacon, Glen B.; Delbridge, Ewan E.; Forsyth, Craig M.; Skelton, Brian W.; White, Allan H.","Novel pyrazolate coordination modes and unusual Tl · · · Tl or Tl-π-(phenyl) interactions in the crystal structures of [{Tl3(Ph2pz)3}n], [{Tl4(Ph2pz)4}n], [{Tl4(Ph2pz)3(OH)}2] and [{Tl4(MePhpz)3(OH)}n] (Ph2pz = 3,5-diphenylpyrazolate; MePhpz = 3-methyl-5-phenylpyrazolate)","Journal of the Chemical Society, Dalton Transactions","2000","","5","745","","10.1039/a909048g","","","0.71073","MoKα","","0.0831","0.0549","","","0.1328","0.1439","","","","","","1.073","","","","has coordinates,has disorder","179795","2020-10-21","18:00:00",""
"7009168","13.851","0.002","21.533","0.004","14.721","0.003","90","","92.16","0.003","90","","4387.5","1.4","153","","153","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C92 H72 Cl4 N12 O2 Tl8 -","- C92 H72 Cl4 N12 O2 Tl8 -","- C184 H144 Cl8 N24 O4 Tl16 -","2","0.5","","Deacon, Glen B.; Delbridge, Ewan E.; Forsyth, Craig M.; Skelton, Brian W.; White, Allan H.","Novel pyrazolate coordination modes and unusual Tl · · · Tl or Tl-π-(phenyl) interactions in the crystal structures of [{Tl3(Ph2pz)3}n], [{Tl4(Ph2pz)4}n], [{Tl4(Ph2pz)3(OH)}2] and [{Tl4(MePhpz)3(OH)}n] (Ph2pz = 3,5-diphenylpyrazolate; MePhpz = 3-methyl-5-phenylpyrazolate)","Journal of the Chemical Society, Dalton Transactions","2000","","5","745","","10.1039/a909048g","","","0.71073","MoKα","","0.066","0.038","","0.047","","0.042","","","0.95","","","1.04","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009169","7.331","0.001","26.592","0.005","18.044","0.003","90","","97.516","0.003","90","","3487.4","1","153","","153","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C30.5 H29 Cl N6 O Tl4 -","- C30.5 H29 Cl N6 O Tl4 -","- C122 H116 Cl4 N24 O4 Tl16 -","4","1","","Deacon, Glen B.; Delbridge, Ewan E.; Forsyth, Craig M.; Skelton, Brian W.; White, Allan H.","Novel pyrazolate coordination modes and unusual Tl · · · Tl or Tl-π-(phenyl) interactions in the crystal structures of [{Tl3(Ph2pz)3}n], [{Tl4(Ph2pz)4}n], [{Tl4(Ph2pz)3(OH)}2] and [{Tl4(MePhpz)3(OH)}n] (Ph2pz = 3,5-diphenylpyrazolate; MePhpz = 3-methyl-5-phenylpyrazolate)","Journal of the Chemical Society, Dalton Transactions","2000","","5","745","","10.1039/a909048g","","","0.71073","MoKα","","0.094","0.067","","0.09","","0.087","","","1.782","","","1.936","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009170","10.594","0.005","18.425","0.006","28.12","0.005","90","","98.65","0.03","90","","5426","3","203","2","203","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C21 H21 I4 O3 P -","- C21 H21 I4 O3 P -","- C168 H168 I32 O24 P8 -","8","1","","Godfrey, Stephen M.; McAuliffe, Charles A.; Peaker, Andrew T.; Pritchard, Robin G.","The reaction of tertiary aryl phosphites with diiodine at ambient temperatures; structural characterisation of the tertiary phosphite tetraiodides (PhO)3PI4, (4-MeC6H4O)3PI4 and (2,4-But2C6H3O)3PI4","Journal of the Chemical Society, Dalton Transactions","2000","","8","1287","","10.1039/a909057f","","","0.71069","MoKα","","0.1373","0.0533","","","0.0684","0.0883","","","","","","0.956","","","","has coordinates","206958","2020-10-21","18:00:00",""
"7009171","11.763","0.001","19.565","0.002","21.003","0.002","90","","90","","90","","4833.7","0.8","203","2","203","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C42 H63 I4 O3 P -","- C42 H63 I4 O3 P -","- C168 H252 I16 O12 P4 -","4","1","","Godfrey, Stephen M.; McAuliffe, Charles A.; Peaker, Andrew T.; Pritchard, Robin G.","The reaction of tertiary aryl phosphites with diiodine at ambient temperatures; structural characterisation of the tertiary phosphite tetraiodides (PhO)3PI4, (4-MeC6H4O)3PI4 and (2,4-But2C6H3O)3PI4","Journal of the Chemical Society, Dalton Transactions","2000","","8","1287","","10.1039/a909057f","","","0.71073","MoKα","","0.1247","0.0646","","","0.1379","0.1681","","","","","","1.008","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009172","9.3386","0.001","10","0.002","24.168","0.002","90","","90","","90","","2257","0.5","203","2","203","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C18 H15 I4 O3 P -","- C18 H15 I4 O3 P -","- C72 H60 I16 O12 P4 -","4","1","","Godfrey, Stephen M.; McAuliffe, Charles A.; Peaker, Andrew T.; Pritchard, Robin G.","The reaction of tertiary aryl phosphites with diiodine at ambient temperatures; structural characterisation of the tertiary phosphite tetraiodides (PhO)3PI4, (4-MeC6H4O)3PI4 and (2,4-But2C6H3O)3PI4","Journal of the Chemical Society, Dalton Transactions","2000","","8","1287","","10.1039/a909057f","","","0.71069","MoKα","","0.0306","0.0285","","","0.0738","0.0766","","","","","","1.115","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009173","11.558","0.006","13.251","0.009","14.713","0.009","94.29","0.09","109.65","0.08","102.97","0.06","2040","3","298","","298","","","","","","","","","7","P -1","-P 1","2","","","","- C20 H48 Cl4 Gd N8 Na O24 -","- C20 H40 Cl4 Gd N8 Na O24 -","- C40 H80 Cl8 Gd2 N16 Na2 O48 -","2","1","","Bianchi, Antonio; Calabi, Luisella; Giorgi, Claudia; Losi, Pietro; Mariani, Palma; Paoli, Paola; Rossi, Patrizia; Valtancoli, Barbara; Virtuani, Mario","Thermodynamic and structural properties of Gd3+ complexes with functionalized macrocyclic ligands based upon 1,4,7,10-tetraazacyclododecane","Journal of the Chemical Society, Dalton Transactions","2000","","5","697","","10.1039/a909098c","","","0.71069","MoKα","","0.0574","0.0496","","0.139","0.1306","","","","1.051","1.053","1.053","","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009174","20.641","0.009","14.447","0.007","24.912","0.012","90","","90","","90","","7429","6","293","","293","","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C35 H41 Cu N5 O10.8675 -","- C35 H41 Cu N5 O10.87 -","- C280 H328 Cu8 N40 O86.96 -","8","1","","Atkinson, Ian M.; Chartres, Jy D.; Everett, Grover W.; Ji, Xue-Kui; Lindoy, Leonard F.; Matthews, Owen A.; Meehan, George V.; Skelton, Brian W.; Wei, Gang; White, Allan H.","Macrocyclic ligand design. Interaction of selected transition and post-transition metal ions with a new N2O2-donor macrocycle incorporating a pyridylmethyl pendant arm","Journal of the Chemical Society, Dalton Transactions","2000","","7","1191","","10.1039/a909102e","","","0.71073","MoKα","","0.142","0.07","","0.077","","0.066","","","1.705","","","1.934","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009175","18.303","0.002","11.177","0.001","15.94","0.002","90","","90.221","0.002","90","","3260.9","0.6","153","","153","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C35 H41 Ag N4 O5 -","- C35 H41 Ag N4 O5 -","- C140 H164 Ag4 N16 O20 -","4","1","","Atkinson, Ian M.; Chartres, Jy D.; Everett, Grover W.; Ji, Xue-Kui; Lindoy, Leonard F.; Matthews, Owen A.; Meehan, George V.; Skelton, Brian W.; Wei, Gang; White, Allan H.","Macrocyclic ligand design. Interaction of selected transition and post-transition metal ions with a new N2O2-donor macrocycle incorporating a pyridylmethyl pendant arm","Journal of the Chemical Society, Dalton Transactions","2000","","7","1191","","10.1039/a909102e","","","0.71073","MoKα","","0.106","0.049","","0.068","","0.046","","","1.363","","","1.224","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009176","26.494","0.0017","12.4426","0.0008","22.046","0.0014","90","","90","","90","","7267.6","0.8","293","","293","","","","","","","","","6","P c c n","-P 2ab 2ac","56","","","","- C35 H41 Cl N4 O9 Pb -","- C35 H41 Cl N4 O9 Pb -","- C280 H328 Cl8 N32 O72 Pb8 -","8","1","","Atkinson, Ian M.; Chartres, Jy D.; Everett, Grover W.; Ji, Xue-Kui; Lindoy, Leonard F.; Matthews, Owen A.; Meehan, George V.; Skelton, Brian W.; Wei, Gang; White, Allan H.","Macrocyclic ligand design. Interaction of selected transition and post-transition metal ions with a new N2O2-donor macrocycle incorporating a pyridylmethyl pendant arm","Journal of the Chemical Society, Dalton Transactions","2000","","7","1191","","10.1039/a909102e","","","0.71073","MoKα","","0.077","0.033","","0.045","","0.04","","","1.104","","","1.276","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009177","17.9","0.003","21.4197","0.0019","24.477","0.002","90","","90","","90","","9384.8","1.9","150","2","150","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C58 H67 O4 P -","- C58 H67 O4 P -","- C464 H536 O32 P8 -","8","1","","Parlevliet, Floris J.; Kiener, Christoph; Fraanje, Jan; Goubitz, Kees; Lutz, Martin; Spek, Anthony L.; Kamer, Paul C. J.; van Leeuwen, Piet W. N. M.","Calix[4]arene based monophosphites, identification of three conformations and their use in the rhodium-catalysed hydroformylation of 1-octene","Journal of the Chemical Society, Dalton Transactions","2000","","7","1113","","10.1039/a909103c","","","0.71073","MoKα","","0.1543","0.0755","","","0.1487","0.1798","","","","","","1.014","","","","has coordinates","288183","2023-12-08","14:43:00",""
"7009178","12.013","0.002","13.353","0.001","16.616","0.006","75.59","0.02","73.23","0.02","67.607","0.01","2330.3","1","223","","223","","","","","","","","see text","5","P -1","-P 1","2","","","","- C52 H61 Cl2 O4 P -","- C52 H61 Cl2 O4 P -","- C104 H122 Cl4 O8 P2 -","2","1","","Parlevliet, Floris J.; Kiener, Christoph; Fraanje, Jan; Goubitz, Kees; Lutz, Martin; Spek, Anthony L.; Kamer, Paul C. J.; van Leeuwen, Piet W. N. M.","Calix[4]arene based monophosphites, identification of three conformations and their use in the rhodium-catalysed hydroformylation of 1-octene","Journal of the Chemical Society, Dalton Transactions","2000","","7","1113","","10.1039/a909103c","","","1.5418","CuKα","","0.104","0.097","","","0.094","0.096","","","","","","0.801","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009179","10.6498","0.0001","21.2477","0.0002","24.3318","0.0003","90","","97.292","0.0005","90","","5461.36","0.1","190","2","190","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C60 H76 Fe N6 -","- C60 H76 Fe N6 -","- C240 H304 Fe4 N24 -","4","1","","Dawson, David M.; Walker, Dennis A.; Thornton-Pett, Mark; Bochmann, Manfred","Synthesis and reactivity of sterically hindered iminopyrrolato complexes of zirconium, iron, cobalt and nickel","Journal of the Chemical Society, Dalton Transactions","2000","","4","459","","10.1039/a909125d","","","0.71069","MoKα","","0.0496","0.0407","","","0.1051","0.1151","","","","","","1.027","","","","has coordinates,has disorder","179795","2020-10-21","18:00:00",""
"7009180","6.0799","0.0001","18.1845","0.0005","27.39","0.0007","90","","91.708","0.0014","90","","3026.89","0.12","190","2","190","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C32 H44 N3 O0.5 -","- C32 H44 N3 O0.5 -","- C128 H176 N12 O2 -","4","1","","Dawson, David M.; Walker, Dennis A.; Thornton-Pett, Mark; Bochmann, Manfred","Synthesis and reactivity of sterically hindered iminopyrrolato complexes of zirconium, iron, cobalt and nickel","Journal of the Chemical Society, Dalton Transactions","2000","","4","459","","10.1039/a909125d","","","0.71069","MoKα","","0.0727","0.06","","","0.194","0.2051","","","","","","1.601","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7009181","14.7035","0.0002","11.3266","0.0001","22.2836","0.0003","90","","97.813","0.0006","90","","3676.68","0.08","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C38 H54 N6 Zr -","- C38 H54 N6 Zr -","- C152 H216 N24 Zr4 -","4","1","","Dawson, David M.; Walker, Dennis A.; Thornton-Pett, Mark; Bochmann, Manfred","Synthesis and reactivity of sterically hindered iminopyrrolato complexes of zirconium, iron, cobalt and nickel","Journal of the Chemical Society, Dalton Transactions","2000","","4","459","","10.1039/a909125d","","","0.71073","MoKα","","0.0386","0.0355","","","0.093","0.0953","","","","","","1.055","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009182","13.5477","0.0001","16.4563","0.0001","18.0523","0.0001","90","","109.536","0.0004","90","","3792.98","0.04","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C36 H56 N6 Zr -","- C36 H56 N6 Zr -","- C144 H224 N24 Zr4 -","4","1","","Dawson, David M.; Walker, Dennis A.; Thornton-Pett, Mark; Bochmann, Manfred","Synthesis and reactivity of sterically hindered iminopyrrolato complexes of zirconium, iron, cobalt and nickel","Journal of the Chemical Society, Dalton Transactions","2000","","4","459","","10.1039/a909125d","","","0.71073","MoKα","","0.0255","0.024","","","0.0616","0.0632","","","","","","1.036","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009183","13.1768","0.0021","7.7443","0.0007","21.4713","0.0016","90","","105.38","0.01","90","","2112.6","0.4","293","","293","","","","","","","","?","4","P 1 21 1","P 2yb","4","","","","- C25 H27 N3 O -","- C25 H27 N3 O -","- C100 H108 N12 O4 -","4","2","","Baum, Gerhard; Constable, Edwin C.; Fenske, Dieter; Housecroft, Catherine E.; Kulke, Torsten; Neuburger, Markus; Zehnder, Margareta","Regio- and diastereo-selective formation of dicopper(I) and disilver(I) double helicates with chiral 6-substituted 2,2'∶6',2″-terpyridines","Journal of the Chemical Society, Dalton Transactions","2000","","6","945","","10.1039/a909158k","","","1.5418","CuKα","","","0.0651","","","0.0786","","","","","0.8879","0.8879","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009184","13.19","0.002","7.75","0.001","21.469","0.001","90","","105.39","0.007","90","","2115.9","0.4","293","","293","","","","","","","","?","4","P 1 21 1","P 2yb","4","","","","- C25 H27 N3 O -","- C25 H27 N3 O -","- C100 H108 N12 O4 -","4","2","","Baum, Gerhard; Constable, Edwin C.; Fenske, Dieter; Housecroft, Catherine E.; Kulke, Torsten; Neuburger, Markus; Zehnder, Margareta","Regio- and diastereo-selective formation of dicopper(I) and disilver(I) double helicates with chiral 6-substituted 2,2'∶6',2″-terpyridines","Journal of the Chemical Society, Dalton Transactions","2000","","6","945","","10.1039/a909158k","","","1.5418","CuKα","","","0.0544","","","0.0652","","","","","0.758","0.758","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009185","6.929","0.002","10.696","0.001","29.978","0.004","90","","92.81","0.01","90","","2219.1","0.7","293","","293","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C26 H29 N3 O -","- C26 H29 N3 O -","- C104 H116 N12 O4 -","4","2","","Baum, Gerhard; Constable, Edwin C.; Fenske, Dieter; Housecroft, Catherine E.; Kulke, Torsten; Neuburger, Markus; Zehnder, Margareta","Regio- and diastereo-selective formation of dicopper(I) and disilver(I) double helicates with chiral 6-substituted 2,2'∶6',2″-terpyridines","Journal of the Chemical Society, Dalton Transactions","2000","","6","945","","10.1039/a909158k","","","1.5418","CuKα","","","0.0469","","","0.0552","","","","","0.8702","0.8702","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7009186","24.641","0.007","12.669","0.002","8.39","0.003","90","","95.59","0.03","90","","2606.7","1.3","203","2","203","2","","","","","","","","7","C 1 2 1","C 2y","5","","","","- C52 H58 Ag2 F12 N6 O2 P2 -","- C52 H58 Ag2 F12 N6 O2 P2 -","- C104 H116 Ag4 F24 N12 O4 P4 -","2","0.5","","Baum, Gerhard; Constable, Edwin C.; Fenske, Dieter; Housecroft, Catherine E.; Kulke, Torsten; Neuburger, Markus; Zehnder, Margareta","Regio- and diastereo-selective formation of dicopper(I) and disilver(I) double helicates with chiral 6-substituted 2,2'∶6',2″-terpyridines","Journal of the Chemical Society, Dalton Transactions","2000","","6","945","","10.1039/a909158k","","","0.71073","MoKa","","0.0257","0.0253","","0.0702","0.0687","","","","1.065","1.048","1.048","","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009187","61.445","0.013","10.441","0.001","29.371","0.01","90","","101.45","0.01","90","","18468","8","193","2","193","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H40 Cl2 Ga2 N4 -","- C20 H40 Cl2 Ga2 N4 -","- C560 H1120 Cl56 Ga56 N112 -","28","3.5","","Schmidt, Eva Susanne; Jockisch, Alexander; Schmidbaur, Hubert","Isomerism of dimeric cis-ethene-1,2-di(alkylamido)gallium hydrides and chlorides","Journal of the Chemical Society, Dalton Transactions","2000","","7","1039","","10.1039/a909198j","","","0.71073","MoKα","","0.1172","0.0615","","","0.1286","0.1436","","","","","","1.056","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009188","8.14","0.002","8.639","0.002","10.674","0.002","82.15","0.02","89.32","0.02","81.16","0.02","734.7","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H48 Cl2 Ga2 N4 -","- C28 H48 Cl2 Ga2 N4 -","- C28 H48 Cl2 Ga2 N4 -","1","0.5","","Schmidt, Eva Susanne; Jockisch, Alexander; Schmidbaur, Hubert","Isomerism of dimeric cis-ethene-1,2-di(alkylamido)gallium hydrides and chlorides","Journal of the Chemical Society, Dalton Transactions","2000","","7","1039","","10.1039/a909198j","","","0.71073","MoKα","","0.0388","0.0295","","","0.0741","0.0781","","","","","","1.053","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009189","10.077","0.002","9.818","0.001","12.304","0.002","90","","100.16","0.01","90","","1198.2","0.3","143","2","143","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H42 Ga2 N4 -","- C20 H42 Ga2 N4 -","- C40 H84 Ga4 N8 -","2","0.5","","Schmidt, Eva Susanne; Jockisch, Alexander; Schmidbaur, Hubert","Isomerism of dimeric cis-ethene-1,2-di(alkylamido)gallium hydrides and chlorides","Journal of the Chemical Society, Dalton Transactions","2000","","7","1039","","10.1039/a909198j","","","0.71073","MoKα","","0.0543","0.0301","","","0.071","0.077","","","","","","1.065","","","","has coordinates,has disorder","179795","2020-10-21","18:00:00",""
"7009190","17.75","0.02","18.316","0.019","20.84","0.02","90","","113.514","0.01","90","","6213","11","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C32 H32 Cl Cu N4 O4 -","- C32 H32 Cl Cu N4 O4 -","- C256 H256 Cl8 Cu8 N32 O32 -","8","1","","Chowdhury, Shubhamoy; Patra, Goutam K.; Drew, Michael G. B.; Chattopadhyay, Nitin; Datta, Dipankar","New photoluminescent CuIN4 chromophores. Stabilisation of copper(I) by unconjugated diimines","Journal of the Chemical Society, Dalton Transactions","2000","","3","235","","10.1039/a909224b","","","0.71073","MoKα","","0.1736","0.0731","","","0.1871","0.2193","","","","","","0.785","","","","has coordinates,has disorder","179795","2020-10-21","18:00:00",""
"7009191","15.446","0.017","13.27","0.015","23.7","0.03","90","","91.579","0.01","90","","4856","10","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C56 H48 Cl Cu N4 O4 -","- C56 H48 Cl Cu N4 O4 -","- C224 H192 Cl4 Cu4 N16 O16 -","4","1","","Chowdhury, Shubhamoy; Patra, Goutam K.; Drew, Michael G. B.; Chattopadhyay, Nitin; Datta, Dipankar","New photoluminescent CuIN4 chromophores. Stabilisation of copper(I) by unconjugated diimines","Journal of the Chemical Society, Dalton Transactions","2000","","3","235","","10.1039/a909224b","","","0.71073","MoKα","","0.154","0.0837","","","0.1515","0.1733","","","","","","1.119","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009192","10.828","0.001","25.14","0.003","26.674","0.003","90","","98.304","0.002","90","","7185","1.4","203","2","203","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H53 Ge N3 Se2 Si2 -","- C32 H53 Ge N3 Se2 Si2 -","- C256 H424 Ge8 N24 Se16 Si16 -","8","2","","Foley, Stephen R.; Yap, Glenn P. A.; Richeson, Darrin S.","Oxidative addition to M(II) (M = Ge, Sn) amidinate complexes: routes to group 14 chalcogenolates with hypervalent coordination environments","Journal of the Chemical Society, Dalton Transactions","2000","","10","1663","","10.1039/a909228e","","","0.71073","MoKα","","0.0785","0.0366","","","0.061","0.0641","","","","","","1.006","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009193","13.234","0.002","15.834","0.002","19.023","0.002","88.728","0.002","80.465","0.002","67.232","0.002","3621","0.8","203","2","203","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H53 N3 S2 Si2 Sn -","- C32 H53 N3 S2 Si2 Sn -","- C128 H212 N12 S8 Si8 Sn4 -","4","2","","Foley, Stephen R.; Yap, Glenn P. A.; Richeson, Darrin S.","Oxidative addition to M(II) (M = Ge, Sn) amidinate complexes: routes to group 14 chalcogenolates with hypervalent coordination environments","Journal of the Chemical Society, Dalton Transactions","2000","","10","1663","","10.1039/a909228e","","","0.71073","MoKα","","0.0758","0.0393","","","0.0791","0.0867","","","","","","1.002","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009194","10.953","0.002","19.181","0.004","18.909","0.004","90","","94.72","0.03","90","","3959.1","1.4","163","2","163","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H60 Ge N4 Se2 -","- C40 H60 Ge N4 Se2 -","- C160 H240 Ge4 N16 Se8 -","4","1","","Foley, Stephen R.; Yap, Glenn P. A.; Richeson, Darrin S.","Oxidative addition to M(II) (M = Ge, Sn) amidinate complexes: routes to group 14 chalcogenolates with hypervalent coordination environments","Journal of the Chemical Society, Dalton Transactions","2000","","10","1663","","10.1039/a909228e","","","0.71073","MoKα","","0.077","0.0708","","","0.1931","0.1997","","","","","","1.013","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009195","16.457","0.003","18.945","0.003","18.671","0.003","90","","101.39","0.01","90","","5706.6","1.7","296.2","","296.2","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C24 H24 Cl Cr N4 Pt S4 -","- C24 H24 Cl Cr N4 Pt S4 -","- C192 H192 Cl8 Cr8 N32 Pt8 S32 -","8","2","","Ken'ichi Kitano; Rika Tanaka; Takahiro Kimura; Toshiyuki Tsuda; Seiji Shimizu; Hideaki Takagi; Takanori Nishioka; Daisuke Shiomi; Akio Ichimura; Isamu Kinoshita; Kiyoshi Isobe; Shun'ichiro Ooi","Lantern-type dinuclear CrIIIPtII and VIVPtII complexes bridged by pyridine-2-thiolate. Synthesis and characterization","J. Chem. Soc., Dalton Trans.","2000","","6","995","1000","10.1039/a909241b","","","0.7107","MoKα","","","0.0473","","","0.0546","","","","","1.234","1.234","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009196","14.929","0.005","14.9289","","14.32","0.007","90","","90","","90","","3191.5","1.9","296.2","","296.2","","","","","","","","","7","P 4/n c c :2","-P 4a 2ac","130","","","","- C28 H31 Cr N6 O Pt S4 -","- C26 H24 Cr0.25 N5 O0.25 Pt0.25 S4 -","- C104 H96 Cr N20 O Pt S16 -","4","0.25","","Ken'ichi Kitano; Rika Tanaka; Takahiro Kimura; Toshiyuki Tsuda; Seiji Shimizu; Hideaki Takagi; Takanori Nishioka; Daisuke Shiomi; Akio Ichimura; Isamu Kinoshita; Kiyoshi Isobe; Shun'ichiro Ooi","Lantern-type dinuclear CrIIIPtII and VIVPtII complexes bridged by pyridine-2-thiolate. Synthesis and characterization","J. Chem. Soc., Dalton Trans.","2000","","6","995","1000","10.1039/a909241b","","","0.7107","MoKα","","","0.034","","","0.0479","","","","","1.635","1.635","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009197","15.35","0.002","15.35","0.002","14.27","0.003","90","","90","","90","","3362.3","0.9","296.2","","296.2","","","","","","","","","7","P 4/n c c :2","-P 4a 2ac","130","","","","- C24 H24 N4 O Pt S4 V -","- C24 H24 N4 O0.25 Pt0.25 S4 V0.25 -","- C96 H96 N16 O Pt S16 V -","4","0.25","","Ken'ichi Kitano; Rika Tanaka; Takahiro Kimura; Toshiyuki Tsuda; Seiji Shimizu; Hideaki Takagi; Takanori Nishioka; Daisuke Shiomi; Akio Ichimura; Isamu Kinoshita; Kiyoshi Isobe; Shun'ichiro Ooi","Lantern-type dinuclear CrIIIPtII and VIVPtII complexes bridged by pyridine-2-thiolate. Synthesis and characterization","J. Chem. Soc., Dalton Trans.","2000","","6","995","1000","10.1039/a909241b","","","0.7107","MoKα","","","0.0616","","","0.1022","","","","","2.891","2.891","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009198","18.7732","0.0008","18.7732","0.0008","9.4537","0.0005","90","","90","","90","","3331.8","0.3","298","2","298","2","","","","","","","-","6","P 4/n :2","-P 4a","85","Mg-STA-7","","","- C3.38 H8.62 Al3 N1.12 O12.38 P3 -","- C3.6 Al3 N O12.375 P3 -","- C28.8 Al24 N8 O99 P24 -","8","1","","Wright, Paul A.; Maple, Martin J.; Slawin, Alexandra M. Z.; Patinec, Véronique; Aitken, R. Alan; Welsh, Simon; Cox, Paul A.","Cation-directed syntheses of novel zeolite-like metalloaluminophosphates STA-6 and STA-7 in the presence of azamacrocycle templates","Journal of the Chemical Society, Dalton Transactions","2000","","8","1243","","10.1039/a909249h","","","0.71073","MoK?","","0.0966","0.0539","","0.2303","0.1422","","","","0.806","0.828","0.828","","","","","has coordinates","179795","2020-10-21","18:00:00",""
"7009199","18.74","0.005","18.74","","9.439","0.007","90","","90","","90","","3315","3","293","2","293","2","","","","","","","-","7","P 4/n :2","-P 4a","85","","","","- C1.75 H5.5 Al2.1 Co0.9 N0.5 O12.75 P3 -","- C1.82 Al2.1 Co0.9 N0.52 O12.75 P3 -","- C14.56 Al16.8 Co7.2 N4.16 O102 P24 -","8","1","","Wright, Paul A.; Maple, Martin J.; Slawin, Alexandra M. Z.; Patinec, Véronique; Aitken, R. Alan; Welsh, Simon; Cox, Paul A.","Cation-directed syntheses of novel zeolite-like metalloaluminophosphates STA-6 and STA-7 in the presence of azamacrocycle templates","Journal of the Chemical Society, Dalton Transactions","2000","","8","1243","","10.1039/a909249h","","","1.54178","CuKα","","0.2029","0.1169","","0.4409","0.3134","","","","1.057","1.203","1.203","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009200","18.691","0.002","18.691","0.002","9.423","0.001","90","","90","","90","","3292","0.6","150","2","150","2","","","","","","","","7","P 4/n :2","-P 4a","85","","","","- C1.75 H5 Al2.4 N0.5 O12.5 P3 Zn0.6 -","- C1.82 Al2.4 N0.52 O12.5 P3 Zn0.6 -","- C14.56 Al19.2 N4.16 O100 P24 Zn4.8 -","8","1","","Wright, Paul A.; Maple, Martin J.; Slawin, Alexandra M. Z.; Patinec, Véronique; Aitken, R. Alan; Welsh, Simon; Cox, Paul A.","Cation-directed syntheses of novel zeolite-like metalloaluminophosphates STA-6 and STA-7 in the presence of azamacrocycle templates","Journal of the Chemical Society, Dalton Transactions","2000","","8","1243","","10.1039/a909249h","","","0.6884","synchrotron","","0.1189","0.0912","","0.2595","0.2203","","","","1.234","1.311","1.311","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009201","14.5319","0.0002","20.0832","0.0002","29.2213","0.0003","83.434","0.001","88.522","0.001","83.281","0.001","8413.36","0.17","293","2","293","2","","","","","","","","9","P -1","-P 1","2","","","","- C82 H68 Cl F6 N2 P5 Pt2 S2 Zn -","- C82 H68 Cl F6 N2 P5 Pt2 S2 Zn -","- C328 H272 Cl4 F24 N8 P20 Pt8 S8 Zn4 -","4","2","","Li, Zhaohui; Loh, Zhi-Heng; Audi Fong, S.-W.; Yan, Yaw-Kai; Henderson, William; Mok, K. F.; Hor, T. S. Andy","Ligand-stabilization of an unusual square-based pyramidal geometry of Cd(II) and Zn(II) in an heterometallic {MPt2S2} core (M = Cd, Zn)","Journal of the Chemical Society, Dalton Transactions","2000","","7","1027","","10.1039/a909254d","","","0.71073","MoKα","","0.0753","0.0508","","","0.1345","0.1477","","","","","","1.054","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009202","14.5256","0.0005","20.1188","0.0007","29.3002","0.0011","83.11","0.001","88.39","0.001","82.842","0.001","8433.8","0.5","293","2","293","2","","","","","","","","9","P -1","-P 1","2","","","","- C82 H68 Cd Cl F6 N2 P5 Pt2 S2 -","- C82 H68 Cd Cl F6 N2 P5 Pt2 S2 -","- C328 H272 Cd4 Cl4 F24 N8 P20 Pt8 S8 -","4","2","","Li, Zhaohui; Loh, Zhi-Heng; Audi Fong, S.-W.; Yan, Yaw-Kai; Henderson, William; Mok, K. F.; Hor, T. S. Andy","Ligand-stabilization of an unusual square-based pyramidal geometry of Cd(II) and Zn(II) in an heterometallic {MPt2S2} core (M = Cd, Zn)","Journal of the Chemical Society, Dalton Transactions","2000","","7","1027","","10.1039/a909254d","","","0.71073","MoKα","","0.0592","0.0417","","","0.1191","0.1301","","","","","","1.084","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009203","19.289","0.004","15.548","0.002","20.389","0.004","90","","90","","90","","6114.8","1.9","150","","150","","","","","","","","?","6","P c a 21","P 2c -2ac","29","","","","- C22 H41 Cl4 N2 Si2 Ta -","- C22 H41 Cl4 N2 Si2 Ta -","- C176 H328 Cl32 N16 Si16 Ta8 -","8","2","","Chen, Chi-Tien; Doerrer, Linda H.; Williams, V. Cliff; Green, Malcolm L. H.","Niobium- and tantalum-benzamidinato complexes with trimethylphosphine, imido, or η-cyclopentadienyl derivatives","Journal of the Chemical Society, Dalton Transactions","2000","","6","967","","10.1039/a909333h","","","0.71069","MoKα","","","0.0243","","","0.0281","","","","","1.0262","1.0262","","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009204","12.722","0.004","10.598","0.002","15.931","0.004","90","","97.829","0.006","90","","2127.9","0.9","125","","125","","","","","","","","?","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H23 Cl5 N Ta -","- C16 H23 Cl5 N Ta -","- C64 H92 Cl20 N4 Ta4 -","4","1","","Chen, Chi-Tien; Doerrer, Linda H.; Williams, V. Cliff; Green, Malcolm L. H.","Niobium- and tantalum-benzamidinato complexes with trimethylphosphine, imido, or η-cyclopentadienyl derivatives","Journal of the Chemical Society, Dalton Transactions","2000","","6","967","","10.1039/a909333h","","","0.71069","MoKα","","","0.0237","","","","0.0257","","","","","","1.0157","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009205","18.388","0.004","10.256","0.002","18.799","0.007","90","","96.701","0.006","90","","3521","1.7","270","","270","","","","","","","","?","7","P 1 21/c 1","-P 2ybc","14","","","","- C25 H50 Cl4 N2 Nb P Si2 -","- C25 H50 Cl4 N2 Nb P Si2 -","- C100 H200 Cl16 N8 Nb4 P4 Si8 -","4","1","","Chen, Chi-Tien; Doerrer, Linda H.; Williams, V. Cliff; Green, Malcolm L. H.","Niobium- and tantalum-benzamidinato complexes with trimethylphosphine, imido, or η-cyclopentadienyl derivatives","Journal of the Chemical Society, Dalton Transactions","2000","","6","967","","10.1039/a909333h","","","0.71069","MoKα","","","0.0523","","","","0.0537","","","","","","1.0611","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009206","16.852","0.005","15.111","0.004","13.049","0.002","90","","75.653","0.005","90","","3219.3","1.4","125","","125","","","","","","","","?","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H46 Cl3 N2 Si2 Ta -","- C27 H46 Cl3 N2 Si2 Ta -","- C108 H184 Cl12 N8 Si8 Ta4 -","4","1","","Chen, Chi-Tien; Doerrer, Linda H.; Williams, V. Cliff; Green, Malcolm L. H.","Niobium- and tantalum-benzamidinato complexes with trimethylphosphine, imido, or η-cyclopentadienyl derivatives","Journal of the Chemical Society, Dalton Transactions","2000","","6","967","","10.1039/a909333h","","","0.71073","MoKα","","","0.029","","","0.0316","","","","","0.9904","0.9904","","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009207","17.847","0.004","9.386","0.002","27.936","0.006","90","","101.44","0.03","90","","4586.6","1.8","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C30 H40 As4 Cl F6 N2 P Ru -","- C30 H40 As4 Cl F6 N2 P Ru -","- C120 H160 As16 Cl4 F24 N8 P4 Ru4 -","4","1","","Coe, Benjamin J.; Beyer, Tim; Jeffery, John C.; Coles, Simon J.; Gelbrich, Thomas; Hursthouse, Michael B.; Light, Mark E.","A spectroscopic, electrochemical and structural study of polarizable, dipolar ruthenium(II) arsine complexes as models for chromophores with large quadratic non-linear optical responses","Journal of the Chemical Society, Dalton Transactions","2000","","5","797","","10.1039/a909336b","","","0.71073","MoKα","","0.1257","0.0727","","","0.1663","0.1881","","","","","","1.01","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009208","15.2797","0.0005","17.1152","0.0006","19.3725","0.0006","90","","111.127","0.002","90","","4725.7","0.3","150","2","150","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C38 H48 As4 Cl F12 N3 P2 Ru -","- C38 H48 As4 Cl F12 N3 P2 Ru -","- C152 H192 As16 Cl4 F48 N12 P8 Ru4 -","4","1","","Coe, Benjamin J.; Beyer, Tim; Jeffery, John C.; Coles, Simon J.; Gelbrich, Thomas; Hursthouse, Michael B.; Light, Mark E.","A spectroscopic, electrochemical and structural study of polarizable, dipolar ruthenium(II) arsine complexes as models for chromophores with large quadratic non-linear optical responses","Journal of the Chemical Society, Dalton Transactions","2000","","5","797","","10.1039/a909336b","","","0.71073","MoKα","","0.0976","0.0464","","","0.0903","0.1011","","","","","","0.926","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009209","14.519","0.003","22.552","0.005","16.361","0.003","90","","90","","90","","5357.1","1.9","150","2","150","2","","","","","","","","9","P n a 21","P 2c -2n","33","","","","- C41 H53 As4 Cl F12 N2 O2 P2 Ru -","- C41 H53 As4 Cl F12 N2 O2 P2 Ru -","- C164 H212 As16 Cl4 F48 N8 O8 P8 Ru4 -","4","1","","Coe, Benjamin J.; Beyer, Tim; Jeffery, John C.; Coles, Simon J.; Gelbrich, Thomas; Hursthouse, Michael B.; Light, Mark E.","A spectroscopic, electrochemical and structural study of polarizable, dipolar ruthenium(II) arsine complexes as models for chromophores with large quadratic non-linear optical responses","Journal of the Chemical Society, Dalton Transactions","2000","","5","797","","10.1039/a909336b","","","0.71073","MoKα","","0.1323","0.0547","","","0.1143","0.1498","","","","","","0.771","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009210","12.1453","0.0004","13.7579","0.0004","15.7162","0.0005","108.745","0.002","95.169","0.002","90.339","0.002","2474.98","0.14","150","2","150","2","","","","","","","","9","P -1","-P 1","2","","","","- C38 H46 As4 Cl F12 N5 O4 P2 Ru -","- C38 H46 As4 Cl F12 N5 O4 P2 Ru -","- C76 H92 As8 Cl2 F24 N10 O8 P4 Ru2 -","2","1","","Coe, Benjamin J.; Beyer, Tim; Jeffery, John C.; Coles, Simon J.; Gelbrich, Thomas; Hursthouse, Michael B.; Light, Mark E.","A spectroscopic, electrochemical and structural study of polarizable, dipolar ruthenium(II) arsine complexes as models for chromophores with large quadratic non-linear optical responses","Journal of the Chemical Society, Dalton Transactions","2000","","5","797","","10.1039/a909336b","","","0.71073","MoKα","","0.0871","0.0459","","","0.0965","0.107","","","","","","0.947","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009211","20.2099","0.0008","9.1355","0.0005","25.8443","0.0012","90","","110.886","0.003","90","","4458","0.4","150","2","150","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C34 H43 As4 Cl F12 N4 P2 Ru -","- C34 H43 As4 Cl F12 N4 P2 Ru -","- C136 H172 As16 Cl4 F48 N16 P8 Ru4 -","4","1","","Coe, Benjamin J.; Beyer, Tim; Jeffery, John C.; Coles, Simon J.; Gelbrich, Thomas; Hursthouse, Michael B.; Light, Mark E.","A spectroscopic, electrochemical and structural study of polarizable, dipolar ruthenium(II) arsine complexes as models for chromophores with large quadratic non-linear optical responses","Journal of the Chemical Society, Dalton Transactions","2000","","5","797","","10.1039/a909336b","","","0.71073","MoKα","","0.1885","0.1238","","","0.3157","0.3401","","","","","","1.094","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009212","9.926","0.004","13.005","0.003","14.224","0.004","90","","122.61","0.02","90","","1546.7","0.9","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H12 As2 Cl2 N4 -","- C12 H12 As2 Cl2 N4 -","- C48 H48 As8 Cl8 N16 -","4","1","","Raston, Colin L.; Skelton, Brian W.; Tolhurst, Vicki-Anne; White, Allan H.","Geminal arsa(III)amide and trisubstituted antimony and bismuth amides from the sterically hindered, N-functionalised amido ligand [{2-(6-Me)C5H3N}NSiMe3]−","Journal of the Chemical Society, Dalton Transactions","2000","","8","1279","","10.1039/a909338i","","","0.71073","MoKα","","0.101","0.055","","0.055","","0.051","","","1.67","","","2.01","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7009213","14.912","0.005","11.812","0.004","11.389","0.004","116.11","0.02","94.03","0.03","104.73","0.02","1703.4","1.1","293","","293","","","","","","","","","5","P -1","-P 1","2","","","","- C27 H45 Bi N6 Si3 -","- C27 H45 Bi N6 Si3 -","- C54 H90 Bi2 N12 Si6 -","2","1","","Raston, Colin L.; Skelton, Brian W.; Tolhurst, Vicki-Anne; White, Allan H.","Geminal arsa(III)amide and trisubstituted antimony and bismuth amides from the sterically hindered, N-functionalised amido ligand [{2-(6-Me)C5H3N}NSiMe3]−","Journal of the Chemical Society, Dalton Transactions","2000","","8","1279","","10.1039/a909338i","","","0.71073","MoKα","","0.049","0.038","","0.039","","0.038","","","1.392","","","1.45","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009214","10.608","0.006","8.296","0.003","8.073","0.004","78.75","0.03","68.12","0.04","68.91","0.04","613.6","0.6","293","","293","","","","","","","","","5","P -1","-P 1","2","","","","- C6 H6 As2 Cl4 N2 -","- C6 H6 As2 Cl4 N2 -","- C12 H12 As4 Cl8 N4 -","2","1","","Raston, Colin L.; Skelton, Brian W.; Tolhurst, Vicki-Anne; White, Allan H.","Geminal arsa(III)amide and trisubstituted antimony and bismuth amides from the sterically hindered, N-functionalised amido ligand [{2-(6-Me)C5H3N}NSiMe3]−","Journal of the Chemical Society, Dalton Transactions","2000","","8","1279","","10.1039/a909338i","","","0.71073","MoKα","","0.081","0.044","","0.064","","0.051","","","0.996","","","0.99","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009215","14.865","0.006","11.682","0.017","11.296","0.01","116.13","0.09","94.04","0.05","104.01","0.07","1673","3","293","","293","","","","","","","","","5","P -1","-P 1","2","","","","- C27 H45 N6 Sb Si3 -","- C27 H45 N6 Sb Si3 -","- C54 H90 N12 Sb2 Si6 -","2","1","","Raston, Colin L.; Skelton, Brian W.; Tolhurst, Vicki-Anne; White, Allan H.","Geminal arsa(III)amide and trisubstituted antimony and bismuth amides from the sterically hindered, N-functionalised amido ligand [{2-(6-Me)C5H3N}NSiMe3]−","Journal of the Chemical Society, Dalton Transactions","2000","","8","1279","","10.1039/a909338i","","","0.71073","Mo-Kα","","0.028","0.025","","0.032","","0.032","","","1.378","","","1.458","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009216","17.1111","0.0007","18.1222","0.0007","13.4364","0.0005","90","","90","","90","","4166.5","0.3","297","2","297","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C19.6 H48.4 Br2 Cu N18.8 O14 -","- C19.6 H48.4 Br2 Cu N18.8 O14 -","- C78.4 H193.6 Br8 Cu4 N75.2 O56 -","4","1","","Bishop, Michael M.; Lindoy, Leonard F.; Mahadev, Srihari; Turner, Peter","Modification of supramolecular motifs: perturbation of the structure of an extended hydrogen-bonded biuret array by interaction with an intercalated copper complex and methanol molecules †","Journal of the Chemical Society, Dalton Transactions","2000","","3","233","","10.1039/a909359a","","","0.71073","MoKα","","0.0531","0.0378","","","0.091","0.0986","","","","","","1.027","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009217","15.015","0.003","10.748","0.002","29.927","0.006","90","","103.12","0.03","90","","4703.6","1.7","190","1","190","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C45 H63 Fe3 O6 Sb -","- C45 H63 Fe3 O6 Sb -","- C180 H252 Fe12 O24 Sb4 -","4","1","","Gröer, Thomas; Scheer, Manfred","Structure and reactivity of transition metal substituted dichloroantimony and dichlorobismuth complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","5","647","","10.1039/a909394j","","","0.71073","MoKα","","0.0765","0.0475","","","0.1086","0.1298","","","","","","1.048","","","","has coordinates,has disorder","179796","2020-10-21","18:00:00",""
"7009218","20.936","0.003","20.936","0.003","8.8426","0.0018","90","","90","","90","","3875.9","1.1","200","1","200","1","","","","","","","","6","I -4","I -4","82","","","","- C15 H21 Bi Cl2 Fe O2 -","- C15 H21 Bi Cl2 Fe O2 -","- C120 H168 Bi8 Cl16 Fe8 O16 -","8","1","","Gröer, Thomas; Scheer, Manfred","Structure and reactivity of transition metal substituted dichloroantimony and dichlorobismuth complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","5","647","","10.1039/a909394j","","","0.71073","MoKα","","0.0383","0.0306","","","0.0648","0.0666","","","","","","0.958","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009219","6.9597","0.0014","13.363","0.003","15.702","0.003","73.79","0.03","89.82","0.03","88.65","0.03","1401.9","0.5","200","1","200","1","","","","","","","","5","P -1","-P 1","2","","","","- C28 H31 Fe3 O5 Sb -","- C28 H31 Fe3 O5 Sb -","- C56 H62 Fe6 O10 Sb2 -","2","1","","Gröer, Thomas; Scheer, Manfred","Structure and reactivity of transition metal substituted dichloroantimony and dichlorobismuth complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","5","647","","10.1039/a909394j","","","0.71073","MoKα","","0.0479","0.0334","","","0.0823","0.1027","","","","","","1.052","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009220","11.919","0.002","10.089","0.002","15.006","0.003","90","","94.68","0.03","90","","1798.5","0.6","200","1","200","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C15 H21 Cl2 Fe O2 Sb -","- C15 H21 Cl2 Fe O2 Sb -","- C60 H84 Cl8 Fe4 O8 Sb4 -","4","1","","Gröer, Thomas; Scheer, Manfred","Structure and reactivity of transition metal substituted dichloroantimony and dichlorobismuth complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","5","647","","10.1039/a909394j","","","0.71073","MoKα","","0.2047","0.0716","","","0.117","0.1613","","","","","","0.892","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009221","8.144","0.002","18.352","0.004","16.518","0.003","90","","92.53","0.03","90","","2466.4","0.9","193","1","193","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C30.67 H24 Bi1.33 Fe4 N1.33 O8 -","- C23 H18 Bi Fe3 N O6 -","- C92 H72 Bi4 Fe12 N4 O24 -","4","1","","Gröer, Thomas; Scheer, Manfred","Structure and reactivity of transition metal substituted dichloroantimony and dichlorobismuth complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","5","647","","10.1039/a909394j","","","0.71073","MoKα","","0.0579","0.052","","0.1362","0.1319","","","","0.991","1.043","1.043","","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009222","10.479","0.002","15.405","0.003","20.248","0.004","90","","98.84","0.03","90","","3229.8","1.1","200","1","200","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C30 H42 Bi Cl Fe2 O4 -","- C30 H42 Bi Cl Fe2 O4 -","- C120 H168 Bi4 Cl4 Fe8 O16 -","4","1","","Gröer, Thomas; Scheer, Manfred","Structure and reactivity of transition metal substituted dichloroantimony and dichlorobismuth complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","5","647","","10.1039/a909394j","","","0.71073","MoKα","","0.0567","0.0513","","0.1409","0.1371","","","","1.045","1.093","1.093","","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009223","15.7714","0.0003","11.4969","0.0002","12.757","0.0001","90","","108.67","","90","","2191.41","0.06","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13 H26 Cl3 Co N4 O8 -","- C13 H26 Cl3 Co N4 O8 -","- C52 H104 Cl12 Co4 N16 O32 -","4","1","","Ware, David C.; Brothers, Penelope J.; Clark, George R.; Denny, William A.; Palmer, Brian D.; Wilson, William R.","Synthesis, structures and hypoxia-selective cytotoxicity of cobalt(III) complexes containing tridentate amine and nitrogen mustard ligands","Journal of the Chemical Society, Dalton Transactions","2000","","6","925","","10.1039/a909447d","","","0.71073","MoKα","","0.0852","0.0618","","","0.1545","0.1726","","","","","","1.058","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009224","19.242","0.014","7.475","0.003","14.545","0.006","90","","103.42","0.05","90","","2034.9","1.9","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13 H26 Cl2 Co N5 O6 -","- C13 H26 Cl2 Co N5 O6 -","- C52 H104 Cl8 Co4 N20 O24 -","4","1","","Ware, David C.; Brothers, Penelope J.; Clark, George R.; Denny, William A.; Palmer, Brian D.; Wilson, William R.","Synthesis, structures and hypoxia-selective cytotoxicity of cobalt(III) complexes containing tridentate amine and nitrogen mustard ligands","Journal of the Chemical Society, Dalton Transactions","2000","","6","925","","10.1039/a909447d","","","0.71069","MoKα","","0.1915","0.079","","","0.1912","0.2353","","","","","","1.055","","","","has coordinates,has disorder","179796","2020-10-21","18:00:00",""
"7009225","6.293","0.003","6.294","0.003","6.844","0.005","107.04","0.05","92.34","0.05","90.13","0.05","258.9","0.3","298","","","","","","","","","","","5","P 1","P 1","1","","","","- H8 Na O14 P2 V2 -","- Na O14 P2 V2 -","- Na O14 P2 V2 -","1","1","","Yamase, Toshihiro; Makino, Haruyo","Crystal and electronic structures and magnetic susceptibility of the photochemically prepared layered vanadyl phosphate Na(VO)2(PO4)2·4H2O †","Journal of the Chemical Society, Dalton Transactions","2000","","7","1143","","10.1039/a909452k","","","0.7107","MoKα","","","0.056","","","","0.055","","","","","","1.56","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009226","6.293","0.003","6.294","0.003","6.844","0.005","107.04","0.05","92.34","0.05","90.13","0.05","258.9","0.3","298","","","","","","","","","","","5","P -1","-P 1","2","","","","- H8 Na O14 P2 V2 -","- Na O14 P2 V2 -","- Na O14 P2 V2 -","1","0.5","","Yamase, Toshihiro; Makino, Haruyo","Crystal and electronic structures and magnetic susceptibility of the photochemically prepared layered vanadyl phosphate Na(VO)2(PO4)2·4H2O †","Journal of the Chemical Society, Dalton Transactions","2000","","7","1143","","10.1039/a909452k","","","0.7107","MoKα","","","0.067","","","","0.072","","","","","","2.06","","","","has coordinates","209356","2020-10-21","18:00:00",""
"7009227","7.6567","0.0001","9.7915","0.0002","16.0835","0.0003","87.261","0.001","77.433","0.001","75.054","0.001","1137.04","0.04","200","2","200","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H39 Co N2 -","- C26 H39 Co N2 -","- C52 H78 Co2 N4 -","2","1","","Gleiter, Rolf; von Hirschheydt, Thomas; Wolfart, Volker; Rominger, Frank","Reaction of N,N'-bridged 1,10-diazacyclooctadeca-5,14-diynes with [CpCo(cod)]: a new type of superphane","Journal of the Chemical Society, Dalton Transactions","2000","","5","685","","10.1039/a909482b","","","0.71073","MoKα","","0.0307","0.028","","","0.0832","0.0854","","","","","","1.125","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009228","8.5424","0.0001","29.0936","0.0003","10.9486","0.0001","90","","110.09","","90","","2555.48","0.05","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C29 H45 Co N2 -","- C29 H45 Co N2 -","- C116 H180 Co4 N8 -","4","1","","Gleiter, Rolf; von Hirschheydt, Thomas; Wolfart, Volker; Rominger, Frank","Reaction of N,N'-bridged 1,10-diazacyclooctadeca-5,14-diynes with [CpCo(cod)]: a new type of superphane","Journal of the Chemical Society, Dalton Transactions","2000","","5","685","","10.1039/a909482b","","","0.71073","MoKα","","0.0364","0.031","","","0.0823","0.0856","","","","","","1.085","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009229","23.9708","0.0016","9.4887","0.0007","23.9264","0.0017","90","","98.214","0.001","90","","5386.3","0.7","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C58 H90 Co2 N4 -","- C58 H90 Co2 N4 -","- C232 H360 Co8 N16 -","4","0.5","","Gleiter, Rolf; von Hirschheydt, Thomas; Wolfart, Volker; Rominger, Frank","Reaction of N,N'-bridged 1,10-diazacyclooctadeca-5,14-diynes with [CpCo(cod)]: a new type of superphane","Journal of the Chemical Society, Dalton Transactions","2000","","5","685","","10.1039/a909482b","","","0.71073","MoKα","","0.1483","0.0689","","","0.1602","0.2032","","","","","","1.02","","","","has coordinates,has disorder","179796","2020-10-21","18:00:00",""
"7009230","15.4749","0.0013","11.6232","0.0006","41.92","0.004","90","","97.861","0.01","90","","7469.2","1","223","2","223","2","","","","","","","","6","A 1 2/n 1","-A 2yab","15","","","","- C31 H38.5 F12 N7.5 P2 Ru -","- C31 H37 F12 N7.5 P2 Ru -","- C248 H296 F96 N60 P16 Ru8 -","8","1","","Isabel Romero; Montserrat Rodríguez; Antoni Llobet; Marie-Noëlle Collomb-Dunand-Sauthier; Alain Deronzier; Teodor Parella; Helen Stoeckli-Evans","Synthesis, structure and redox properties of a new ruthenium(II) complex containing the flexible tridentate ligand N,N-bis(2-pyridylmethyl)ethylamine, cis-fac-Ru(bpea)22+, and its homologue attached covalently to a polypyrrole film","J. Chem. Soc., Dalton Trans.","2000","","11","1689","1694","10.1039/a909511j","","","0.71073","MoKα","","0.1051","0.0426","","","0.0753","0.0853","","","","","","0.757","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009231","14.6828","0.0014","12.1699","0.001","18.895","0.003","90","","90","","90","","3376.3","0.7","298","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C12 H17 B N6 S2 Zn -","- C12 H17 B N6 S2 Zn -","- C96 H136 B8 N48 S16 Zn8 -","8","1","","Kimblin, Clare; Bridgewater, Brian M.; Hascall, Tony; Parkin, Gerard","The synthesis and structural characterization of bis(mercaptoimidazolyl)(pyrazolyl)hydroborato and tris(mercaptoimidazolyl)hydroborato complexes of thallium(I) and thallium(III)","Journal of the Chemical Society, Dalton Transactions","2000","","8","1267","","10.1039/a909542j","","","0.71073","MoKα","","0.0896","0.0449","","0.1172","0.0966","","","","1.042","1.1","1.1","","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009232","11.848","0.0006","12.0738","0.0007","22.1239","0.0012","90.296","0.001","97.423","0.001","109.724","0.001","2950.1","0.3","228","2","228","2","","","","","","","","8","P -1","-P 1","2","","","","- C54 H44 B2 Cl N12 O4 S6 Tl -","- C54 H44 B2 Cl N12 O4 S6 Tl -","- C108 H88 B4 Cl2 N24 O8 S12 Tl2 -","2","1","","Kimblin, Clare; Bridgewater, Brian M.; Hascall, Tony; Parkin, Gerard","The synthesis and structural characterization of bis(mercaptoimidazolyl)(pyrazolyl)hydroborato and tris(mercaptoimidazolyl)hydroborato complexes of thallium(I) and thallium(III)","Journal of the Chemical Society, Dalton Transactions","2000","","8","1267","","10.1039/a909542j","","","0.71073","MoKα","","0.0479","0.0354","","","0.108","0.1137","","","","","","1.103","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009233","7.6486","0.0004","14.5166","0.0007","16.9156","0.0008","90","","101.822","0.001","90","","1838.33","0.16","203","2","203","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C13 H20 B N6 S2 Tl -","- C13 H20 B N6 S2 Tl -","- C52 H80 B4 N24 S8 Tl4 -","4","1","","Kimblin, Clare; Bridgewater, Brian M.; Hascall, Tony; Parkin, Gerard","The synthesis and structural characterization of bis(mercaptoimidazolyl)(pyrazolyl)hydroborato and tris(mercaptoimidazolyl)hydroborato complexes of thallium(I) and thallium(III)","Journal of the Chemical Society, Dalton Transactions","2000","","8","1267","","10.1039/a909542j","","","0.71073","MoKα","","0.026","0.0228","","0.0578","0.0557","","","","1.021","1.042","1.042","","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009234","10.3343","0.0009","10.6394","0.001","14.8014","0.0014","103.389","0.002","95.63","0.002","100.605","0.002","1539.2","0.2","243","2","243","2","","","","","","","","7","P -1","-P 1","2","","","","- C55 H45 B2 Cl3 N12 S6 Tl2 -","- C55 H45 B2 Cl3 N12 S6 Tl2 -","- C55 H45 B2 Cl3 N12 S6 Tl2 -","1","0.5","","Kimblin, Clare; Bridgewater, Brian M.; Hascall, Tony; Parkin, Gerard","The synthesis and structural characterization of bis(mercaptoimidazolyl)(pyrazolyl)hydroborato and tris(mercaptoimidazolyl)hydroborato complexes of thallium(I) and thallium(III)","Journal of the Chemical Society, Dalton Transactions","2000","","8","1267","","10.1039/a909542j","","","0.71073","MoKα","","0.0732","0.0384","","","0.0559","0.0614","","","","","","1.024","","","","has coordinates,has disorder","179796","2020-10-21","18:00:00",""
"7009235","14.595","0.002","14.595","0.002","15.267","0.003","90","","90","","120","","2816.4","0.8","293","2","293","2","","","","","","","","5","P 6/m c c","-P 6 2c","192","","Yttrium Copper Oxydiacetate","","- C24 H60 Cu3 O48 Y2 -","- C24 H36 Cu3 O48 Y2 -","- C48 H72 Cu6 O96 Y4 -","2","0.0833333","","Baggio, Ricardo; Garland, Maria T.; Moreno, Yanko; Peña, Octavio; Perec, Mireille; Spodine, Evgenia","Synthesis, structure and magnetic properties of the 2,2'-oxydiacetato-bridged Cu(II)‒Ln(III) complexes [{Cu3Ln2(oda)6(H2O)6}·12H2O]n (Ln = Y, Gd, Eu, Nd, Pr)","Journal of the Chemical Society, Dalton Transactions","2000","","13","2061","","10.1039/a909544f","","","0.71073","MoKα","","0.081","0.038","","","0.08","0.094","","","","","","1.003","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009236","14.717","0.002","14.717","0.002","15.169","0.003","90","","90","","120","","2845.3","0.8","293","2","293","2","","","","","","","","5","P 6/m c c","-P 6 2c","192","","Gadolinium Copper Oxydiacetate","","- C24 H60 Cu3 Gd2 O48 -","- C24 H36 Cu3 Gd2 O46.08 -","- C48 H72 Cu6 Gd4 O92.16 -","2","0.0833333","","Baggio, Ricardo; Garland, Maria T.; Moreno, Yanko; Peña, Octavio; Perec, Mireille; Spodine, Evgenia","Synthesis, structure and magnetic properties of the 2,2'-oxydiacetato-bridged Cu(II)‒Ln(III) complexes [{Cu3Ln2(oda)6(H2O)6}·12H2O]n (Ln = Y, Gd, Eu, Nd, Pr)","Journal of the Chemical Society, Dalton Transactions","2000","","13","2061","","10.1039/a909544f","","","0.71073","MoKα","","0.037","0.024","","","0.054","0.06","","","","","","1.06","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009237","14.872","0.001","14.872","0.001","15.019","0.002","90","","90","","120","","2876.8","0.5","293","2","293","2","","","","","","","","5","P 6/m c c","-P 6 2c","192","","Europium Copper Oxydiacetate","","- C24 H60 Cu3 Eu2 O48 -","- C24 H36 Cu3 Eu2 O41.28 -","- C48 H72 Cu6 Eu4 O82.56 -","2","0.0833333","","Baggio, Ricardo; Garland, Maria T.; Moreno, Yanko; Peña, Octavio; Perec, Mireille; Spodine, Evgenia","Synthesis, structure and magnetic properties of the 2,2'-oxydiacetato-bridged Cu(II)‒Ln(III) complexes [{Cu3Ln2(oda)6(H2O)6}·12H2O]n (Ln = Y, Gd, Eu, Nd, Pr)","Journal of the Chemical Society, Dalton Transactions","2000","","13","2061","","10.1039/a909544f","","","0.71073","MoKα","","0.042","0.035","","","0.1","0.106","","","","","","0.988","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009238","15.0645","0.0016","15.0645","0.0016","14.751","0.003","90","","90","","120","","2899.1","0.7","293","2","293","2","","","","","","","","5","P 6/m c c","-P 6 2c","192","","Neodimium Copper Oxydiacetate","","- C24 H60 Cu3 Nd2 O48 -","- C24 H36 Cu3 Nd2 O46.56 -","- C48 H72 Cu6 Nd4 O93.12 -","2","0.0833333","","Baggio, Ricardo; Garland, Maria T.; Moreno, Yanko; Peña, Octavio; Perec, Mireille; Spodine, Evgenia","Synthesis, structure and magnetic properties of the 2,2'-oxydiacetato-bridged Cu(II)‒Ln(III) complexes [{Cu3Ln2(oda)6(H2O)6}·12H2O]n (Ln = Y, Gd, Eu, Nd, Pr)","Journal of the Chemical Society, Dalton Transactions","2000","","13","2061","","10.1039/a909544f","","","0.71073","MoKα","","0.0403","0.0301","","","0.1048","0.1141","","","","","","0.903","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009239","15.199","0.002","15.199","0.002","14.584","0.003","90","","90","","120","","2917.7","0.8","293","2","293","2","","","","","","","","5","P 6/m c c","-P 6 2c","192","","Praseodimium Copper Oxydiacetate","","- C24 H60 Cu3 O48 Pr2 -","- C24 H36 Cu3 O47.98 Pr2 -","- C48 H72 Cu6 O95.96 Pr4 -","2","0.0833333","","Baggio, Ricardo; Garland, Maria T.; Moreno, Yanko; Peña, Octavio; Perec, Mireille; Spodine, Evgenia","Synthesis, structure and magnetic properties of the 2,2'-oxydiacetato-bridged Cu(II)‒Ln(III) complexes [{Cu3Ln2(oda)6(H2O)6}·12H2O]n (Ln = Y, Gd, Eu, Nd, Pr)","Journal of the Chemical Society, Dalton Transactions","2000","","13","2061","","10.1039/a909544f","","","0.71073","MoKα","","0.0363","0.0305","","","0.1052","0.1104","","","","","","0.987","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009240","12.547","0.002","9.905","0.002","24.461","0.004","90","","96.91","0.01","90","","3017.9","0.9","158","2","158","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1,1-Bis(N,N-dimethylaminoxy)-2,3,4,5-tetraphenyl-1-sila-cyclopentene","","- C35 H35 N2 O2 Si -","- C35 H35 N2 O2 Si -","- C140 H140 N8 O8 Si4 -","4","1","","Losehand, Udo; Mitzel, Norbert W.","Siloles and germoles modified by partial hypercoordination through aminoxy substituents","Journal of the Chemical Society, Dalton Transactions","2000","","7","1049","","10.1039/a909547k","","","0.71073","MoKα","","0.1238","0.0467","","","0.1039","0.1301","","","","","","1.007","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009241","12.399","0.004","12.453","0.003","19.955","0.003","81.16","0.02","84.37","0.02","66.05","0.02","2780.2","1.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","1,1-Bis(N,N-dimethylaminoxy)-2,3,4,5-tetraphenyl-1-germacyclopentadien","","- C32 H32 Ge N2 O2 -","- C32 H32 Ge N2 O2 -","- C128 H128 Ge4 N8 O8 -","4","2","","Losehand, Udo; Mitzel, Norbert W.","Siloles and germoles modified by partial hypercoordination through aminoxy substituents","Journal of the Chemical Society, Dalton Transactions","2000","","7","1049","","10.1039/a909547k","","","0.71073","MoKα","","0.2201","0.0659","","","0.1401","0.1825","","","","","","0.998","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009242","8.415","0.002","17.478","0.003","20.165","0.003","90","","99.19","0.02","90","","2927.7","1","296.2","","296.2","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Complex of Bis(hexafluoroacetylacetonato)zinc(II) with 4-(N-tert-Butyl-N-oxylamino)-2,2-bipyridine.","","","- C24 H18 F12 N3 O5 Zn -","- C24 H18 F12 N3 O5 Zn -","- C96 H72 F48 N12 O20 Zn4 -","4","1","","Kumada, Harumi; Sakane, Akira; Koga, Noboru; Iwamura, Hiizu","Through-bond magnetic interaction between the 2p spin of the aminoxyl radical and the 3d spin of the metal ions in the complexes of bis(hexafluoroacetylacetonato)-manganese(II) and -copper(II) with 4-(N-tert-butyl-N-oxylamino)-2,2'-bipyridine †","Journal of the Chemical Society, Dalton Transactions","2000","","6","911","","10.1039/a909564k","","","0.7107","MoKα","","0.0666","0.0666","","0.1039","0.0991","0.098","","","2.377","","","2.783","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009243","8.358","0.002","17.716","0.003","20.249","0.003","90","","98.83","0.02","90","","2962.7","1","298.2","","298.2","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Complex of Bis(hexafluoroacetylacetonato)manganese(II) with 4-(N-tert-Butyl-N-oxylamino)-2,2-bipyridine.","","","- C24 H18 F12 Mn N3 O5 -","- C24 H18 F12 Mn N3 O5 -","- C96 H72 F48 Mn4 N12 O20 -","4","1","","Kumada, Harumi; Sakane, Akira; Koga, Noboru; Iwamura, Hiizu","Through-bond magnetic interaction between the 2p spin of the aminoxyl radical and the 3d spin of the metal ions in the complexes of bis(hexafluoroacetylacetonato)-manganese(II) and -copper(II) with 4-(N-tert-butyl-N-oxylamino)-2,2'-bipyridine †","Journal of the Chemical Society, Dalton Transactions","2000","","6","911","","10.1039/a909564k","","","1.5418","CuKα","","0.0741","0.0741","","","0.0759","0.0759","","","","","","2.79","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009244","8.496","0.002","17.305","0.003","20.1","0.003","90","","99.04","0.02","90","","2918.5","1","296.2","","296.2","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Complex of Bis(hexafluoroacetylacetonato)copper(II) with 4-(N-tert-Butyl-N-oxylamino)-2,2-bipyridine.","","","- C24 H18 Cu F12 N3 O5 -","- C24 H18 Cu F12 N3 O5 -","- C96 H72 Cu4 F48 N12 O20 -","4","1","","Kumada, Harumi; Sakane, Akira; Koga, Noboru; Iwamura, Hiizu","Through-bond magnetic interaction between the 2p spin of the aminoxyl radical and the 3d spin of the metal ions in the complexes of bis(hexafluoroacetylacetonato)-manganese(II) and -copper(II) with 4-(N-tert-butyl-N-oxylamino)-2,2'-bipyridine †","Journal of the Chemical Society, Dalton Transactions","2000","","6","911","","10.1039/a909564k","","","1.5418","CuKα","","0.0563","0.0563","","","0.0832","0.0832","","","","","","1.924","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009245","15.391","0.008","27.946","0.005","23.403","0.011","90","","91.61","0.05","90","","10062","7","213","2","213","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","compound 3","","","- C49.5 H103 Cl11 Co4 N12 Ni4 O36 P12 -","- C49.5 H103 Cl11 Co4 N12 Ni4 O36 P12 -","- C198 H412 Cl44 Co16 N48 Ni16 O144 P48 -","4","1","","De-qiang Ma; Shiro Hikichi; Munetaka Akita; Yoshihiko Moro-oka","An entry to half-sandwich complexes of first row transition metals (Ni, Co, Mn) containing the Kläui tripodal ligand, LOMe: synthesis and crystal structures of oligomeric, [LOMeM(μ-X)(L)]n (n = 2, 4), and monomeric complexes, LOMeM(L2)(X)","J. Chem. Soc., Dalton Trans.","2000","","7","1123","1134","10.1039/a909580b","","","0.7107","MoKα","","0.1233","0.0888","","","0.1995","0.2163","","","","","","1.43","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009246","19.497","0.008","11.9703","0.0018","17.705","0.007","90","","98.32","0.04","90","","4089","2","213","2","213","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","compound 4(Ni)","","","- C26 H54 Co2 Ni O19 P6 -","- C26 H54 Co2 Ni O19 P6 -","- C104 H216 Co8 Ni4 O76 P24 -","4","0.5","","De-qiang Ma; Shiro Hikichi; Munetaka Akita; Yoshihiko Moro-oka","An entry to half-sandwich complexes of first row transition metals (Ni, Co, Mn) containing the Kläui tripodal ligand, LOMe: synthesis and crystal structures of oligomeric, [LOMeM(μ-X)(L)]n (n = 2, 4), and monomeric complexes, LOMeM(L2)(X)","J. Chem. Soc., Dalton Trans.","2000","","7","1123","1134","10.1039/a909580b","","","0.7107","MoKα","","0.076","0.0728","","","0.1945","0.1974","","","","","","1.663","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009247","19.103","0.005","14.8","0.002","21.34","0.002","90","","113.253","0.003","90","","5543.3","1.7","213","2","213","2","","","","","","","","7","P 1 21/a 1","-P 2yab","14","compound 5b(Ni)","","","- C39 H66 Cl2 Co2 Ni2 O20 P6 -","- C39 H48 Cl2 Co2 Ni2 O20 P6 -","- C156 H192 Cl8 Co8 Ni8 O80 P24 -","4","1","","De-qiang Ma; Shiro Hikichi; Munetaka Akita; Yoshihiko Moro-oka","An entry to half-sandwich complexes of first row transition metals (Ni, Co, Mn) containing the Kläui tripodal ligand, LOMe: synthesis and crystal structures of oligomeric, [LOMeM(μ-X)(L)]n (n = 2, 4), and monomeric complexes, LOMeM(L2)(X)","J. Chem. Soc., Dalton Trans.","2000","","7","1123","1134","10.1039/a909580b","","","0.7107","MoKα","","0.064","0.0591","","","0.1703","0.174","","","","","","1.419","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009248","19.005","0.007","14.9328","0.0016","21.355","0.003","90","","113.004","0.016","90","","5579","2","213","2","213","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","compound 5b(Co)","","","- C39 H66 Cl2 Co4 O20 P6 -","- C39 H48 Cl2 Co4 O20 P6 -","- C156 H192 Cl8 Co16 O80 P24 -","4","1","","De-qiang Ma; Shiro Hikichi; Munetaka Akita; Yoshihiko Moro-oka","An entry to half-sandwich complexes of first row transition metals (Ni, Co, Mn) containing the Kläui tripodal ligand, LOMe: synthesis and crystal structures of oligomeric, [LOMeM(μ-X)(L)]n (n = 2, 4), and monomeric complexes, LOMeM(L2)(X)","J. Chem. Soc., Dalton Trans.","2000","","7","1123","1134","10.1039/a909580b","","","0.7107","MoKα","","0.078","0.076","","","0.2061","0.208","","","","","","1.816","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009249","18.968","0.003","15.162","0.008","21.543","0.005","90","","113.058","0.014","90","","5701","3","213","2","213","2","","","","","","","","7","P 1 21/a 1","-P 2yab","14","compound 5b(Mn)","","","- C39 H66 Cl2 Co2 Mn2 O20 P6 -","- C39 H48 Cl2 Co2 Mn2 O20 P6 -","- C156 H192 Cl8 Co8 Mn8 O80 P24 -","4","1","","De-qiang Ma; Shiro Hikichi; Munetaka Akita; Yoshihiko Moro-oka","An entry to half-sandwich complexes of first row transition metals (Ni, Co, Mn) containing the Kläui tripodal ligand, LOMe: synthesis and crystal structures of oligomeric, [LOMeM(μ-X)(L)]n (n = 2, 4), and monomeric complexes, LOMeM(L2)(X)","J. Chem. Soc., Dalton Trans.","2000","","7","1123","1134","10.1039/a909580b","","","0.7107","MoKα","","0.0885","0.0784","","","0.2068","0.2146","","","","","","1.599","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009250","14.389","0.004","18.824","0.003","14.313","0.01","112.36","0.007","119.89","0.03","88.509","0.013","3043","3","213","2","213","2","","","","","","","","8","P -1","-P 1","2","compound 6d(Ni)","","","- C38 H46 Cl4 Co2 N2 Ni2 O26 P6 -","- C38 H28 Cl4 Co2 N2 Ni2 O26 P6 -","- C76 H56 Cl8 Co4 N4 Ni4 O52 P12 -","2","1","","De-qiang Ma; Shiro Hikichi; Munetaka Akita; Yoshihiko Moro-oka","An entry to half-sandwich complexes of first row transition metals (Ni, Co, Mn) containing the Kläui tripodal ligand, LOMe: synthesis and crystal structures of oligomeric, [LOMeM(μ-X)(L)]n (n = 2, 4), and monomeric complexes, LOMeM(L2)(X)","J. Chem. Soc., Dalton Trans.","2000","","7","1123","1134","10.1039/a909580b","","","0.7107","MoKα","","0.1099","0.1039","","","0.2765","0.2839","","","","","","2.267","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009251","9.2507","0.0014","28.276","0.008","12.14","0.002","90","","100.241","0.009","90","","3124.9","1.1","213","2","213","2","","","","","","","","7","P 1 21/a 1","-P 2yab","14","compound 6e(Ni)","","","- C42 H66 Co2 F10 Ni2 O24 P6 -","- C42 H46 Co2 F10 Ni2 O24 P6 -","- C84 H92 Co4 F20 Ni4 O48 P12 -","2","0.5","","De-qiang Ma; Shiro Hikichi; Munetaka Akita; Yoshihiko Moro-oka","An entry to half-sandwich complexes of first row transition metals (Ni, Co, Mn) containing the Kläui tripodal ligand, LOMe: synthesis and crystal structures of oligomeric, [LOMeM(μ-X)(L)]n (n = 2, 4), and monomeric complexes, LOMeM(L2)(X)","J. Chem. Soc., Dalton Trans.","2000","","7","1123","1134","10.1039/a909580b","","","0.7107","MoKα","","0.094","0.0894","","","0.2336","0.2371","","","","","","2.101","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009252","24.196","0.004","24.838","0.003","10.667","0.002","90","","100.374","0.003","90","","6305.9","1.8","213","2","213","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","compound 7c(Ni)","","","- C36 H58 Cl4 Co2 N2 Ni2 O24 P6 -","- C36 H58 Cl4 Co2 N2 Ni2 O24 P6 -","- C144 H232 Cl16 Co8 N8 Ni8 O96 P24 -","4","0.5","","De-qiang Ma; Shiro Hikichi; Munetaka Akita; Yoshihiko Moro-oka","An entry to half-sandwich complexes of first row transition metals (Ni, Co, Mn) containing the Kläui tripodal ligand, LOMe: synthesis and crystal structures of oligomeric, [LOMeM(μ-X)(L)]n (n = 2, 4), and monomeric complexes, LOMeM(L2)(X)","J. Chem. Soc., Dalton Trans.","2000","","7","1123","1134","10.1039/a909580b","","","0.7107","MoKα","","0.0795","0.0754","","","0.2146","0.2172","","","","","","1.799","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009253","15.558","0.008","19.023","0.007","8.898","0.003","97.65","0.02","92.1","0.03","80.74","0.03","2575.7","1.9","213","2","213","2","","","","","","","","7","P -1","-P 1","2","compound 7c(Mn)","","","- C34 H54 Co2 Mn2 N2 O24 P6 -","- C34 H54 Co2 Mn2 N2 O24 P6 -","- C68 H108 Co4 Mn4 N4 O48 P12 -","2","1","","De-qiang Ma; Shiro Hikichi; Munetaka Akita; Yoshihiko Moro-oka","An entry to half-sandwich complexes of first row transition metals (Ni, Co, Mn) containing the Kläui tripodal ligand, LOMe: synthesis and crystal structures of oligomeric, [LOMeM(μ-X)(L)]n (n = 2, 4), and monomeric complexes, LOMeM(L2)(X)","J. Chem. Soc., Dalton Trans.","2000","","7","1123","1134","10.1039/a909580b","","","0.7107","MoKα","","0.1538","0.1332","","","0.3107","0.3215","","","","","","2.067","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009254","9.0941","0.0013","17.068","0.003","17.876","0.008","90","","94.982","0.005","90","","2764.2","1.4","213","2","213","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","compound 9(Ni)","","","- C17 H39 Co N3 Ni O12 P3 -","- C17 H39 Co N3 Ni O12 P3 -","- C68 H156 Co4 N12 Ni4 O48 P12 -","4","1","","De-qiang Ma; Shiro Hikichi; Munetaka Akita; Yoshihiko Moro-oka","An entry to half-sandwich complexes of first row transition metals (Ni, Co, Mn) containing the Kläui tripodal ligand, LOMe: synthesis and crystal structures of oligomeric, [LOMeM(μ-X)(L)]n (n = 2, 4), and monomeric complexes, LOMeM(L2)(X)","J. Chem. Soc., Dalton Trans.","2000","","7","1123","1134","10.1039/a909580b","","","0.7107","MoKα","","0.0603","0.0588","","0.1789","0.1776","","","","1.583","1.598","1.598","","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009255","13.959","0.007","11.083","0.004","19.026","0.003","90","","109.61","0.02","90","","2772.7","1.8","213","2","213","2","","","","","","","","7","P 1 21/a 1","-P 2yab","14","compound 10","","","- C21 H31 Co N5 Ni O9 P3 -","- C21 H26 Co N5 Ni O9 P3 -","- C84 H104 Co4 N20 Ni4 O36 P12 -","4","1","","De-qiang Ma; Shiro Hikichi; Munetaka Akita; Yoshihiko Moro-oka","An entry to half-sandwich complexes of first row transition metals (Ni, Co, Mn) containing the Kläui tripodal ligand, LOMe: synthesis and crystal structures of oligomeric, [LOMeM(μ-X)(L)]n (n = 2, 4), and monomeric complexes, LOMeM(L2)(X)","J. Chem. Soc., Dalton Trans.","2000","","7","1123","1134","10.1039/a909580b","","","0.7107","MoKα","","0.0647","0.0624","","0.1737","0.1716","","","","1.487","1.509","1.509","","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009256","19.733","0.003","18.211","0.015","20.147","0.004","90","","90","","90","","7240","6","213","2","213","2","","","","","","","","8","P b c a","-P 2ac 2ab","61","compound 13a","","","- C28 H37 Cl2 Co N3 Ni O12 P3 -","- C28 H19 Cl2 Co N3 Ni O12 P3 -","- C224 H152 Cl16 Co8 N24 Ni8 O96 P24 -","8","1","","De-qiang Ma; Shiro Hikichi; Munetaka Akita; Yoshihiko Moro-oka","An entry to half-sandwich complexes of first row transition metals (Ni, Co, Mn) containing the Kläui tripodal ligand, LOMe: synthesis and crystal structures of oligomeric, [LOMeM(μ-X)(L)]n (n = 2, 4), and monomeric complexes, LOMeM(L2)(X)","J. Chem. Soc., Dalton Trans.","2000","","7","1123","1134","10.1039/a909580b","","","0.7107","MoKα","","0.0932","0.0764","","","0.1909","0.1984","","","","","","1.327","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009257","12.468","0.002","16.435","0.003","26.532","0.012","90","","96.85","0.03","90","","5398","3","213","2","213","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","compound 14","","","- C51 H64 B Co N3 Ni O10 P3 -","- C51 H64 B Co N3 Ni O10 P3 -","- C204 H256 B4 Co4 N12 Ni4 O40 P12 -","4","1","","De-qiang Ma; Shiro Hikichi; Munetaka Akita; Yoshihiko Moro-oka","An entry to half-sandwich complexes of first row transition metals (Ni, Co, Mn) containing the Kläui tripodal ligand, LOMe: synthesis and crystal structures of oligomeric, [LOMeM(μ-X)(L)]n (n = 2, 4), and monomeric complexes, LOMeM(L2)(X)","J. Chem. Soc., Dalton Trans.","2000","","7","1123","1134","10.1039/a909580b","","","0.7107","MoKα","","0.0745","0.0701","","","0.2014","0.2063","","","","","","1.697","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009258","5.187","0.002","10.722","0.003","12.636","0.004","82.315","0.004","78.712","0.004","79.952","0.004","675","0.4","168","2","168","2","","","","","","","","6","P -1","-P 1","2","","","","- C10 H14 Ag N2 O5 S -","- C10 H14 Ag N2 O5 S -","- C20 H28 Ag2 N4 O10 S2 -","2","1","","Hanton, Lyall R.; Lee, Kitty","The role of the metal connectors AgNO3, Cu2I2 and CuCl2 in co-ordination-polymer formation using the N2S2 ditopic ligand 1,4-bis(2-pyridylmethylsulfanylmethyl)benzene †","Journal of the Chemical Society, Dalton Transactions","2000","","7","1161","","10.1039/a909601i","","","0.71073","MoKα","","0.0281","0.0231","","","0.0565","0.0575","","","","","","0.976","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009259","10.282","0.001","9.793","0.001","12.188","0.001","90","","105.482","0.002","90","","1182.7","0.19","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H20 Cu2 I2 N2 S2 -","- C20 H20 Cu2 I2 N2 S2 -","- C40 H40 Cu4 I4 N4 S4 -","2","0.5","","Hanton, Lyall R.; Lee, Kitty","The role of the metal connectors AgNO3, Cu2I2 and CuCl2 in co-ordination-polymer formation using the N2S2 ditopic ligand 1,4-bis(2-pyridylmethylsulfanylmethyl)benzene †","Journal of the Chemical Society, Dalton Transactions","2000","","7","1161","","10.1039/a909601i","","","0.71073","MoKα","","0.0428","0.0397","","","0.0883","0.0906","","","","","","1.042","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009260","8.017","0.002","10.026","0.002","13.063","0.003","90","","90.816","0.003","90","","1049.9","0.4","163","2","163","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H20 Cl2 Cu N2 S2 -","- C20 H20 Cl2 Cu N2 S2 -","- C40 H40 Cl4 Cu2 N4 S4 -","2","0.5","","Hanton, Lyall R.; Lee, Kitty","The role of the metal connectors AgNO3, Cu2I2 and CuCl2 in co-ordination-polymer formation using the N2S2 ditopic ligand 1,4-bis(2-pyridylmethylsulfanylmethyl)benzene †","Journal of the Chemical Society, Dalton Transactions","2000","","7","1161","","10.1039/a909601i","","","0.71073","MoKα","","0.0283","0.0233","","","0.0637","0.0651","","","","","","1.04","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009261","8.677","0.003","21.385","0.009","12.229","0.005","90","","108.06","0.03","90","","2157.4","1.5","293","2","293","2","","","","","","","synthesized","4","P 1 21/c 1","-P 2ybc","14","","bis(2-benzoyl pyridine) thiocarbazone","","- C25 H20 N6 S -","- C25 H20 N6 S -","- C100 H80 N24 S4 -","4","1","","He Cheng; Duan Chun-ying; Fang Chen-jie; Liu Yong-jiang; Meng Qing-jin","Self-assembled macrocyclic tetranuclear molecular square [Ni(HL)]44+ and molecular rectangle [Cu2Cl2L]2{H2L = bis[phenyl(2-pyridyl)methanone] thiocarbazone}","J. Chem. Soc., Dalton Trans.","2000","","7","1207","1212","10.1039/a909604c","","","0.71073","MoKα","","0.1372","0.0618","","","0.1221","0.1517","","","","","","1.01","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7009262","27.045","0.009","16.385","0.007","29.595","0.009","90","","109.38","0.02","90","","12371","8","293","2","293","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C27 H25.5 F6 N6 Ni O1.25 P S -","- C27 H25.5 F6 N6 Ni O1.25 P S -","- C432 H408 F96 N96 Ni16 O20 P16 S16 -","16","2","","He Cheng; Duan Chun-ying; Fang Chen-jie; Liu Yong-jiang; Meng Qing-jin","Self-assembled macrocyclic tetranuclear molecular square [Ni(HL)]44+ and molecular rectangle [Cu2Cl2L]2{H2L = bis[phenyl(2-pyridyl)methanone] thiocarbazone}","J. Chem. Soc., Dalton Trans.","2000","","7","1207","1212","10.1039/a909604c","","","0.71073","MoKα","","0.263","0.0787","","0.2556","0.1623","","","","0.819","1.068","1.068","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7009263","12.142","0.003","10.625","0.002","19.535","0.006","90","","90.43","0.02","90","","2520.1","1.1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C25 H18 Cl2 Cu2 N6 S -","- C25 H18 Cl2 Cu2 N6 S -","- C100 H72 Cl8 Cu8 N24 S4 -","4","1","","He Cheng; Duan Chun-ying; Fang Chen-jie; Liu Yong-jiang; Meng Qing-jin","Self-assembled macrocyclic tetranuclear molecular square [Ni(HL)]44+ and molecular rectangle [Cu2Cl2L]2{H2L = bis[phenyl(2-pyridyl)methanone] thiocarbazone}","J. Chem. Soc., Dalton Trans.","2000","","7","1207","1212","10.1039/a909604c","","","0.71073","MoKα","","0.185","0.0728","","0.1519","0.1129","","","","1.028","1.222","1.222","","","","","has coordinates,has disorder","179796","2020-10-21","18:00:00",""
"7009264","7.9677","0.0001","16.8612","0.0001","10.8686","0.0001","90","","111.07","","90","","1362.52","0.02","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C22 H10 O10 Os3 Te2 -","- C22 H10 O10 Os3 Te2 -","- C44 H20 O20 Os6 Te4 -","2","1","","Zhang, Junlian; Leong, Weng Kee","The reaction of diphenyl ditelluride with triosmium clusters","Journal of the Chemical Society, Dalton Transactions","2000","","8","1249","","10.1039/a909628k","","","0.71073","MoKα","","0.0427","0.0409","","","0.1081","0.1103","","","","","","1.05","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009265","15.7411","0.0001","12.736","","14.6953","0.0002","90","","113.71","","90","","2697.42","0.04","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C22 H10 O10 Os3 Te2 -","- C22 H10 O10 Os3 Te2 -","- C88 H40 O40 Os12 Te8 -","4","0.5","","Zhang, Junlian; Leong, Weng Kee","The reaction of diphenyl ditelluride with triosmium clusters","Journal of the Chemical Society, Dalton Transactions","2000","","8","1249","","10.1039/a909628k","","","0.71073","MoKα","","0.0448","0.035","","","0.0904","0.0949","","","","","","1.067","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009266","20.6376","0.0005","15.3639","0.0004","9.0517","0.0002","90","","90","","90","","2870.06","0.12","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C22 H12 O10 Os3 Te2 -","- C22 H12 O10 Os3 Te2 -","- C88 H48 O40 Os12 Te8 -","4","0.5","","Zhang, Junlian; Leong, Weng Kee","The reaction of diphenyl ditelluride with triosmium clusters","Journal of the Chemical Society, Dalton Transactions","2000","","8","1249","","10.1039/a909628k","","","0.71073","MoKα","","0.0438","0.0332","","","0.0749","0.0807","","","","","","1.078","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009267","9.3686","0.0004","6.2656","0.0003","19.0147","0.0008","90","","90.448","0.001","90","","1116.13","0.09","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H12 O6 Os2 Te2 -","- C18 H12 O6 Os2 Te2 -","- C36 H24 O12 Os4 Te4 -","2","0.5","","Zhang, Junlian; Leong, Weng Kee","The reaction of diphenyl ditelluride with triosmium clusters","Journal of the Chemical Society, Dalton Transactions","2000","","8","1249","","10.1039/a909628k","","","0.71073","MoKα","","0.0418","0.0301","","","0.0662","0.0719","","","","","","1.084","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009268","14.6982","0.0001","14.6793","0.0001","28.3219","0.0003","90","","90","","90","","6110.71","0.09","293","2","293","2","","","","","","","","6","P 43 21 2","P 4nw 2abw","96","","","","- C44 H68 Cu4 N10 S8 W -","- C44 H68 Cu4 N10 S8 W -","- C176 H272 Cu16 N40 S32 W4 -","4","0.5","","Zhang, Chi; Song, Yinglin; Jin, Guocheng; Fang, Guangyu; Wang, Yuxiao; Raj, S. Shanmuga Sundara; Fun, Hoong-Kun; Xin, Xinquan","Two novel anion cluster compounds with a planar 'open' structure [Et4N]2[MS4Cu4(SCN)4(2-pic)4] (M = W, Mo; 2-pic = 2-methylpyridine): synthesis, structural characterization, nonlinear response and large optical limiting properties","Journal of the Chemical Society, Dalton Transactions","2000","","8","1317","","10.1039/a909656f","","","0.71073","MoKα","","0.0213","0.0202","","","0.0519","0.0524","","","","","","1.14","","","","has coordinates,has disorder","179796","2020-10-21","18:00:00",""
"7009269","14.6884","0.0003","14.6881","0.0002","28.3778","0.0006","90","","90","","90","","6122.4","0.2","293","2","293","2","","","","","","","","6","P 43 21 2","P 4nw 2abw","96","","","","- C44 H68 Cu4 Mo N10 S8 -","- C44 H68 Cu4 Mo N10 S8 -","- C176 H272 Cu16 Mo4 N40 S32 -","4","0.5","","Zhang, Chi; Song, Yinglin; Jin, Guocheng; Fang, Guangyu; Wang, Yuxiao; Raj, S. Shanmuga Sundara; Fun, Hoong-Kun; Xin, Xinquan","Two novel anion cluster compounds with a planar 'open' structure [Et4N]2[MS4Cu4(SCN)4(2-pic)4] (M = W, Mo; 2-pic = 2-methylpyridine): synthesis, structural characterization, nonlinear response and large optical limiting properties","Journal of the Chemical Society, Dalton Transactions","2000","","8","1317","","10.1039/a909656f","","","0.71073","MoKα","","0.0702","0.0452","","","0.0848","0.0958","","","","","","1.076","","","","has coordinates,has disorder","179796","2020-10-21","18:00:00",""
"7009270","21.2302","0.0017","9.4767","0.0004","23.7715","0.0018","90","","95.39","0.009","90","","4761.5","0.6","193","","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C33 H64 Ga2 Mn2 O8 Si6 -","- C33 H64 Ga2 Mn2 O8 Si6 -","- C132 H256 Ga8 Mn8 O32 Si24 -","4","1","","Uhl, Werner; Benter, Maike; Prött, Malte","Replacement of CO ligands by the isolobal gallium(I) compound GaR [R = C(SiMe3)3], formation of the transition metal gallium compounds Mn2(CO)8(μ-GaR)2 and Fe3(CO)9(μ-CO)(μ-GaR)2","Journal of the Chemical Society, Dalton Transactions","2000","","5","643","","10.1039/a909658b","","","0.71073","MoKα","","0.1405","0.0521","","","0.1159","0.1603","","","","","","0.655","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009271","9.3853","0.0009","14.757","0.002","19.118","0.002","75.71","0.02","80.74","0.01","74.49","0.01","2459.6","0.5","213","","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C33 H54 F2.5 Fe3 Ga2 O10 Si6 -","- C33 H54 F2.49 Fe3 Ga2 O10 Si6 -","- C66 H108 F4.98 Fe6 Ga4 O20 Si12 -","2","1","","Uhl, Werner; Benter, Maike; Prött, Malte","Replacement of CO ligands by the isolobal gallium(I) compound GaR [R = C(SiMe3)3], formation of the transition metal gallium compounds Mn2(CO)8(μ-GaR)2 and Fe3(CO)9(μ-CO)(μ-GaR)2","Journal of the Chemical Society, Dalton Transactions","2000","","5","643","","10.1039/a909658b","","","0.71073","MoKα","","0.0434","0.0327","","","0.0849","0.0944","","","","","","0.674","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009272","6.0948","0.0008","10.967","0.002","17.606","0.003","90","0.02","94.066","0.015","90","0.013","1173.9","0.3","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C30 H24 N6 -","- C30 H24 N6 -","- C60 H48 N12 -","2","0.5","","Paul, Rowena L.; Couchman, Samantha M.; Jeffery, John C.; McCleverty, Jon A.; Reeves, Zoe R.; Ward, Michael D.","Effects of metal co-ordination geometry on self-assembly: a dinuclear double helicate complex and a tetranuclear cage complex of a new bis-bidentate bridging ligand","Journal of the Chemical Society, Dalton Transactions","2000","","6","845","","10.1039/a909702c","","","0.71073","MoKα","","0.0575","0.0372","","0.0968","0.0867","","","","1.026","1.121","1.121","","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009273","14.702","0.003","20.284","0.004","20.669","0.006","90","","94.561","0.011","90","","6144","2","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C32 H27 B Cu F4 N6 O2 -","- C32 H27 B Cu F4 N6 O2 -","- C256 H216 B8 Cu8 F32 N48 O16 -","8","1","","Paul, Rowena L.; Couchman, Samantha M.; Jeffery, John C.; McCleverty, Jon A.; Reeves, Zoe R.; Ward, Michael D.","Effects of metal co-ordination geometry on self-assembly: a dinuclear double helicate complex and a tetranuclear cage complex of a new bis-bidentate bridging ligand","Journal of the Chemical Society, Dalton Transactions","2000","","6","845","","10.1039/a909702c","","","0.71073","MoKα","","0.1452","0.0654","","0.1773","0.1442","","","","0.954","1.112","1.112","","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009274","19.221","0.008","37.421","0.018","31.929","0.009","90","","90.71","0.02","90","","22964","16","123","2","123","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C192 H162 B8 Co4 F32 N42 -","- C197 H144 B7.98 Co4 F31.92 N38.5 -","- C788 H576 B31.92 Co16 F127.68 N154 -","4","1","","Paul, Rowena L.; Couchman, Samantha M.; Jeffery, John C.; McCleverty, Jon A.; Reeves, Zoe R.; Ward, Michael D.","Effects of metal co-ordination geometry on self-assembly: a dinuclear double helicate complex and a tetranuclear cage complex of a new bis-bidentate bridging ligand","Journal of the Chemical Society, Dalton Transactions","2000","","6","845","","10.1039/a909702c","","","0.71073","MoKα","","0.2633","0.1576","","","0.4077","0.4853","","","","","","1.589","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009275","35.916","0.011","14.059","0.004","26.247","0.007","90","","120.314","0.007","90","","11441","6","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C48 H36 B F4 N13 O5.5 Pd2 -","- C48 H36 B F4 N13 O5.5 Pd2 -","- C384 H288 B8 F32 N104 O44 Pd16 -","8","1","","Paul, Rowena L.; Couchman, Samantha M.; Jeffery, John C.; McCleverty, Jon A.; Reeves, Zoe R.; Ward, Michael D.","Effects of metal co-ordination geometry on self-assembly: a dinuclear double helicate complex and a tetranuclear cage complex of a new bis-bidentate bridging ligand","Journal of the Chemical Society, Dalton Transactions","2000","","6","845","","10.1039/a909702c","","","0.71073","MoKα","","0.2306","0.1696","","","0.4155","0.444","","","","","","1.439","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009276","17.106","0.006","13.531","0.008","13.128","0.007","116.83","0.05","112.58","0.03","90.83","0.05","2438","3","220","2","220","2","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C102 H114 Mo2 N4 O6 Si4 -","- C102 H114 Mo2 N4 O6 Si4 -","- C102 H114 Mo2 N4 O6 Si4 -","1","0.5","","King, Lawrence; Motevalli, Majid; Sullivan, Alice C.","High oxidation state imido metallasiloxanes: synthesis and structural characterisation of novel bis-imido chromium(VI) and molybdenum(VI) compounds †","Journal of the Chemical Society, Dalton Transactions","2000","","8","1357","","10.1039/a909712k","","","0.71073","MoKα","","0.1229","0.0559","","","0.134","0.1564","","","","","","1.022","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009277","12.395","0.002","15.831","0.003","17.246","0.003","90","","100.07","0.03","90","","3332","1.1","293","2","293","2","","","","","","","synthesis as described","6","P 1 21/c 1","-P 2ybc","14","","","","- C64 H76 Mo2 N4 O6 Si4 -","- C64 H76 Mo2 N4 O6 Si4 -","- C128 H152 Mo4 N8 O12 Si8 -","2","0.5","","King, Lawrence; Motevalli, Majid; Sullivan, Alice C.","High oxidation state imido metallasiloxanes: synthesis and structural characterisation of novel bis-imido chromium(VI) and molybdenum(VI) compounds †","Journal of the Chemical Society, Dalton Transactions","2000","","8","1357","","10.1039/a909712k","","","0.71073","MoKα","","0.2106","0.0867","","","0.2059","0.2454","","","","","","0.923","","","","has coordinates,has disorder","179796","2020-10-21","18:00:00",""
"7009278","9.689","0.006","37.658","0.008","10.246","0.004","90","","95.62","0.05","90","","3720","3","293","2","293","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C37.5 H47.5 Cl2 Mo N4 -","- C37.5 H47.5 Cl2 Mo N4 -","- C150 H190 Cl8 Mo4 N16 -","4","1","","King, Lawrence; Motevalli, Majid; Sullivan, Alice C.","High oxidation state imido metallasiloxanes: synthesis and structural characterisation of novel bis-imido chromium(VI) and molybdenum(VI) compounds †","Journal of the Chemical Society, Dalton Transactions","2000","","8","1357","","10.1039/a909712k","","","0.71073","MoKα","","0.1639","0.1067","","0.3358","0.2893","","","","0.914","1.036","1.036","","","","","has coordinates","209363","2020-10-21","18:00:00",""
"7009279","11.287","0.002","14.365","0.003","13.237","0.003","90","","114.99","0.03","90","","1945.3","0.8","190","1","190","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H10 As0.25 Cr2 O4 P5.75 -","- C14 H10 As0.246 Cr2 O4 P5.754 -","- C56 H40 As0.984 Cr8 O16 P23.016 -","4","1","","Umbarkar, Shubhangi; Sekar, Perumal; Scheer, Manfred","Chromium complexes with mixed Group 15 elements as ligands. Synthesis and characterisation of the first cyclo-P2As ligand in [CrCp(CO)2(η3-P2As)] †","Journal of the Chemical Society, Dalton Transactions","2000","","7","1135","","10.1039/a909717a","","","0.71073","MoKα","","0.056","0.0403","","","0.1044","0.1162","","","","","","1.032","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009280","11.144","0.002","9.852","0.002","12.139","0.002","90","","90","","90","","1332.7","0.4","203","2","203","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C10 H10 Cl4 Cr2 -","- C10 H10 Cl4 Cr2 -","- C40 H40 Cl16 Cr8 -","4","0.5","","Umbarkar, Shubhangi; Sekar, Perumal; Scheer, Manfred","Chromium complexes with mixed Group 15 elements as ligands. Synthesis and characterisation of the first cyclo-P2As ligand in [CrCp(CO)2(η3-P2As)] †","Journal of the Chemical Society, Dalton Transactions","2000","","7","1135","","10.1039/a909717a","","","0.71073","MoKα","","0.0375","0.0299","","0.0842","0.0765","","","","1.124","1.117","1.117","","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009281","7.3175","0.0002","20.8936","0.0007","14.3418","0.0004","90","","92.71","","90","","2190.25","0.11","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C15 H17 F3 O4 S3 W -","- C15 H17 F3 O4 S3 W -","- C60 H68 F12 O16 S12 W4 -","4","1","","Carmichael, Adrian J.; Duncalf, David J.; Wallbridge, Malcolm G. H.; McCamley, Andrew","Synthesis and characterisation of cationic bis(cyclopentadienyl)tungsten(IV) complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","7","1219","","10.1039/a909732e","","","0.71073","MoKα","","0.1051","0.0735","","0.2375","0.2133","","","","0.913","0.982","0.982","","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009282","8.759","0.002","13.161","0.003","15.623","0.003","90","","90","","90","","1801","0.7","150","2","150","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C18 H16 F3 N O3 S W -","- C18 H15 F3 N O3 S W -","- C72 H60 F12 N4 O12 S4 W4 -","4","1","","Carmichael, Adrian J.; Duncalf, David J.; Wallbridge, Malcolm G. H.; McCamley, Andrew","Synthesis and characterisation of cationic bis(cyclopentadienyl)tungsten(IV) complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","7","1219","","10.1039/a909732e","","","0.71073","MoKα","","0.05","0.0493","","0.1122","0.1118","","","","0.877","0.887","0.887","","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009283","6.526","0.0013","17.464","0.004","15.736","0.003","90","","94.67","0.03","90","","1787.5","0.6","220","2","220","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H19 F6 P W -","- C18 H19 F6 P W -","- C72 H76 F24 P4 W4 -","4","1","","Carmichael, Adrian J.; Duncalf, David J.; Wallbridge, Malcolm G. H.; McCamley, Andrew","Synthesis and characterisation of cationic bis(cyclopentadienyl)tungsten(IV) complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","7","1219","","10.1039/a909732e","","","0.71073","MoKα","","0.0981","0.0705","","","0.1399","0.1589","","","","","","1.213","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009284","22.228","0.004","22.989","0.005","28.829","0.006","90","","90","","90","","14732","5","203","2","203","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C114 H90 Cl4 Cu6 In8 O1.5 P6 Se13 -","- C114 H90 Cl4 Cu6 In8 O1.5 P6 Se13 -","- C456 H360 Cl16 Cu24 In32 O6 P24 Se52 -","4","1","","Eichhöfer, Andreas; Fenske, Dieter","Syntheses and structures of new copper(I)‒indium(III)‒selenide clusters †","Journal of the Chemical Society, Dalton Transactions","2000","","6","941","","10.1039/a909737f","","","0.71073","MoKa","","0.0731","0.0605","","0.1686","0.1555","","","","1.178","1.19","1.19","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009285","19.609","0.004","31.841","0.006","34.232","0.007","90","","91.72","0.03","90","","21364","7","200","2","200","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C144 H228 Cl4 Cu6 In8 P12 Se13 -","- C144 H228 Cl4 Cu6 In8 P12 Se13 -","- C576 H912 Cl16 Cu24 In32 P48 Se52 -","4","1","","Eichhöfer, Andreas; Fenske, Dieter","Syntheses and structures of new copper(I)‒indium(III)‒selenide clusters †","Journal of the Chemical Society, Dalton Transactions","2000","","6","941","","10.1039/a909737f","","","0.71073","MoKa","","0.1351","0.0854","","0.2341","0.2148","","","","1.186","1.482","1.482","","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009286","25.431","0.003","25.431","0.003","25.431","0.003","90","","90","","90","","16447","3","203","2","203","2","","","","","","","","6","I -4 3 m","I -4 2 3","217","","","","- C216 H180 Cu11 In15 P4 Se40 -","- C240 Cu11 In15 P4 Se40 -","- C480 Cu22 In30 P8 Se80 -","2","0.0416667","","Eichhöfer, Andreas; Fenske, Dieter","Syntheses and structures of new copper(I)‒indium(III)‒selenide clusters †","Journal of the Chemical Society, Dalton Transactions","2000","","6","941","","10.1039/a909737f","","","0.71073","MoKa","","0.0461","0.0439","","0.1449","0.1429","","","","1.281","1.297","1.297","","","","","has coordinates,has disorder","179796","2020-10-21","18:00:00",""
"7009287","9.42","0.004","9.016","0.003","12.258","0.002","90","","94.88","0.03","90","","1037.3","0.6","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- Al Cs2 O10 P3 -","- Al Cs2 O10 P3 -","- Al4 Cs8 O40 P12 -","4","1","","Devi, R. Nandini; Vidyasagar, K.","Synthesis and characterisation of novel layered compounds, Cs2MP3O10 (M = Al or Ga), containing triphosphate groups †","Journal of the Chemical Society, Dalton Transactions","2000","","10","1605","","10.1039/a909753h","","","0.71073","MoKα","","0.0451","0.032","","0.1892","0.0777","","","","1.233","1.118","1.118","","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009288","9.494","0.006","9.016","0.009","12.29","0.032","90","","94.97","0.18","90","","1048","3","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- Cs2 Ga O10 P3 -","- Cs2 Ga O10 P3 -","- Cs8 Ga4 O40 P12 -","4","1","","Devi, R. Nandini; Vidyasagar, K.","Synthesis and characterisation of novel layered compounds, Cs2MP3O10 (M = Al or Ga), containing triphosphate groups †","Journal of the Chemical Society, Dalton Transactions","2000","","10","1605","","10.1039/a909753h","","","0.71073","MoKα","","0.0594","0.0471","","0.1369","0.1282","","","","1.021","1.092","1.092","","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009289","15.005","0.005","12.6","0.005","27.92","0.005","90","0.005","98.3","0.005","90","0.005","5223","3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C43 H48 F18 Fe N11 P3 -","- C43 H49 F18 Fe N12 P3 -","- C172 H196 F72 Fe4 N48 P12 -","4","1","","Amendola, Valeria; Fabbrizzi, Luigi; Mangano, Carlo; Lanfredi, Anna Manotti; Pallavicini, Piersandro; Perotti, Angelo; Ugozzoli, Franco","A monometallic and kinetically inert complex of a ditopic open ligand as a tight polyaza cage","Journal of the Chemical Society, Dalton Transactions","2000","","7","1155","","10.1039/a909756b","","","0.71069","MoKα","","0.2266","0.0569","","0.1588","0.132","","","","0.632","1.273","1.273","","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009290","10.3746","0.0017","16.061","0.006","16.726","0.006","90","","90.15","0.02","90","","2787","1.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C34 H26 Mn N8 -","- C34 H26 Mn N8 -","- C136 H104 Mn4 N32 -","4","1","","Saha, Amrita; Majumdar, Partha; Goswami, Sreebrata","Low-spin manganese(II) and cobalt(III) complexes of N-aryl-2-pyridylazophenylamines: new tridentate N,N,N-donors derived from cobalt mediated aromatic ring amination of 2-(phenylazo)pyridine. Crystal structure of a manganese(II) complex †","Journal of the Chemical Society, Dalton Transactions","2000","","11","1703","","10.1039/a909769d","","","0.71073","MoKα","","0.0532","0.0332","","","0.074","0.0864","","","","","","1.048","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009291","9.789","0.003","19.287","0.003","11.885","0.003","90","","97.26","0.03","90","","2225.9","1","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C23 H30 Cl In N4 -","- C23 H30 Cl In N4 -","- C92 H120 Cl4 In4 N16 -","4","1","","Bürgstein, Markus R.; Euringer, Nadine P.; Roesky, Peter W.","Bridged aminotroponiminate complexes of gallium and indium","Journal of the Chemical Society, Dalton Transactions","2000","","7","1045","","10.1039/a909773b","","","0.71073","MoKα","","0.0447","0.0323","","0.0836","0.0732","","","","1.118","1.111","1.111","","","","","has coordinates","179796","2020-10-21","18:00:00",""
"7009292","12.9497","0.0004","11.8967","0.0003","18.0227","0.0004","90","","102.895","0.002","90","","2706.53","0.13","150","0.1","150","0.1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C5 H12 Bi Br3 S2 -","- C5 H12 Bi3 Br4 S3 -","- C40 H96 Bi24 Br32 S24 -","8","1","","Barton, Andrew J.; Genge, Anthony R. J.; Levason, William; Reid, Gillian","Synthesis and structures of bismuth(III) complexes involving thio- and seleno-ether ligands","Journal of the Chemical Society, Dalton Transactions","2000","","6","859","","10.1039/a909803h","","","0.71073","MoKα","","0.065","0.065","","0.0769","","0.0769","","","1.584","","","1.584","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009293","13.04","0.001","14.493","0.002","9.883","0.002","90","","90","","90","","1867.8","0.5","150.1","","150.1","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C8 H20 Bi Br3 S4 -","- C8 H20 Bi Br3 S4 -","- C32 H80 Bi4 Br12 S16 -","4","1","","Barton, Andrew J.; Genge, Anthony R. J.; Levason, William; Reid, Gillian","Synthesis and structures of bismuth(III) complexes involving thio- and seleno-ether ligands","Journal of the Chemical Society, Dalton Transactions","2000","","6","859","","10.1039/a909803h","","","0.71073","MoKα","","","0.0354","","","","0.0436","","","","","","1.919","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009294","9.267","0.003","6.981","0.002","18.34","0.005","90","","93.94","0.02","90","","1183.7","0.6","150.1","","150.1","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H14 Bi2 Br6 S2 -","- C14 H14 Bi2 Br6 S2 -","- C28 H28 Bi4 Br12 S4 -","2","0.5","","Barton, Andrew J.; Genge, Anthony R. J.; Levason, William; Reid, Gillian","Synthesis and structures of bismuth(III) complexes involving thio- and seleno-ether ligands","Journal of the Chemical Society, Dalton Transactions","2000","","6","859","","10.1039/a909803h","","","0.71073","MoKα","","","0.044","","","","0.0485","","","","","","1.94","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009295","13.013","0.002","12.012","0.002","18.305","0.004","90","","103.64","0.02","90","","2780.6","0.9","150","0.1","150","0.1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C5 H12 Bi Br3 Se2 -","- C5 H12 Bi Br3 Se2 -","- C40 H96 Bi8 Br24 Se16 -","8","1","","Barton, Andrew J.; Genge, Anthony R. J.; Levason, William; Reid, Gillian","Synthesis and structures of bismuth(III) complexes involving thio- and seleno-ether ligands","Journal of the Chemical Society, Dalton Transactions","2000","","6","859","","10.1039/a909803h","","","0.71073","MoKα","","","0.036","","","","0.0382","","","","","","1.657","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009296","8.653","0.006","12.024","0.005","12.6","0.006","90","","107.7","0.05","90","","1248.9","1.2","150.1","","150.1","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C5 H12 Bi Cl3 Se2 -","- C5 H12 Bi Cl3 Se2 -","- C20 H48 Bi4 Cl12 Se8 -","4","1","","Barton, Andrew J.; Genge, Anthony R. J.; Levason, William; Reid, Gillian","Synthesis and structures of bismuth(III) complexes involving thio- and seleno-ether ligands","Journal of the Chemical Society, Dalton Transactions","2000","","6","859","","10.1039/a909803h","","","0.71073","MoKalpha","","","0.0451","","","0.0489","","","","","2.47","2.47","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009297","11.402","0.007","16.919","0.005","11.893","0.006","90","","99.23","0.04","90","","2264.6","1.9","150","","150","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C8 H18 Bi Cl3 Se3 -","- C8 H18 Bi Cl3 Se3 -","- C32 H72 Bi4 Cl12 Se12 -","4","1","","Barton, Andrew J.; Genge, Anthony R. J.; Levason, William; Reid, Gillian","Synthesis and structures of bismuth(III) complexes involving thio- and seleno-ether ligands","Journal of the Chemical Society, Dalton Transactions","2000","","6","859","","10.1039/a909803h","","","0.71073","MoKalpha","","","0.0598","","","0.0877","","","","","2.568","2.568","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009298","10.59","0.01","8.717","0.004","21.4","0.01","90","","97.93","0.06","90","","1957","2","150","0.1","150","0.1","","","","","","","recrystallisation from MeCN","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 H18 Bi I3 Se3 -","- C8 H18 Bi I3 Se3 -","- C32 H72 Bi4 I12 Se12 -","4","1","","Barton, Andrew J.; Genge, Anthony R. J.; Levason, William; Reid, Gillian","Synthesis and structures of bismuth(III) complexes involving thio- and seleno-ether ligands","Journal of the Chemical Society, Dalton Transactions","2000","","6","859","","10.1039/a909803h","","","0.71073","MoKα","","0.0838","0.0838","","0.0742","","0.0742","","","2.471","","","2.471","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009299","26.754","0.003","8.466","0.003","16.334","0.003","90","","100.94","0.01","90","","3632.4","1.5","299.2","","299.2","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C11 H13 Cl4 Cu2 N7 O -","- C11 H13 Cl4 Cu2 N7 O -","- C88 H104 Cl32 Cu16 N56 O8 -","8","1","","Xu, Zhiqiang; White, Stephen; Thompson, Laurence K.; Miller, D. O.; Ohba, Masaaki; Ōkawa, Hisashi; Wilson, Claire; Howard, Judith A. K.","Extended one- and two-dimensional copper(II) complexes with bridging (N‒N) diazine ligands: structural and magnetic studies †","Journal of the Chemical Society, Dalton Transactions","2000","","11","1751","","10.1039/a909824k","","","1.5418","CuKα","","0.0731","0.058","","0.039","","0.039","","","3.224","","","3.49","","","","has coordinates","208361","2020-10-21","18:00:00",""
"7009300","27.26","0.004","8.688","0.008","16.644","0.005","90","","100.45","0.02","90","","3876","4","299.2","","299.2","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C11 H13 Br4 Cu2 N7 O -","- C11 H13 Br4 Cu2 N7 O -","- C88 H104 Br32 Cu16 N56 O8 -","8","1","","Xu, Zhiqiang; White, Stephen; Thompson, Laurence K.; Miller, D. O.; Ohba, Masaaki; Ōkawa, Hisashi; Wilson, Claire; Howard, Judith A. K.","Extended one- and two-dimensional copper(II) complexes with bridging (N‒N) diazine ligands: structural and magnetic studies †","Journal of the Chemical Society, Dalton Transactions","2000","","11","1751","","10.1039/a909824k","","","0.7107","MoKα","","0.1612","0.049","","0.058","","0.048","","","1.23","","","1.44","","","","has coordinates","208361","2020-10-21","18:00:00",""
"7009301","15.1727","0.0004","8.3275","0.0002","15.2603","0.0004","90","","116.037","0.001","90","","1732.46","0.08","120","2","120","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H12 Cl4 Cu2 N6 -","- C12 H12 Cl4 Cu2 N6 -","- C48 H48 Cl16 Cu8 N24 -","4","0.5","","Xu, Zhiqiang; White, Stephen; Thompson, Laurence K.; Miller, D. O.; Ohba, Masaaki; Ōkawa, Hisashi; Wilson, Claire; Howard, Judith A. K.","Extended one- and two-dimensional copper(II) complexes with bridging (N‒N) diazine ligands: structural and magnetic studies †","Journal of the Chemical Society, Dalton Transactions","2000","","11","1751","","10.1039/a909824k","","","0.71073","MoKα","","0.0213","0.0185","","","0.0464","0.0475","","","","","","1.045","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009302","10.638","0.002","11.38","0.002","13.512","0.002","98.11","0.03","102","0.03","110.17","0.03","1461","0.6","203","2","293","2","","","","","","","","6","P -1","-P 1","2","","Triethylammonium-bis{[N,N-bis(2-oxyphenyl)glycinate] oxovanadium(IV)} dichloromethane solvate","","- C48 H68 Cl8 N4 O10 V2 -","- C48 H64 Cl8 N4 O10 V2 -","- C48 H64 Cl8 N4 O10 V2 -","1","0.5","","Ceccato, Augusto S.; Neves, Ademir; de Brito, Marcos A.; Drechsel, Sueli M.; Mangrich, Antonio S.; Werner, Rüdiger; Haase, Wolfgang; Bortoluzzi, Adailton J.","Magneto-structural correlation for binuclear octahedral vanadium(IV)–oxo complexes. Synthesis, structure and magnetic properties of a VIVO2+ complex with a new ligand derived from glycine","Journal of the Chemical Society, Dalton Transactions","2000","","10","1573","","10.1039/a909846a","","","0.71073","MoKα","","0.0476","0.0406","","","0.1105","0.1149","","","","","","1.066","","","","has coordinates","288121","2023-12-07","11:18:02",""
"7009303","12.6694","0.0008","26.479","0.002","20.799","0.0013","90","","94.021","0.001","90","","6960.3","0.8","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C71 H53 Cl2 Ir4 N O9 P4 -","- C71 H53 Cl2 Ir4 N O9 P4 -","- C284 H212 Cl8 Ir16 N4 O36 P16 -","4","1","","Detti, Serena; Lumini, Tito; Roulet, Raymond; Schenk, Kurt; Ros, Renzo; Tassan, Augusto","Bis(diphosphino)methanide and hydride derivatives of Ir4(CO)12","Journal of the Chemical Society, Dalton Transactions","2000","","10","1645","","10.1039/a909881j","","","0.71073","MoKα","","0.0742","0.0554","","0.0858","0.0823","","","","1.816","1.958","1.958","","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009304","10.2149","0.0008","18.4724","0.0013","33.772","0.003","90","","94.578","0.009","90","","6352.2","0.9","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C70 H53 Ir4 N O9 P4 -","- C70 H53 Ir4 N O9 P4 -","- C280 H212 Ir16 N4 O36 P16 -","4","1","","Detti, Serena; Lumini, Tito; Roulet, Raymond; Schenk, Kurt; Ros, Renzo; Tassan, Augusto","Bis(diphosphino)methanide and hydride derivatives of Ir4(CO)12","Journal of the Chemical Society, Dalton Transactions","2000","","10","1645","","10.1039/a909881j","","","0.71073","MoKα","","0.0454","0.0412","","0.0838","0.0691","","","","2.556","2.627","2.627","","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009305","11.922","0.002","8.5","0.001","19.517","0.003","90","","104.41","0.01","90","","1915.6","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H24 N5 O6 Tl -","- C13 H24 N5 O6 Tl -","- C52 H96 N20 O24 Tl4 -","4","1","","Bhandari, Sonali; Mahon, Mary F.; Molloy, Kieran C.; Palmer, Julie S.; Sayers, Stephen F.","Thallium(I)- and organothallium(III)-substituted mono-, bis- and tris-tetrazoles: synthesis and supramolecular structures","Journal of the Chemical Society, Dalton Transactions","2000","","7","1053","","10.1039/a910235n","","","0.71069","MoKα","","0.0772","0.0761","","0.2024","0.1972","","","","1.192","1.192","1.192","","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009306","8.413","0.003","9.509","0.003","12.148","0.005","81.02","0.03","78.17","0.03","85.76","0.03","938.6","0.6","170","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H19 N4 O Tl -","- C20 H19 N4 O Tl -","- C40 H38 N8 O2 Tl2 -","2","1","","Bhandari, Sonali; Mahon, Mary F.; Molloy, Kieran C.; Palmer, Julie S.; Sayers, Stephen F.","Thallium(I)- and organothallium(III)-substituted mono-, bis- and tris-tetrazoles: synthesis and supramolecular structures","Journal of the Chemical Society, Dalton Transactions","2000","","7","1053","","10.1039/a910235n","","","0.7093","","","0.0433","0.0342","","0.1311","0.0978","","","","0.919","0.909","0.909","","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009307","7.596","0.002","9.862","0.002","11.388","0.001","108.88","0.02","97.69","0.03","92.103","0.012","797","0.3","170","2","396","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H18 N4 O Tl -","- C16 H18 N4 O Tl -","- C32 H36 N8 O2 Tl2 -","2","1","","Bhandari, Sonali; Mahon, Mary F.; Molloy, Kieran C.; Palmer, Julie S.; Sayers, Stephen F.","Thallium(I)- and organothallium(III)-substituted mono-, bis- and tris-tetrazoles: synthesis and supramolecular structures","Journal of the Chemical Society, Dalton Transactions","2000","","7","1053","","10.1039/a910235n","","","0.71069","MoKα","","0.042","0.0394","","0.1065","0.1061","","","","1.143","1.187","1.187","","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009308","11.041","0.002","17.52","0.005","12.406","0.002","90","","105.21","0.02","90","","2315.7","0.9","293","2","293","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C46 H46 Cl N8 O4 Tl3 -","- C46 H40 Cl N8 O4 Tl3 -","- C92 H80 Cl2 N16 O8 Tl6 -","2","0.5","","Bhandari, Sonali; Mahon, Mary F.; Molloy, Kieran C.; Palmer, Julie S.; Sayers, Stephen F.","Thallium(I)- and organothallium(III)-substituted mono-, bis- and tris-tetrazoles: synthesis and supramolecular structures","Journal of the Chemical Society, Dalton Transactions","2000","","7","1053","","10.1039/a910235n","","","0.7093","","","0.1001","0.0563","","0.159","0.1319","","","","1.111","1.126","1.126","","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009309","11.033","0.001","47.147","0.006","14.193","0.001","90","","95.96","","90","","7342.9","1.3","153","2","153","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C86 H85 B2 Cu2 N9 -","- C86 H85 B2 Cu2 N9 -","- C344 H340 B8 Cu8 N36 -","4","1","","Drew, Michael G. B.; Farrell, David; Morgan, Grace G.; McKee, Vickie; Nelson, Jane","d10 Cations within triple-helical cryptand hosts; a structural and modelling study","Journal of the Chemical Society, Dalton Transactions","2000","","9","1513","","10.1039/a910240j","","","0.71073","MoKα","","0.1722","0.0722","","","0.1104","0.1444","","","","","","1.025","","","","has coordinates","288183","2023-12-08","14:43:00",""
"7009310","22.386","0.004","22.386","0.004","45.09","0.02","90","","90","","120","","19569","10","153","2","153","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C36 H49.5 Cl2 Cu2 N8 O11.69 -","- C36 H48 Cl1.99933 Cu2 N8 O11.75 -","- C648 H864 Cl35.988 Cu36 N144 O211.5 -","18","1","","Drew, Michael G. B.; Farrell, David; Morgan, Grace G.; McKee, Vickie; Nelson, Jane","d10 Cations within triple-helical cryptand hosts; a structural and modelling study","Journal of the Chemical Society, Dalton Transactions","2000","","9","1513","","10.1039/a910240j","","","0.71073","MoKα","","0.1985","0.0814","","","0.1756","0.2251","","","","","","1.024","","","","has coordinates,has disorder","288183","2023-12-08","14:43:00",""
"7009311","15.569","0.003","14.289","0.004","22.001","0.004","90","","105.755","0.011","90","","4710.6","1.8","153","2","153","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C39 H57 Ag Cl2 Cu N8 O12.5 -","- C39 H57 Ag Cl2 Cu N8 O12.5 -","- C156 H228 Ag4 Cl8 Cu4 N32 O50 -","4","1","","Drew, Michael G. B.; Farrell, David; Morgan, Grace G.; McKee, Vickie; Nelson, Jane","d10 Cations within triple-helical cryptand hosts; a structural and modelling study","Journal of the Chemical Society, Dalton Transactions","2000","","9","1513","","10.1039/a910240j","","","0.71073","MoKα","","0.1395","0.0838","","","0.1948","0.2267","","","","","","1.078","","","","has coordinates","288183","2023-12-08","14:43:00",""
"7009312","20.802","0.005","29.313","0.009","8.312","0.006","90","","90","","90","","5068","4","294.2","","294.2","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C33 H22 Cl2 Zr -","- C33 H22 Cl2 Zr -","- C264 H176 Cl16 Zr8 -","8","1","","Baker, Robert W.; Foulkes, Michael A.; Turner, Peter","Enantiospecific synthesis of a planar chiral fluorenylzirconium ansa-metallocene: synthesis and structures of [1-(9-fluorenyl)- and [1-(1-methyl-9-fluorenyl)-2-(2-indenyl)naphthalene]zirconium dichloride","Journal of the Chemical Society, Dalton Transactions","2000","","4","431","","10.1039/a910246i","","","1.5418","CuKα","","0.082","0.082","","0.0733","0.0733","","","","2.145","2.145","2.145","","","","","has coordinates","209482","2020-10-21","18:00:00",""
"7009313","12.134","0.002","12.745","0.002","10.334","0.002","98.72","0.01","112.29","0.01","68.47","0.01","1375.4","0.4","294.2","","294.2","","","","","","","","","4","P -1","-P 1","2","","","","- C35 H23 Cl2 Zr -","- C35 H23 Cl2 Zr -","- C70 H46 Cl4 Zr2 -","2","1","","Baker, Robert W.; Foulkes, Michael A.; Turner, Peter","Enantiospecific synthesis of a planar chiral fluorenylzirconium ansa-metallocene: synthesis and structures of [1-(9-fluorenyl)- and [1-(1-methyl-9-fluorenyl)-2-(2-indenyl)naphthalene]zirconium dichloride","Journal of the Chemical Society, Dalton Transactions","2000","","4","431","","10.1039/a910246i","","","1.5418","CuKα","","0.0516","0.0353","","0.0413","0.0398","","","","1.886","2.042","2.042","","","","","has coordinates","209482","2020-10-21","18:00:00",""
"7009314","9.564","0.002","5.416","0.002","12.867","0.002","90","","109.34","0.01","90","","628.9","0.3","296.2","","296.2","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C10 H10 Ag2 O8 -","- C10 H10 Ag2 O8 -","- C20 H20 Ag4 O16 -","2","1","","Nomiya, Kenji; Takahashi, Satoshi; Noguchi, Ryusuke","Synthesis and crystal structure of three silver(I) complexes with (S )-(+)-5-oxo-2-tetrahydrofurancarboxylic acid (S-Hothf ) and its isomeric forms (R-Hothf and R,S-Hothf ) showing wide spectra of effective antibacterial and antifungal activities. Chiral helical polymers in the solid state formed by self-assembly of the dimeric [Ag(othf )]2 cores","Journal of the Chemical Society, Dalton Transactions","2000","","8","1343","","10.1039/a910251p","","","0.7107","MoKα","","0.0295","0.029","","0.019","","0.019","","","1.317","","","1.32","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009315","9.56","0.002","5.417","0.002","12.858","0.002","90","","109.37","0.01","90","","628.2","0.3","296.2","","296.2","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C10 H10 Ag2 O8 -","- C10 H10 Ag2 O8 -","- C20 H20 Ag4 O16 -","2","1","","Nomiya, Kenji; Takahashi, Satoshi; Noguchi, Ryusuke","Synthesis and crystal structure of three silver(I) complexes with (S )-(+)-5-oxo-2-tetrahydrofurancarboxylic acid (S-Hothf ) and its isomeric forms (R-Hothf and R,S-Hothf ) showing wide spectra of effective antibacterial and antifungal activities. Chiral helical polymers in the solid state formed by self-assembly of the dimeric [Ag(othf )]2 cores","Journal of the Chemical Society, Dalton Transactions","2000","","8","1343","","10.1039/a910251p","","","0.7107","MoKα","","0.0357","0.036","","0.026","","0.026","","","1.256","","","1.26","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009316","23.766","0.004","5.466","0.001","10.128","0.001","90","","102.58","0.01","90","","1284.1","0.3","296.2","","296.2","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Ag2 O8 -","- C10 H10 Ag2 O8 -","- C40 H40 Ag8 O32 -","4","0.5","","Nomiya, Kenji; Takahashi, Satoshi; Noguchi, Ryusuke","Synthesis and crystal structure of three silver(I) complexes with (S )-(+)-5-oxo-2-tetrahydrofurancarboxylic acid (S-Hothf ) and its isomeric forms (R-Hothf and R,S-Hothf ) showing wide spectra of effective antibacterial and antifungal activities. Chiral helical polymers in the solid state formed by self-assembly of the dimeric [Ag(othf )]2 cores","Journal of the Chemical Society, Dalton Transactions","2000","","8","1343","","10.1039/a910251p","","","0.7107","MoKα","","0.0322","0.032","","0.055","","0.055","","","1.439","","","1.44","","","","has coordinates","277927","2022-09-16","19:50:24",""
"7009317","8.2051","0.0005","9.5548","0.0007","16.134","0.0011","75.502","0.003","78.898","0.004","74.485","0.004","1169.23","0.14","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C43 H48 Cr N7 O7 S4 -","- C43 H48 Cr N7 O7 S4 -","- C43 H48 Cr N7 O7 S4 -","1","0.5","","Turner, Scott S.; Michaut, Cecile; Durot, Stephanie; Day, Peter; Gelbrich, Thomas; Hursthouse, Michael B.","TTF based charge transfer salts of [M(NCS)4(C9H7N)2]− where M = Cr, Fe and C9H7N = isoquinoline; observation of bulk ferrimagnetic order","Journal of the Chemical Society, Dalton Transactions","2000","","6","905","","10.1039/a910259k","","","0.71073","MoKα","","0.0653","0.0418","","","0.0975","0.1062","","","","","","0.993","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009318","10.0659","0.0001","13.4957","0.0001","13.6217","0.0001","66.709","0.001","84.669","0.001","85.686","0.001","1690.81","0.03","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H22 N2 O8 Os3 P -","- C34 H22 N2 O8 Os3 P -","- C68 H44 N4 O16 Os6 P2 -","2","1","","Yeh, Wen-Yann; Yang, Ching-Chao; Peng, Shie-Ming; Lee, Gene-Hsiang","Complexation and metallation of the multifunctional [Ph2P(o-C6H4)CHN(CH2)2(o-C5H4N)] ligand on triosmium carbonyl clusters","Journal of the Chemical Society, Dalton Transactions","2000","","10","1649","","10.1039/a910260o","","","0.71073","MoKα","","0.0535","0.0313","","0.0591","0.0544","","","","1.003","1.079","1.079","","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009319","10.9788","0.0013","12.592","0.002","14.214","0.003","80.23","0.02","72.02","0.02","79.288","0.011","1823.2","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H23 N2 O10 Os3 P -","- C36 H23 N2 O10 Os3 P -","- C72 H46 N4 O20 Os6 P2 -","2","1","","Yeh, Wen-Yann; Yang, Ching-Chao; Peng, Shie-Ming; Lee, Gene-Hsiang","Complexation and metallation of the multifunctional [Ph2P(o-C6H4)CHN(CH2)2(o-C5H4N)] ligand on triosmium carbonyl clusters","Journal of the Chemical Society, Dalton Transactions","2000","","10","1649","","10.1039/a910260o","","","0.71073","MoKα","","0.0498","0.0353","","0.0992","0.0929","","","","1.023","1.073","1.073","","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009320","9.572","0.0001","10.6385","0.0002","20.2534","0.0002","79.228","0.001","88.699","0.001","68.027","0.001","1876.39","0.05","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","","","- C37 H29 N2 O8 Os3 P -","- C37 H29 N2 O8 Os3 P -","- C74 H58 N4 O16 Os6 P2 -","2","1","","Yeh, Wen-Yann; Yang, Ching-Chao; Peng, Shie-Ming; Lee, Gene-Hsiang","Complexation and metallation of the multifunctional [Ph2P(o-C6H4)CHN(CH2)2(o-C5H4N)] ligand on triosmium carbonyl clusters","Journal of the Chemical Society, Dalton Transactions","2000","","10","1649","","10.1039/a910260o","","","0.71073","MoKα","","0.0453","0.031","","0.0839","0.0729","","","","1.134","1.094","1.094","","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009321","18.768","0.003","21.023","0.002","20.026","0.004","90","","90","","90","","7901","2","295","2","295","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C43 H32 N2 O5 Os2 P2 -","- C43 H32 N2 O5 Os2 P2 -","- C344 H256 N16 O40 Os16 P16 -","8","1","","Yeh, Wen-Yann; Yang, Ching-Chao; Peng, Shie-Ming; Lee, Gene-Hsiang","Complexation and metallation of the multifunctional [Ph2P(o-C6H4)CHN(CH2)2(o-C5H4N)] ligand on triosmium carbonyl clusters","Journal of the Chemical Society, Dalton Transactions","2000","","10","1649","","10.1039/a910260o","","","0.71073","MoKα","","0.0871","0.0358","","0.0649","0.057","","","","1.002","1.153","1.153","","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009322","9.1822","0.0002","13.5268","0.0002","21.47","0.0005","74.1341","0.0013","86.9295","0.0011","74.3192","0.0013","2469.05","0.09","150","2","150","2","","","","","","","","5","P 1","P 1","1","","","","- C51 H50 N2 O12 Re2 -","- C51 H50 N2 O12 Re2 -","- C102 H100 N4 O24 Re4 -","2","2","","Guillevic, Marie-Andrée; Light, Mark E.; Coles, Simon J.; Gelbrich, Thomas; Hursthouse, Michael B.; Bruce, Duncan W.","Synthesis of dinuclear complexes of rhenium(I) as potential metallomesogens","Journal of the Chemical Society, Dalton Transactions","2000","","9","1437","","10.1039/a910273f","","","0.71073","MoKα","","0.0424","0.0372","","","0.086","0.0895","","","","","","0.942","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009323","8.5056","0.0002","11.9274","0.0003","21.6445","0.0008","82.0034","0.0019","82.2317","0.0018","71.9589","0.0018","2057.66","0.11","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C43 H34 N2 O12 Re2 -","- C43 H34 N2 O12 Re2 -","- C86 H68 N4 O24 Re4 -","2","1","","Guillevic, Marie-Andrée; Light, Mark E.; Coles, Simon J.; Gelbrich, Thomas; Hursthouse, Michael B.; Bruce, Duncan W.","Synthesis of dinuclear complexes of rhenium(I) as potential metallomesogens","Journal of the Chemical Society, Dalton Transactions","2000","","9","1437","","10.1039/a910273f","","","0.71073","MoKα","","0.0521","0.0367","","","0.0847","0.0898","","","","","","1.005","","","","has coordinates,has disorder","179797","2020-10-21","18:00:00",""
"7009324","7.2025","0.0006","10.1729","0.0013","20.231","0.003","83.619","0.005","87.892","0.008","83.518","0.008","1463.3","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C35 H36 N2 O4 -","- C35 H36 N2 O4 -","- C70 H72 N4 O8 -","2","1","","Guillevic, Marie-Andrée; Light, Mark E.; Coles, Simon J.; Gelbrich, Thomas; Hursthouse, Michael B.; Bruce, Duncan W.","Synthesis of dinuclear complexes of rhenium(I) as potential metallomesogens","Journal of the Chemical Society, Dalton Transactions","2000","","9","1437","","10.1039/a910273f","","","0.71073","MoKα","","0.1704","0.0782","","","0.1828","0.2201","","","","","","1.077","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7009325","15.907","0.003","13.541","0.003","10.966","0.002","116.504","0.004","92.816","0.005","103.092","0.004","2028.1","0.7","293","","293","","","","","","","","","4","P -1","-P 1","2","","","","- C54 H39 O3 Y -","- C54 H39 O3 Y -","- C108 H78 O6 Y2 -","2","1","","Deacon, Glen B.; Feng, Tiecheng; Forsyth, Craig M.; Gitlits, Alex; Hockless, David C. R.; Shen, Qi; Skelton, Brian W.; White, Allan H.","A simple synthesis and a structural survey of homoleptic rare earth(III) 2,6-diphenylphenolates","Journal of the Chemical Society, Dalton Transactions","2000","","6","961","","10.1039/a910277i","","","0.71073","MoKα","","0.122","0.076","","0.128","","0.099","","","2.995","","","2.937","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7009326","15.827","0.006","13.506","0.005","11.012","0.003","116.39","0.03","92.77","0.03","101.3","0.02","2043","1.4","293","","293","","","","","","","","","4","P -1","-P 1","2","","","","- C54 H39 O3 Pr -","- C54 H39 O3 Pr -","- C108 H78 O6 Pr2 -","2","1","","Deacon, Glen B.; Feng, Tiecheng; Forsyth, Craig M.; Gitlits, Alex; Hockless, David C. R.; Shen, Qi; Skelton, Brian W.; White, Allan H.","A simple synthesis and a structural survey of homoleptic rare earth(III) 2,6-diphenylphenolates","Journal of the Chemical Society, Dalton Transactions","2000","","6","961","","10.1039/a910277i","","","0.71073","Mo-Kα","","0.059","0.039","","0.052","0.046","","","","1.159","1.18","1.18","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009327","15.5685","0.0004","13.3666","0.0003","10.9262","0.0001","116.029","0.001","92.403","0.001","100.75","0.001","1987.42","0.07","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","Tris(2,6-diphenylphenolato)cerium(III)","","- C54 H39 Ce O3 -","- C54 H39 Ce O3 -","- C108 H78 Ce2 O6 -","2","1","","Deacon, Glen B.; Feng, Tiecheng; Forsyth, Craig M.; Gitlits, Alex; Hockless, David C. R.; Shen, Qi; Skelton, Brian W.; White, Allan H.","A simple synthesis and a structural survey of homoleptic rare earth(III) 2,6-diphenylphenolates","Journal of the Chemical Society, Dalton Transactions","2000","","6","961","","10.1039/a910277i","","","0.71073","MoKα","","0.0405","0.0341","","","0.0819","0.0894","","","","","","1.079","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009328","15.703","0.006","13.537","0.005","10.391","0.003","95.79","0.03","104.77","0.03","102.13","0.03","2060.1","1.3","293","","293","","","","","","","","","4","P -1","-P 1","2","","","","- C54 H39 La O3 -","- C54 H39 La O3 -","- C108 H78 La2 O6 -","2","1","","Deacon, Glen B.; Feng, Tiecheng; Forsyth, Craig M.; Gitlits, Alex; Hockless, David C. R.; Shen, Qi; Skelton, Brian W.; White, Allan H.","A simple synthesis and a structural survey of homoleptic rare earth(III) 2,6-diphenylphenolates","Journal of the Chemical Society, Dalton Transactions","2000","","6","961","","10.1039/a910277i","","","0.71073","Mo-Kα","","0.094","0.044","","0.048","0.039","","","","1.186","1.282","1.282","","","","","has coordinates","288539","2023-12-24","00:56:28",""
"7009329","15.888","0.006","13.524","0.003","10.939","0.004","116.49","0.02","92.86","0.03","103.63","0.02","2011.7","1.3","293","","293","","","","","","","","","4","P -1","-P 1","2","","","","- C54 H39 Lu O3 -","- C54 H39 Lu O3 -","- C108 H78 Lu2 O6 -","2","1","","Deacon, Glen B.; Feng, Tiecheng; Forsyth, Craig M.; Gitlits, Alex; Hockless, David C. R.; Shen, Qi; Skelton, Brian W.; White, Allan H.","A simple synthesis and a structural survey of homoleptic rare earth(III) 2,6-diphenylphenolates","Journal of the Chemical Society, Dalton Transactions","2000","","6","961","","10.1039/a910277i","","","0.71073","Mo-Kα","","0.082","0.041","","0.059","0.048","","","","1.124","1.136","1.136","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009330","7.267","0.001","31.143","0.002","16.758","0.002","90","","90","","90","","3792.6","0.7","298.2","","298.2","","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C12 H20 Au2 Cu N8 -","- C12 H20 Au2 Cu N8 -","- C96 H160 Au16 Cu8 N64 -","8","1","","Yeung, Wai-Fun; Wong, Wing-Tak; Zuo, Jing-Lin; Lau, Tai-Chu","Syntheses and structures of novel heterobimetallic Cu(II)‒Au(I) complexes Cu(cyclen)[Au(CN)2]2 and Cu(pyz)[Au(CN)2]2","Journal of the Chemical Society, Dalton Transactions","2000","","5","629","","10.1039/a910350n","","","0.7107","MoKalpha","","","0.0767","","","0.0748","","","","","1.678","1.678","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009331","6.883","0.001","10.094","0.001","17.831","0.001","90","","90","","90","","1238.8","0.2","298.2","","298.2","","","","","","","","","4","C m c a","-C 2ac 2","64","","","","- C8 Au2 Cu N6 -","- C8 Au2 Cu N6 -","- C32 Au8 Cu4 N24 -","4","","","Yeung, Wai-Fun; Wong, Wing-Tak; Zuo, Jing-Lin; Lau, Tai-Chu","Syntheses and structures of novel heterobimetallic Cu(II)‒Au(I) complexes Cu(cyclen)[Au(CN)2]2 and Cu(pyz)[Au(CN)2]2","Journal of the Chemical Society, Dalton Transactions","2000","","5","629","","10.1039/a910350n","","","0.7107","MoKalpha","","","0.0419","","","0.0503","","","","","1.625","1.625","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009332","16.584","0.003","13.214","0.003","8.419","0.002","90","","90","","90","","1844.9","0.7","100","","100","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C14 H23 Cl2 Nb Si2 -","- C14 H23 Cl2 Nb Si2 -","- C56 H92 Cl8 Nb4 Si8 -","4","0.5","","Bakhmutov, Vladimir I.; Howard, Judith A. K.; Keen, David A.; Kuzmina, Lyudmila G.; Leech, Michael A.; Nikonov, Georgii I.; Vorontsov, Eugenii V.; Wilson, Chick C.","Combined single crystal neutron diffraction and solution NMR relaxation studies of mono- and bis(silyl) substituted niobocene hydrides with nonclassical interligand interactions","Journal of the Chemical Society, Dalton Transactions","2000","","10","1631","","10.1039/b000089m","","neutron","","neutron","","","0.062","","","0.098","","","","","1.185","1.185","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7009333","20.669","0.009","13.19","0.003","15.77","0.007","90","","112.92","0.02","90","","3960","3","294","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C19 H20 Cl2 Cu N4 O -","- C19 H20 Cl2 Cu N4 O -","- C152 H160 Cl16 Cu8 N32 O8 -","8","1","","He, Zhicong; Chaimungkalanont, P. Jinny; Craig, Donald C.; Colbran, Stephen B.","Copper(II) complexes of 6-hydroxymethyl-substituted tris(2-pyridylmethyl)amine ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","9","1419","","10.1039/b000092m","","","0.71073","MoKα","","","0.027","","","","0.042","","","","","","1.52","","","","has coordinates","191942","2020-10-21","18:00:00",""
"7009334","8.204","0.005","16.174","0.003","16.453","0.009","90","","105.85","0.02","90","","2100.2","1.8","294","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H22 Cl2 Cu N4 O2 -","- C20 H22 Cl2 Cu N4 O2 -","- C80 H88 Cl8 Cu4 N16 O8 -","4","1","","He, Zhicong; Chaimungkalanont, P. Jinny; Craig, Donald C.; Colbran, Stephen B.","Copper(II) complexes of 6-hydroxymethyl-substituted tris(2-pyridylmethyl)amine ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","9","1419","","10.1039/b000092m","","","0.71073","MoKα","","","0.029","","","","0.039","","","","","","1.47","","","","has coordinates","191942","2020-10-21","18:00:00",""
"7009335","8.929","0.005","12.006","0.007","14.098","0.009","114.43","0.03","97.71","0.04","91","0.04","1359.1","1.5","294","","","","","","","","","","","7","P -1","-P 1","2","","","","- C27 H29 Cl Cu N4 O5 S -","- C27 H31 Cl Cu N4 O6 S -","- C54 H62 Cl2 Cu2 N8 O12 S2 -","2","1","","He, Zhicong; Chaimungkalanont, P. Jinny; Craig, Donald C.; Colbran, Stephen B.","Copper(II) complexes of 6-hydroxymethyl-substituted tris(2-pyridylmethyl)amine ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","9","1419","","10.1039/b000092m","","","0.71073","MoKα","","","0.031","","","","0.042","","","","","","1.4","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009336","9.206","0.005","20.41","0.004","13.364","0.007","90","","119.44","0.02","90","","2186.8","1.8","294","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C20 H20 B2 Cu F6 N4 O2 -","- C20 H20 B2 Cu F6 N4 O2 -","- C80 H80 B8 Cu4 F24 N16 O8 -","4","1","","He, Zhicong; Chaimungkalanont, P. Jinny; Craig, Donald C.; Colbran, Stephen B.","Copper(II) complexes of 6-hydroxymethyl-substituted tris(2-pyridylmethyl)amine ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","9","1419","","10.1039/b000092m","","","0.71073","MoKα","","","0.048","","","","0.059","","","","","","1.78","","","","has coordinates","191942","2020-10-21","18:00:00",""
"7009337","16.31","0.004","10.311","0.001","28.039","0.006","90","","90.77","0.01","90","","4715","1.6","294","","","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C21 H24 Br1.83 Cl1.18 Cu1.5 N4 O3 -","- C21 H24 Br3 Cu1.5 N4 O3 -","- C168 H192 Br24 Cu12 N32 O24 -","8","1","","He, Zhicong; Chaimungkalanont, P. Jinny; Craig, Donald C.; Colbran, Stephen B.","Copper(II) complexes of 6-hydroxymethyl-substituted tris(2-pyridylmethyl)amine ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","9","1419","","10.1039/b000092m","","","1.54184","CuKα","","","0.026","","","","0.038","","","","","","1.36","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009338","16.793","0.003","14.003","0.002","18.986","0.003","90","","90","","90","","4464.6","1.2","294","","","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C21 H24 Br2 Cu N4 O3 -","- C21 H24 Br2 Cu N4 O3 -","- C168 H192 Br16 Cu8 N32 O24 -","8","1","","He, Zhicong; Chaimungkalanont, P. Jinny; Craig, Donald C.; Colbran, Stephen B.","Copper(II) complexes of 6-hydroxymethyl-substituted tris(2-pyridylmethyl)amine ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","9","1419","","10.1039/b000092m","","","1.54184","CuKα","","","0.031","","","","0.04","","","","","","1.38","","","","has coordinates","191942","2020-10-21","18:00:00",""
"7009339","14.6","0.003","19.021","0.004","19.56","0.003","90","","90.407","0.008","90","","5431.8","1.8","294","","","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C48 H61 B2 Br Cu3 F8 N8 O7.5 -","- C47 H50 B2 Br Cu3 F8 N8 O7.5 -","- C188 H200 B8 Br4 Cu12 F32 N32 O30 -","4","1","","He, Zhicong; Chaimungkalanont, P. Jinny; Craig, Donald C.; Colbran, Stephen B.","Copper(II) complexes of 6-hydroxymethyl-substituted tris(2-pyridylmethyl)amine ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","9","1419","","10.1039/b000092m","","","1.54184","CuKα","","","0.062","","","","0.091","","","","","","3.29","","","","has coordinates","191942","2020-10-21","18:00:00",""
"7009340","17.5248","0.0007","16.7568","0.0007","18.3862","0.0007","90","","110.155","0.01","90","","5068.7","0.5","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C56 H40 N4 P2 S4 Zn -","- C56 H40 N4 P2 S4 Zn -","- C224 H160 N16 P8 S16 Zn4 -","4","1","","Lewis, Gareth R.; Dance, Ian","Crystal supramolecular motifs for [Ph4P]+ salts of [M(mnt)2]2−, [M(mnt)2]−, [{M(mnt)2}2]2−, [M(mnt)3]3− and [M(mnt)3]2− (mnt2− = maleonitriledithiolate) †","Journal of the Chemical Society, Dalton Transactions","2000","","18","3176","","10.1039/b000093k","","","0.71073","MoKα","","0.1477","0.0414","","","0.064","0.0793","","","","","","0.738","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009341","11.148","0.002","15.318","0.003","14.587","0.003","90","","96.92","0.03","90","","2472.8","0.8","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C56 H40 Cu N4 P2 S4 -","- C56 H40 Cu N4 P2 S4 -","- C112 H80 Cu2 N8 P4 S8 -","2","0.5","","Lewis, Gareth R.; Dance, Ian","Crystal supramolecular motifs for [Ph4P]+ salts of [M(mnt)2]2−, [M(mnt)2]−, [{M(mnt)2}2]2−, [M(mnt)3]3− and [M(mnt)3]2− (mnt2− = maleonitriledithiolate) †","Journal of the Chemical Society, Dalton Transactions","2000","","18","3176","","10.1039/b000093k","","","0.71073","MoKα","","0.1262","0.0383","","","0.083","0.0956","","","","","","0.943","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009342","11.223","0.002","15.164","0.003","14.67","0.003","90","","95.9","0.03","90","","2483.4","0.8","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C56 H40 N4 Ni P2 S4 -","- C56 H40 N4 Ni P2 S4 -","- C112 H80 N8 Ni2 P4 S8 -","2","0.5","","Lewis, Gareth R.; Dance, Ian","Crystal supramolecular motifs for [Ph4P]+ salts of [M(mnt)2]2−, [M(mnt)2]−, [{M(mnt)2}2]2−, [M(mnt)3]3− and [M(mnt)3]2− (mnt2− = maleonitriledithiolate) †","Journal of the Chemical Society, Dalton Transactions","2000","","18","3176","","10.1039/b000093k","","","0.71073","MoKα","","0.094","0.0409","","","0.1056","0.118","","","","","","0.956","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009343","8.242","0.002","16.083","0.003","24.806","0.005","90","","105.24","0.03","90","","3172.6","1.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H20 N4 Ni P S4 -","- C32 H20 N4 Ni P S4 -","- C128 H80 N16 Ni4 P4 S16 -","4","1","","Lewis, Gareth R.; Dance, Ian","Crystal supramolecular motifs for [Ph4P]+ salts of [M(mnt)2]2−, [M(mnt)2]−, [{M(mnt)2}2]2−, [M(mnt)3]3− and [M(mnt)3]2− (mnt2− = maleonitriledithiolate) †","Journal of the Chemical Society, Dalton Transactions","2000","","18","3176","","10.1039/b000093k","","","0.71073","MoKα","","0.1142","0.0336","","","0.0769","0.0903","","","","","","0.884","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009344","7.1391","0.0014","16.085","0.003","26.993","0.005","90","","90.83","0.03","90","","3099.3","1","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C64 H40 Co2 N8 P2 S8 -","- C64 H40 Co2 N8 P2 S8 -","- C128 H80 Co4 N16 P4 S16 -","2","0.5","","Lewis, Gareth R.; Dance, Ian","Crystal supramolecular motifs for [Ph4P]+ salts of [M(mnt)2]2−, [M(mnt)2]−, [{M(mnt)2}2]2−, [M(mnt)3]3− and [M(mnt)3]2− (mnt2− = maleonitriledithiolate) †","Journal of the Chemical Society, Dalton Transactions","2000","","18","3176","","10.1039/b000093k","","","0.71073","MoKα","","0.1076","0.0416","","","0.0552","0.0658","","","","","","0.774","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009345","20.401","0.005","15.487","0.004","17.965","0.004","90","","90","","90","","5676","2","293","2","293","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C60 H40 Fe N6 P2 S6 -","- C60 H40 Fe N6 P2 S6 -","- C240 H160 Fe4 N24 P8 S24 -","4","0.5","","Lewis, Gareth R.; Dance, Ian","Crystal supramolecular motifs for [Ph4P]+ salts of [M(mnt)2]2−, [M(mnt)2]−, [{M(mnt)2}2]2−, [M(mnt)3]3− and [M(mnt)3]2− (mnt2− = maleonitriledithiolate) †","Journal of the Chemical Society, Dalton Transactions","2000","","18","3176","","10.1039/b000093k","","","1.5418","CuKα","","0.249","0.033","","","0.072","0.0995","","","","","","0.745","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009346","27.978","0.006","13.402","0.003","19.882","0.004","90","","130.09","0.03","90","","5703","3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C60 H40 Fe N6 P2 S6 -","- C60 H40 Fe N6 P2 S6 -","- C240 H160 Fe4 N24 P8 S24 -","4","0.5","","Lewis, Gareth R.; Dance, Ian","Crystal supramolecular motifs for [Ph4P]+ salts of [M(mnt)2]2−, [M(mnt)2]−, [{M(mnt)2}2]2−, [M(mnt)3]3− and [M(mnt)3]2− (mnt2− = maleonitriledithiolate) †","Journal of the Chemical Society, Dalton Transactions","2000","","18","3176","","10.1039/b000093k","","","1.5418","CuKα","","0.1327","0.0334","","","0.1006","0.1364","","","","","","0.716","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009347","24.5937","0.0009","14.7251","0.0006","25.2038","0.001","90","","117.822","0.01","90","","8072.3","0.9","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C86.25 H64.5 Cr N6 O0.75 P3 S6 -","- C86.25 H64.5 Cr N6 O0.75 P3 S6 -","- C345 H258 Cr4 N24 O3 P12 S24 -","4","1","","Lewis, Gareth R.; Dance, Ian","Crystal supramolecular motifs for [Ph4P]+ salts of [M(mnt)2]2−, [M(mnt)2]−, [{M(mnt)2}2]2−, [M(mnt)3]3− and [M(mnt)3]2− (mnt2− = maleonitriledithiolate) †","Journal of the Chemical Society, Dalton Transactions","2000","","18","3176","","10.1039/b000093k","","","0.71073","MoKα","","0.0991","0.0438","","","0.0939","0.1092","","","","","","0.835","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009348","20.29","0.005","15.548","0.004","17.986","0.004","90","","90","","90","","5674","2","293","2","293","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C60 H40 Cr N6 P2 S6 -","- C60 H40 Cr N6 P2 S6 -","- C240 H160 Cr4 N24 P8 S24 -","4","0.5","","Lewis, Gareth R.; Dance, Ian","Crystal supramolecular motifs for [Ph4P]+ salts of [M(mnt)2]2−, [M(mnt)2]−, [{M(mnt)2}2]2−, [M(mnt)3]3− and [M(mnt)3]2− (mnt2− = maleonitriledithiolate) †","Journal of the Chemical Society, Dalton Transactions","2000","","18","3176","","10.1039/b000093k","","","0.71073","MoKα","","0.1186","0.0649","","","0.1573","0.1859","","","","","","0.84","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009349","11.101","0.006","16.935","0.007","9.974","0.004","95.32","0.04","110.15","0.04","107.24","0.03","1641","1.5","296.2","","","","","","","","","","","6","P -1","-P 1","2","","","","- C30 H42 N2 O5 Rh2 S2 -","- C30 H42 N2 O5 Rh2 S2 -","- C60 H84 N4 O10 Rh4 S4 -","2","1","","Yamanari, Kazuaki; Fukuda, Ito; Yamamoto, Shiori; Kushi, Yoshihiko; Fuyuhiro, Akira; Kubota, Naoko; Fukuo, Tsuyoshi; Arakawa, Ryuichi","Structural difference due to intramolecular stacking interactions in dinuclear rhodium(III) complexes [{Rh(η5-C5Me5)(L)}2]n+ containing pyrimidine-2-thionate and related ligands","Journal of the Chemical Society, Dalton Transactions","2000","","13","2131","","10.1039/b000098l","","","0.7107","MoKα","","","0.0328","","","","0.0512","","","","","","2.358","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009350","15.727","0.004","13.366","0.003","21.707","0.002","90","","98.32","0.01","90","","4514.9","1.6","296.2","","296.2","","","","","","","","","8","P 1 21/a 1","-P 2yab","14","","","","- C35 H50 F12 N4 O P2 Rh2 S2 -","- C35 H30 F12 N4 O P2 Rh2 S2 -","- C140 H120 F48 N16 O4 P8 Rh8 S8 -","4","1","","Yamanari, Kazuaki; Fukuda, Ito; Yamamoto, Shiori; Kushi, Yoshihiko; Fuyuhiro, Akira; Kubota, Naoko; Fukuo, Tsuyoshi; Arakawa, Ryuichi","Structural difference due to intramolecular stacking interactions in dinuclear rhodium(III) complexes [{Rh(η5-C5Me5)(L)}2]n+ containing pyrimidine-2-thionate and related ligands","Journal of the Chemical Society, Dalton Transactions","2000","","13","2131","","10.1039/b000098l","","","0.7107","MoKα","","0.0523","0.0523","","","0.0691","0.0691","","","","","","2.184","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009351","15.164","0.003","12.762","0.004","21.467","0.003","90","","108.04","0.01","90","","3950.1","1.6","296.2","","296.2","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C30 H40 Cl2 N4 O8 Rh2 S2 -","- C30 H30 Cl2 N4 O8 Rh2 S2 -","- C120 H120 Cl8 N16 O32 Rh8 S8 -","4","1","","Yamanari, Kazuaki; Fukuda, Ito; Yamamoto, Shiori; Kushi, Yoshihiko; Fuyuhiro, Akira; Kubota, Naoko; Fukuo, Tsuyoshi; Arakawa, Ryuichi","Structural difference due to intramolecular stacking interactions in dinuclear rhodium(III) complexes [{Rh(η5-C5Me5)(L)}2]n+ containing pyrimidine-2-thionate and related ligands","Journal of the Chemical Society, Dalton Transactions","2000","","13","2131","","10.1039/b000098l","","","0.7107","MoKα","","0.053","0.053","","","0.0701","0.0701","","","","","","2.115","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009352","20.16","0.003","17.502","0.003","10.3781","0.0014","90","","90","","90","","3661.8","1","180","2","180","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C13 H23 N O9 S U -","- C13 H23 N O9 S U -","- C104 H184 N8 O72 S8 U8 -","8","1","","Venkateswara Rao, P.; Rao, Chebrolu P.; Sreedhara, Alavattam; Wegelius, Elina K.; Rissanen, Kari; Kolehmainen, Erkki","Synthesis, structure and reactivity of trans-UO22+ complexes of OH-containing ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","7","1213","","10.1039/b000142m","","","0.71069","MoKα","","0.048","0.0338","","0.0905","0.0865","","","","1.06","1.148","1.148","","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009353","16.775","","7.762","","17.891","","90","","101.07","","90","","2286.2","","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C44 H50 N4 O14 S2 U2 -","- C44 H50 N4 O14 S2 U2 -","- C88 H100 N8 O28 S4 U4 -","2","0.5","","Venkateswara Rao, P.; Rao, Chebrolu P.; Sreedhara, Alavattam; Wegelius, Elina K.; Rissanen, Kari; Kolehmainen, Erkki","Synthesis, structure and reactivity of trans-UO22+ complexes of OH-containing ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","7","1213","","10.1039/b000142m","","","0.71073","MoKα","","0.0721","0.0307","","0.0648","0.0599","","","","0.932","1.079","1.079","","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009354","12.01","0.003","16.968","0.002","17.342","0.003","90","","90","","90","","3534.1","1.2","180","2","180","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C14 H19 N O7 S U -","- C14 H21 N O7 S U -","- C112 H168 N8 O56 S8 U8 -","8","1","","Venkateswara Rao, P.; Rao, Chebrolu P.; Sreedhara, Alavattam; Wegelius, Elina K.; Rissanen, Kari; Kolehmainen, Erkki","Synthesis, structure and reactivity of trans-UO22+ complexes of OH-containing ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","7","1213","","10.1039/b000142m","","","0.71069","MoKα","","0.0601","0.0349","","0.0936","0.0889","","","","1.054","1.194","1.194","","","","","has coordinates,has disorder","179797","2020-10-21","18:00:00",""
"7009355","9.097","0.002","18.277","0.002","11.562","0.002","90","","109.01","0.02","90","","1817.5","0.6","293","2","293","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C14 H19 Br N2 O7 U -","- C14 H19 Br N2 O7 U -","- C56 H76 Br4 N8 O28 U4 -","4","1","","Venkateswara Rao, P.; Rao, Chebrolu P.; Sreedhara, Alavattam; Wegelius, Elina K.; Rissanen, Kari; Kolehmainen, Erkki","Synthesis, structure and reactivity of trans-UO22+ complexes of OH-containing ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","7","1213","","10.1039/b000142m","","","0.71073","MoKα","","0.036","0.0294","","0.0705","0.0698","","","","0.947","1.075","1.075","","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009356","7.534","0.002","17.011","0.007","13.069","0.004","90","","97.11","0.02","90","","1662.1","1","180","2","180","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C13 H21 N O5 S U -","- C13 H21 N O5 S U -","- C52 H84 N4 O20 S4 U4 -","4","1","","Venkateswara Rao, P.; Rao, Chebrolu P.; Sreedhara, Alavattam; Wegelius, Elina K.; Rissanen, Kari; Kolehmainen, Erkki","Synthesis, structure and reactivity of trans-UO22+ complexes of OH-containing ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","7","1213","","10.1039/b000142m","","","0.71073","MoKα","","0.077","0.0568","","0.1538","0.144","","","","0.956","1.04","1.04","","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009357","8.142","0.002","25.595","0.005","10.927","0.002","90","0.014","107.86","0.02","90","0.02","2167.4","0.8","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C17 H25 Br N3 O7 U -","- C17 H25 Br N3 O7 U -","- C68 H100 Br4 N12 O28 U4 -","4","1","","Venkateswara Rao, P.; Rao, Chebrolu P.; Sreedhara, Alavattam; Wegelius, Elina K.; Rissanen, Kari; Kolehmainen, Erkki","Synthesis, structure and reactivity of trans-UO22+ complexes of OH-containing ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","7","1213","","10.1039/b000142m","","","0.71073","MoKα","","0.0647","0.0486","","0.1308","0.1254","","","","1.077","1.153","1.153","","","","","has coordinates,has disorder","179797","2020-10-21","18:00:00",""
"7009358","7.6825","0.0015","17.995","0.003","32.276","0.004","90","","90","","90","","4462","1.3","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C18 H24 N O7.5 S1.5 U -","- C17 H23 N O8 S U -","- C136 H184 N8 O64 S8 U8 -","8","1","","Venkateswara Rao, P.; Rao, Chebrolu P.; Sreedhara, Alavattam; Wegelius, Elina K.; Rissanen, Kari; Kolehmainen, Erkki","Synthesis, structure and reactivity of trans-UO22+ complexes of OH-containing ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","7","1213","","10.1039/b000142m","","","0.71073","MoKα","","0.0937","0.0506","","0.1713","0.1497","","","","1.104","1.237","1.237","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009359","4.9199","0.0002","14.255","0.001","14.011","0.003","90","","94.98","0.007","90","","978.9","0.2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-diaqua-μ(O,O',O'',O'''chloranilato)iron(II) hydrate","","- C24 H24 Cl8 Fe4 O28 -","- C6 H6 Cl2 Fe O7 -","- C24 H24 Cl8 Fe4 O28 -","4","0.5","","Abrahams, Brendan F.; Lu, Kevin D.; Moubaraki, Boujemaa; Murray, Keith S.; Robson, Richard","X-Ray diffraction and magnetic studies on a series of isostructural divalent metal chloranilates with zigzag polymeric chain structures and on a dinuclear iron(III) chloranilate †","Journal of the Chemical Society, Dalton Transactions","2000","","11","1793","","10.1039/b000192i","","","1.5418","CuKα","","0.0361","0.0315","","","0.0778","0.0802","","","","","","1.044","","","","has coordinates","194601","2020-10-21","18:00:00",""
"7009360","4.8655","0.0005","14.575","0.001","14.252","0.002","90","","92.95","0.01","90","","1009.34","0.19","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-diaqua-μ(O,O',O'',O'''chloranilato)cadmium(II) hydrate","","- C24 H24 Cd4 Cl8 O28 -","- C6 H6 Cd Cl2 O7 -","- C24 H24 Cd4 Cl8 O28 -","4","0.5","","Abrahams, Brendan F.; Lu, Kevin D.; Moubaraki, Boujemaa; Murray, Keith S.; Robson, Richard","X-Ray diffraction and magnetic studies on a series of isostructural divalent metal chloranilates with zigzag polymeric chain structures and on a dinuclear iron(III) chloranilate †","Journal of the Chemical Society, Dalton Transactions","2000","","11","1793","","10.1039/b000192i","","","1.5418","CuKα","","0.0253","0.0243","","","0.0679","0.0684","","","","","","1.138","","","","has coordinates","194601","2020-10-21","18:00:00",""
"7009361","6.909","0.002","9.894","0.004","11.391","0.003","74.91","0.02","78.45","0.02","75.59","0.03","720.5","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","tetraaquatris(chloranilato)diiron(III) tetrahydrate","","- C18 H16 Cl6 Fe2 O20 -","- C18 H8 Cl6 Fe2 O20 -","- C18 H8 Cl6 Fe2 O20 -","1","0.5","","Abrahams, Brendan F.; Lu, Kevin D.; Moubaraki, Boujemaa; Murray, Keith S.; Robson, Richard","X-Ray diffraction and magnetic studies on a series of isostructural divalent metal chloranilates with zigzag polymeric chain structures and on a dinuclear iron(III) chloranilate †","Journal of the Chemical Society, Dalton Transactions","2000","","11","1793","","10.1039/b000192i","","","1.5418","CuKα","","0.054","0.0454","","","0.1204","0.1265","","","","","","1.05","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009362","8.693","0.003","13.513","0.007","14.137","0.006","99.88","0.04","91.72","0.04","102.42","0.03","1593.9","1.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H25 Cl2 N5 O7 Ru -","- C32 H22 Cl2 N5 O7 Ru -","- C64 H44 Cl4 N10 O14 Ru2 -","2","1","","Mondal, Biplab; Chakraborty, Soma; Munshi, Pradip; Walawalkar, Mrinalini G.; Kumar Lahiri, Goutam","Ruthenium-(II)/-(III) terpyridine complexes incorporating imine functionalities. Synthesis, structure, spectroscopic and electrochemical properties †","Journal of the Chemical Society, Dalton Transactions","2000","","14","2327","","10.1039/b000257g","","","0.7093","MoKα","","0.0616","0.0463","","","0.1129","0.1257","","","","","","1.111","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009363","10.106","0.002","10.656","0.002","19.655","0.004","90","","90","","90","","2116.6","0.7","293","2","293","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C12 H30 N2 Pt2 S4 -","- C12 H30 N2 Pt2 S4 -","- C48 H120 N8 Pt8 S16 -","4","0.5","","Heard, Peter J.; Kite, Kenneth; Nielsen, Julie Søgaard; Tocher, Derek A.","Trimethylplatinum(IV) complexes of dithiocarbamato ligands: an experimental NMR study on the barrier to C‒N bond rotation","Journal of the Chemical Society, Dalton Transactions","2000","","8","1349","","10.1039/b000264j","","","0.71073","MoKα","","0.0774","0.0522","","0.1846","0.1322","","","","1.134","1.033","1.033","","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009364","10.611","0.002","17.725","0.004","14.373","0.003","90","","94.37","0.03","90","","2695.4","1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H30 N2 Pt2 S4 -","- C20 H30 N2 Pt2 S4 -","- C80 H120 N8 Pt8 S16 -","4","1","","Heard, Peter J.; Kite, Kenneth; Nielsen, Julie Søgaard; Tocher, Derek A.","Trimethylplatinum(IV) complexes of dithiocarbamato ligands: an experimental NMR study on the barrier to C‒N bond rotation","Journal of the Chemical Society, Dalton Transactions","2000","","8","1349","","10.1039/b000264j","","","0.71073","MoKα","","0.1179","0.059","","0.2103","0.1316","","","","1.11","0.912","0.912","","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009365","11.287","0.004","18.278","0.035","20.606","0.015","90","","90","","90","","4251","9","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C40 H56 N4 S4 U -","- C40 H56 N4 S4 U -","- C160 H224 N16 S16 U4 -","4","1","","Danopoulos, Andreas A.; Hankin, Danielle M.; Cafferkey, Sean M.; Hursthouse, Michael B.","η2-Sulfenamido complexes of uranium †","Journal of the Chemical Society, Dalton Transactions","2000","","10","1613","","10.1039/b000304m","","","0.71069","MoKα","","0.1827","0.0497","","0.1343","0.0804","","","","0.369","0.682","0.682","","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009366","9.68","0.006","17.226","0.01","18.166","0.005","90","","104.23","0.07","90","","2936","3","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H44 Cl N S U -","- C30 H44 Cl N S U -","- C120 H176 Cl4 N4 S4 U4 -","4","1","","Danopoulos, Andreas A.; Hankin, Danielle M.; Cafferkey, Sean M.; Hursthouse, Michael B.","η2-Sulfenamido complexes of uranium †","Journal of the Chemical Society, Dalton Transactions","2000","","10","1613","","10.1039/b000304m","","","0.71069","MoKα","","0.2035","0.074","","","0.1471","0.1893","","","","","","0.599","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009367","9.724","0.004","17.377","0.015","18.196","0.007","90","","103.74","0.04","90","","2987","3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H44 Br N S U -","- C30 H44 Br N S U -","- C120 H176 Br4 N4 S4 U4 -","4","1","","Danopoulos, Andreas A.; Hankin, Danielle M.; Cafferkey, Sean M.; Hursthouse, Michael B.","η2-Sulfenamido complexes of uranium †","Journal of the Chemical Society, Dalton Transactions","2000","","10","1613","","10.1039/b000304m","","","0.71069","MoKα","","0.0915","0.0403","","","0.0672","0.0764","","","","","","0.601","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009368","9.4952","0.0006","14.1078","0.0008","15.321","0.0009","112.688","0.001","93.374","0.001","90.217","0.001","1889.5","0.2","273.2","","","","","","","","","","","4","P -1","-P 1","2","","","","- C24 H60 O13 Si4 -","- C24 H58 O13 Si4 -","- C48 H116 O26 Si8 -","2","1","","Rulkens, Ron; Coles, Martyn P.; Tilley, T. Don","Synthesis and structure of the (tetrahydroxy)oligosiloxane [(tBuO)3SiOSi(OH)2]2O","Journal of the Chemical Society, Dalton Transactions","2000","","5","627","","10.1039/b000322k","","","0.7107","MoKα","","","0","","","","0.0579","","","","","","2.15","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7009369","13.678","0.0005","18.93","0.001","15.8188","0.0009","90","","92.227","0.003","90","","4092.8","0.4","173","","173","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C38 H36 N6 O19 Tb2 -","- C38 H18 N6 O19 Tb2 -","- C152 H72 N24 O76 Tb8 -","4","1","","Bünzli, Jean-Claude G.; Charbonnière, Loïc J.; Ziessel, Raymond F.","Structural and photophysical properties of LnIII complexes with 2,2'-bipyridine-6,6'-dicarboxylic acid: surprising formation of a H-bonded network of bimetallic entities†","Journal of the Chemical Society, Dalton Transactions","2000","","12","1917","","10.1039/b000436g","","","0.71073","Mo-Kα","","0.057","0.037","","0.175","","0.053","","","3.446","","","1.041","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009370","9.461","0.0009","11.593","0.002","9.372","0.001","93.56","0.01","96.581","0.01","72.653","0.009","974.3","0.2","150.1","","150.1","","","","","","","","","6","P -1","-P 1","2","","","","- C12 H16 F3 Mn O6 S5 -","- C12 H16 F3 Mn O6 S5 -","- C24 H32 F6 Mn2 O12 S10 -","2","1","","Patel, Bhavesh; Reid, Gillian","Stabilisation of the [Mn(CO)2]+ fragment by thioether macrocyclic ligands; synthesis, spectroscopic and structural characterisation","Journal of the Chemical Society, Dalton Transactions","2000","","8","1303","","10.1039/b000446o","","","0.71073","MoKalpha","","","0.028","","","0.0395","","","","","2.543","2.543","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009371","11.42","0.004","14.642","0.003","13.605","0.003","90","","96.55","0.02","90","","2260.1","1","150","","150","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H20 F3 Mn O6 S6 -","- C14 H20 F3 Mn O6 S6 -","- C56 H80 F12 Mn4 O24 S24 -","4","1","","Patel, Bhavesh; Reid, Gillian","Stabilisation of the [Mn(CO)2]+ fragment by thioether macrocyclic ligands; synthesis, spectroscopic and structural characterisation","Journal of the Chemical Society, Dalton Transactions","2000","","8","1303","","10.1039/b000446o","","","0.71073","MoKalpha","","","0.0718","","","0.1012","","","","","4.076","4.076","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009372","14.0952","0.0016","15.267","0.003","9.6411","0.0015","90.983","0.017","90.332","0.014","86.531","0.013","2070.6","0.6","150","0.1","150","0.1","","","","","","","","7","P -1","-P 1","2","","cis-dicarbonyl manganese(I) 1,4,7,10-tetrathiacyclododecane . 1/2CHCl2 solvate","","- C11.5 H16.5 Cl1.5 F3 Mn O5 S5 -","- C11.5 H15.3 Cl1.5 F3 Mn O5 S5 -","- C46 H61.2 Cl6 F12 Mn4 O20 S20 -","4","2","","Patel, Bhavesh; Reid, Gillian","Stabilisation of the [Mn(CO)2]+ fragment by thioether macrocyclic ligands; synthesis, spectroscopic and structural characterisation","Journal of the Chemical Society, Dalton Transactions","2000","","8","1303","","10.1039/b000446o","","","0.71073","MoKα","","0.1631","0.0657","","","0.1643","0.2092","","","","","","1.023","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009373","10.273","0.003","6.524","0.004","10.08","0.004","89","","116.83","0.02","89","","602.5","0.5","493.2","","493.2","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C2 H4 Mn4 O14 P2 -","- C2 H4 Mn4 O14 P2 -","- C4 H8 Mn8 O28 P4 -","2","0.5","","Lethbridge, Zoe A. D.; Hillier, Adrian D.; Cywinski, Robert; Lightfoot, Philip","Mixed inorganic‒organic anion frameworks: synthesis and characterisation of [Mn4(PO4)2(C2O4)(H2O)2] and [H3N(CH2)3NH3][Mn2(HPO4)2(C2O4)(H2O)2]","Journal of the Chemical Society, Dalton Transactions","2000","","10","1595","","10.1039/b000449i","","","0.7107","MoKalpha","","","0.0314","","","0.035","","","","","2.375","2.375","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009374","5.474","0.002","15.737","0.002","9.056","0.002","90","","93.47","0.03","90","","778.7","0.3","493.2","","493.2","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C5 H18 Mn2 N2 O14 P2 -","- C7 H34 Mn2 N4 O14 P2 -","- C14 H68 Mn4 N8 O28 P4 -","2","0.5","","Lethbridge, Zoe A. D.; Hillier, Adrian D.; Cywinski, Robert; Lightfoot, Philip","Mixed inorganic‒organic anion frameworks: synthesis and characterisation of [Mn4(PO4)2(C2O4)(H2O)2] and [H3N(CH2)3NH3][Mn2(HPO4)2(C2O4)(H2O)2]","Journal of the Chemical Society, Dalton Transactions","2000","","10","1595","","10.1039/b000449i","","","0.7107","MoKalpha","","","0.0408","","","0.0388","","","","","2.67","2.67","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009375","17.496","0.006","13.42","0.007","16.247","0.006","90","","99.78","0.03","90","","3759","3","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C26 H62 Li2 N4 Si3 -","- C26 H62 Li2 N4 Si3 -","- C104 H248 Li8 N16 Si12 -","4","0.5","","Fernández-Galán, Rafael; Hitchcock, Peter B.; Lappert, Michael F.; Antiñolo, Antonio; Rodríguez, Ana M.","Synthesis and structural characterisation of new ansa-bis(propene)s and {ansa-bis(allyl)}alkali metal and {ansa-bis(allyl)}transition metal complexes","Journal of the Chemical Society, Dalton Transactions","2000","","11","1743","","10.1039/b000451k","","","0.71073","MoKα","","0.1909","0.0899","","0.2726","0.2103","","","","1.023","1.15","1.15","","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009376","11.512","0.002","17.267","0.003","19.367","0.002","90","","103.39","0.02","90","","3745.1","1","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C28 H60 Si6 Zr -","- C28 H60 Si6 Zr -","- C112 H240 Si24 Zr4 -","4","0.5","","Fernández-Galán, Rafael; Hitchcock, Peter B.; Lappert, Michael F.; Antiñolo, Antonio; Rodríguez, Ana M.","Synthesis and structural characterisation of new ansa-bis(propene)s and {ansa-bis(allyl)}alkali metal and {ansa-bis(allyl)}transition metal complexes","Journal of the Chemical Society, Dalton Transactions","2000","","11","1743","","10.1039/b000451k","","","0.71073","MoKα","","0.1216","0.0627","","0.1661","0.1357","","","","1.043","1.096","1.096","","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009377","8.274","0.002","13.653","0.003","27.992","0.006","90","","92.56","0.03","90","","3159","1.2","136","2","136","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H36 N14 O15 Pd3 Pt -","- C14 H36 N14 O15 Pd3 Pt -","- C56 H144 N56 O60 Pd12 Pt4 -","4","1","","Schneider, Alexandra; Freisinger, Eva; Beck, Bettina; Lippert, Bernhard","Ready formation of water-stable PtII-(μ-NH2)-PdII species through combination of trans-[(NH3)2PtIIL2] (L = N,N'-heterocycle) and [enPd(H2O)2]2+","Journal of the Chemical Society, Dalton Transactions","2000","","6","837","","10.1039/b000456l","","","0.71069","MoKα","","0.0405","0.0248","","0.049","0.0458","","","","0.92","1.013","1.013","","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009378","5.047","0.001","9.58","0.002","13.568","0.003","105.65","0.03","98.84","0.03","98.6","0.03","611.5","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C5 H15 Br N5 O Pd Pt0.5 -","- C5 H13 Br N5 O Pd Pt0.5 -","- C10 H26 Br2 N10 O2 Pd2 Pt -","2","1","","Schneider, Alexandra; Freisinger, Eva; Beck, Bettina; Lippert, Bernhard","Ready formation of water-stable PtII-(μ-NH2)-PdII species through combination of trans-[(NH3)2PtIIL2] (L = N,N'-heterocycle) and [enPd(H2O)2]2+","Journal of the Chemical Society, Dalton Transactions","2000","","6","837","","10.1039/b000456l","","","0.71069","MoKα","","0.0423","0.0325","","0.0944","0.0827","","","","1.018","1.069","1.069","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009379","11.046","0.002","12.056","0.002","12.971","0.003","101.93","0.03","102.74","0.03","112.3","0.03","1475.9","0.8","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C14 H32.6 Cl N13 O10.3 Pd3 Pt -","- C14 H30 Cl N13 O10.3 Pd3 Pt -","- C28 H60 Cl2 N26 O20.6 Pd6 Pt2 -","2","1","","Schneider, Alexandra; Freisinger, Eva; Beck, Bettina; Lippert, Bernhard","Ready formation of water-stable PtII-(μ-NH2)-PdII species through combination of trans-[(NH3)2PtIIL2] (L = N,N'-heterocycle) and [enPd(H2O)2]2+","Journal of the Chemical Society, Dalton Transactions","2000","","6","837","","10.1039/b000456l","","","0.71069","MoKα","","0.0858","0.0369","","0.0667","0.0597","","","","0.847","1.021","1.021","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009380","11.641","0.002","11.757","0.002","14.136","0.003","111.96","0.03","105.48","0.03","100.62","0.03","1639.6","0.9","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C14 H39.2 Br2 N12 O10.6 Pd3 Pt -","- C14 H30 Br2 N12 O10.6 Pd3 Pt -","- C28 H60 Br4 N24 O21.2 Pd6 Pt2 -","2","1","","Schneider, Alexandra; Freisinger, Eva; Beck, Bettina; Lippert, Bernhard","Ready formation of water-stable PtII-(μ-NH2)-PdII species through combination of trans-[(NH3)2PtIIL2] (L = N,N'-heterocycle) and [enPd(H2O)2]2+","Journal of the Chemical Society, Dalton Transactions","2000","","6","837","","10.1039/b000456l","","","0.71069","MoKα","","0.0791","0.0412","","0.1024","0.0835","","","","0.973","1.098","1.098","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7009381","24.94","0.002","9.7718","0.0008","10.1941","0.0006","90","","109.64","0.005","90","","2339.9","0.3","293","2","293","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C28 H70 Co2 Gd2 N4 O34 -","- C28 H36 Co2 Gd2 N4 O34 -","- C56 H72 Co4 Gd4 N8 O68 -","2","0.5","","Ma, Bao-Qing; Gao, Song; Bai, Ou; Sun, Hao-Ling; Xu, Guang-Xian","Synthesis and structure of an unprecedented heterometallic tetranuclear cluster [Gd2Co2(μ4-O)(μ-H2O)(CDTA)2(H2O)6]·10H2O (H4CDTA = trans-1,2-cyclohexanedinitrilotetraacetic acid)","Journal of the Chemical Society, Dalton Transactions","2000","","7","1003","","10.1039/b000490l","","","0.71073","MoKα","","0.0808","0.0712","","","0.1821","0.1932","","","","","","1.173","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009382","24.859","0.003","13.2164","0.001","7.0968","0.0006","90","","96.19","0.02","90","","2318","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C25 H24 Cu N4 O6 -","- C25 H23 Cu N4 O6 -","- C100 H92 Cu4 N16 O24 -","4","0.5","","Gao, En-Qing; Bu, Wei-Ming; Yang, Guang-Ming; Liao, Dai-Zheng; Jiang, Zong-Hui; Yan, Shi-Ping; Wang, Geng-Lin","Crystal structure, redox and spectral properties of copper(II) complexes with macrocyclic ligands incorporating both oxamido and imine groups","Journal of the Chemical Society, Dalton Transactions","2000","","9","1431","","10.1039/b000504p","","","0.71073","MoKα","","0.0626","0.0578","","0.1537","0.1331","","","","1.066","1.15","1.15","","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009383","23.871","0.003","8.0074","0.0012","25.775","0.003","90","","115.663","0.008","90","","4440.8","1.1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H22 Cu N4 O6 -","- C24 H22 Cu N4 O6 -","- C192 H176 Cu8 N32 O48 -","8","1","","Gao, En-Qing; Bu, Wei-Ming; Yang, Guang-Ming; Liao, Dai-Zheng; Jiang, Zong-Hui; Yan, Shi-Ping; Wang, Geng-Lin","Crystal structure, redox and spectral properties of copper(II) complexes with macrocyclic ligands incorporating both oxamido and imine groups","Journal of the Chemical Society, Dalton Transactions","2000","","9","1431","","10.1039/b000504p","","","0.71073","MoKα","","0.0618","0.0492","","0.1062","0.0817","","","","1.001","1.107","1.107","","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009384","10.5216","0.0006","16.7671","0.0009","28.7044","0.0016","90","","89.988","0.001","90","","5063.9","0.5","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C44 H57 Cl3 N6 O15 Zn2 -","- C44 H57 Cl3 N6 O15 Zn2 -","- C176 H228 Cl12 N24 O60 Zn8 -","4","1","","Plater, M. John; Foreman, Mark R. St. J.; Gelbrich, Thomas; Hursthouse, Michael B.","Synthesis and characterisation of infinite di- and tri-nuclear zinc co-ordination networks with flexible dipyridyl ligands","Journal of the Chemical Society, Dalton Transactions","2000","","13","1995","","10.1039/b000566p","","","0.71073","MoKα","","0.073","0.0479","","","0.0999","0.1085","","","","","","0.975","","","","has coordinates,has disorder","179797","2020-10-21","18:00:00",""
"7009385","13.1599","0.0004","21.636","0.001","19.4741","0.0009","90","","103.855","0.002","90","","5383.5","0.4","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C39 H62.33 N9 O20.67 Zn3 -","- C39 H62.1 N9 O20.67 Zn3 -","- C156 H248.4 N36 O82.68 Zn12 -","4","1","","Plater, M. John; Foreman, Mark R. St. J.; Gelbrich, Thomas; Hursthouse, Michael B.","Synthesis and characterisation of infinite di- and tri-nuclear zinc co-ordination networks with flexible dipyridyl ligands","Journal of the Chemical Society, Dalton Transactions","2000","","13","1995","","10.1039/b000566p","","","0.71073","MoKα","","0.1223","0.059","","","0.1323","0.1504","","","","","","0.952","","","","has coordinates,has disorder","179797","2020-10-21","18:00:00",""
"7009386","17.255","0.0004","34.4538","0.0006","24.5191","0.001","90","","90","","90","","14576.6","0.7","293","2","293","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C136 H180 Cl6 N16 O27 Zn4 -","- C136 H178 Cl6 N16 O27 Zn4 -","- C544 H712 Cl24 N64 O108 Zn16 -","4","0.5","","Plater, M. John; Foreman, Mark R. St. J.; Gelbrich, Thomas; Hursthouse, Michael B.","Synthesis and characterisation of infinite di- and tri-nuclear zinc co-ordination networks with flexible dipyridyl ligands","Journal of the Chemical Society, Dalton Transactions","2000","","13","1995","","10.1039/b000566p","","","0.71073","MoKα","","0.2385","0.1108","","","0.1996","0.221","","","","","","1.272","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009387","10.338","0.002","12.819","0.002","15.032","0.005","90","","90","","90","","1992.1","0.8","223","2","223","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C19 H33 N Si Zr -","- C19 H33 N Si Zr -","- C76 H132 N4 Si4 Zr4 -","4","0.5","","Dahlmann, Marc; Schottek, Jörg; Fröhlich, Roland; Kunz, Doris; Nissinen, Maija; Erker, Gerhard; Fink, Gerhard; Kleinschmidt, Ralph","Structural characterization of M(s-cis-η4-C4H6)(Me4C5SiMe2NR) (M = Ti or Zr, R = CMe3 or CHCMe(1-C10H7))","Journal of the Chemical Society, Dalton Transactions","2000","","12","1881","","10.1039/b000570n","","","0.71073","MoKα","","0.0991","0.0401","","","0.0964","0.1173","","","","","","0.999","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009388","10.496","0.004","12.629","0.002","15.201","0.002","90","","90","","90","","2015","0.9","223","2","223","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C19 H33 N Si Ti -","- C19 H33 N Si Ti -","- C76 H132 N4 Si4 Ti4 -","4","0.5","","Dahlmann, Marc; Schottek, Jörg; Fröhlich, Roland; Kunz, Doris; Nissinen, Maija; Erker, Gerhard; Fink, Gerhard; Kleinschmidt, Ralph","Structural characterization of M(s-cis-η4-C4H6)(Me4C5SiMe2NR) (M = Ti or Zr, R = CMe3 or CHCMe(1-C10H7))","Journal of the Chemical Society, Dalton Transactions","2000","","12","1881","","10.1039/b000570n","","","0.71073","MoKα","","0.1325","0.0642","","","0.1944","0.2129","","","","","","1.068","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009389","8.567","0.001","16.693","0.001","17.164","0.001","90","","90","","90","","2454.6","0.4","223","2","223","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C27 H35 N Si Zr -","- C27 H35 N Si Zr -","- C108 H140 N4 Si4 Zr4 -","4","1","","Dahlmann, Marc; Schottek, Jörg; Fröhlich, Roland; Kunz, Doris; Nissinen, Maija; Erker, Gerhard; Fink, Gerhard; Kleinschmidt, Ralph","Structural characterization of M(s-cis-η4-C4H6)(Me4C5SiMe2NR) (M = Ti or Zr, R = CMe3 or CHCMe(1-C10H7))","Journal of the Chemical Society, Dalton Transactions","2000","","12","1881","","10.1039/b000570n","","","0.71073","MoKα","","0.029","0.0222","","","0.06","0.0621","","","","","","1.069","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009390","18.104","0.003","11.5602","0.0016","14.2505","0.0019","90","","90","","90","","2982.4","0.8","160","2","160","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C32 H32 Li2 N6 -","- C32 H32 Li2 N6 -","- C128 H128 Li8 N24 -","4","1","","Clegg, William; Horsburgh, Lynne; Liddle, Stephen T.; Mackenzie, Fiona M.; Mulvey, Robert E.; Robertson, Alan","The changing structural chemistry of lithium anilide on solvation by pyridine, 4-methylpyridine or 4-tert-butylpyridine","Journal of the Chemical Society, Dalton Transactions","2000","","7","1225","","10.1039/b000576m","","","0.71073","MoKα","","0.0699","0.0604","","","0.1514","0.1594","","","","","","1.095","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009391","42.3971","0.0006","9.614","0.002","18.024","0.004","90","","98.287","0.006","90","","7270","2","160","2","160","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C44.5 H44 Li2 N6 -","- C36 H40 Li2 N6 -","- C288 H320 Li16 N48 -","8","1","","Clegg, William; Horsburgh, Lynne; Liddle, Stephen T.; Mackenzie, Fiona M.; Mulvey, Robert E.; Robertson, Alan","The changing structural chemistry of lithium anilide on solvation by pyridine, 4-methylpyridine or 4-tert-butylpyridine","Journal of the Chemical Society, Dalton Transactions","2000","","7","1225","","10.1039/b000576m","","","0.71073","MoKα","","0.1291","0.079","","","0.2038","0.2258","","","","","","1.113","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009392","12.0898","0.0018","12.1766","0.0018","13.717","0.002","106.324","0.003","101.859","0.003","98.673","0.004","1849.2","0.5","160","2","160","2","","","","","","","","4","P -1","-P 1","2","","","","- C78 H102 Li4 N10 -","- C78 H102 Li4 N10 -","- C78 H102 Li4 N10 -","1","0.5","","Clegg, William; Horsburgh, Lynne; Liddle, Stephen T.; Mackenzie, Fiona M.; Mulvey, Robert E.; Robertson, Alan","The changing structural chemistry of lithium anilide on solvation by pyridine, 4-methylpyridine or 4-tert-butylpyridine","Journal of the Chemical Society, Dalton Transactions","2000","","7","1225","","10.1039/b000576m","","","0.71073","MoKα","","0.1137","0.0629","","","0.1502","0.1719","","","","","","0.89","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009393","13.0822","0.0003","19.6074","0.0003","14.4743","0.0003","90","","97.12","","90","","3684.14","0.13","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C62 H72 N4 O4 P4 Pd4 S8 W2 -","- C62 H72 N4 O4 P4 Pd4 S8 W2 -","- C124 H144 N8 O8 P8 Pd8 S16 W4 -","2","0.5","","Zheng, Hegen; Leung, Wa-Hung; Tan, Weilian; Long, Deliang; Ji, Wei; Chen, Jiutong; Xin, Feibo; Xin, Xinquan","Syntheses, crystal structures and non-linear optical properties of two novel windmill-shaped clusters: [M2Pd4S8(dppm)2]·4DMF (M = W or Mo)","Journal of the Chemical Society, Dalton Transactions","2000","","13","2145","","10.1039/b000616p","","","0.71073","MoKα","","0.0658","0.0441","","0.0922","0.0833","","","","1.024","1.057","1.057","","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009394","13.0593","0.0002","19.5518","0.0004","14.4955","0.0002","90","","97.108","0.001","90","","3672.73","0.11","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C62 H72 Mo2 N4 O4 P4 Pd4 S8 -","- C62 H72 Mo2 N4 O4 P4 Pd4 S8 -","- C124 H144 Mo4 N8 O8 P8 Pd8 S16 -","2","0.5","","Zheng, Hegen; Leung, Wa-Hung; Tan, Weilian; Long, Deliang; Ji, Wei; Chen, Jiutong; Xin, Feibo; Xin, Xinquan","Syntheses, crystal structures and non-linear optical properties of two novel windmill-shaped clusters: [M2Pd4S8(dppm)2]·4DMF (M = W or Mo)","Journal of the Chemical Society, Dalton Transactions","2000","","13","2145","","10.1039/b000616p","","","0.71073","MoKα","","0.1277","0.0691","","0.1778","0.1541","","","","0.939","1.097","1.097","","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009395","18.329","0.003","20.302","0.005","27.084","0.007","90","","90","","90","","10078","4","293","2","293","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","bis(ethane-1,2-amine)platinum(II) octacyanotungstate(V) tetrahydrate","","- C28 H56 N28 O4 Pt3 W2 -","- C28 H56 N28 O4 Pt3 W2 -","- C224 H448 N224 O32 Pt24 W16 -","8","0.25","","Robert Podgajny; Barbara Sieklucka; Wiesław Łasocha","Ternary adduct {[W(CN)8]3−,[Pt(en)2]2+,[W(CN)8]3−} in aqueous solution and crystal structure of [Pt(en)2]3[W(CN)8]2·4H2O with infinite linear WPt chains","J. Chem. Soc., Dalton Trans.","2000","","11","1799","1803","10.1039/b000645i","","","0.7093","","","0.0748","0.0574","","","0.1429","0.1499","","","","","","1.319","","","","has coordinates,has disorder","179797","2020-10-21","18:00:00",""
"7009396","18.6724","0.0017","9.0454","0.0009","15.9192","0.002","90","","110.51","0.009","90","","2518.3","0.5","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H20 Cl2 N2 Zn -","- C30 H20 Cl2 N2 Zn -","- C120 H80 Cl8 N8 Zn4 -","4","1","","Charmant, Jonathan P. H.; Fallis, Ian A.; Hunt, Neil J.; Lloyd-Jones, Guy C.; Murray, Martin; Nowak, Thorsten","Ligand exchange and stereodynamics in the cationic palladium(II)‒π-allyl complex of 2,2'-bis(pyridyl)-1,1'-binaphthalene, a novel atropisomeric N,N-ligand","Journal of the Chemical Society, Dalton Transactions","2000","","11","1723","","10.1039/b000651n","","","0.71073","MoKα","","0.028","0.0223","","","0.0596","0.0609","","","","","","1.012","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009397","10.766","0.003","15.359","0.004","18.607","0.004","89.95","0.02","80.42","0.02","85.26","0.02","3023.2","1.3","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C34 H25 F3 N2 O3 Pd S -","- C34 H25 F3 N2 O3 Pd S -","- C136 H100 F12 N8 O12 Pd4 S4 -","4","2","","Charmant, Jonathan P. H.; Fallis, Ian A.; Hunt, Neil J.; Lloyd-Jones, Guy C.; Murray, Martin; Nowak, Thorsten","Ligand exchange and stereodynamics in the cationic palladium(II)‒π-allyl complex of 2,2'-bis(pyridyl)-1,1'-binaphthalene, a novel atropisomeric N,N-ligand","Journal of the Chemical Society, Dalton Transactions","2000","","11","1723","","10.1039/b000651n","","","0.71073","MoKα","","0.0494","0.0327","","","0.0783","0.0844","","","","","","1.003","","","","has coordinates","179797","2020-10-21","18:00:00",""
"7009398","40.3994","0.0005","9.164","0.0001","19.2861","0.0002","90","","106.264","0.001","90","","6854.37","0.14","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C30 H54 O6 P Rb -","- C30 H54 O6 P Rb -","- C240 H432 O48 P8 Rb8 -","8","1","","Rabe, Gerd W.; Heise, Henrike; Liable-Sands, Louise M.; Guzei, Ilia A.; Rheingold, Arnold L.","Synthesis and crystal structure determination of two monomeric alkali metal phosphide derivatives: [M{P(H)C6H2-t-Bu3-2,4,6}(18-crown-6)] (M = K or Rb)","Journal of the Chemical Society, Dalton Transactions","2000","","12","1863","","10.1039/b000653j","","","0.71073","MoKα","","0.0808","0.053","","0.1781","0.1449","","","","1.025","1.051","1.051","","","","","has coordinates,has disorder","179797","2020-10-21","18:00:00",""
"7009399","40.7745","0.0002","9.0007","0.0002","19.1484","0.0003","90","","106.655","0.001","90","","6732.63","0.19","223","2","223","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C30 H54 K O6 P -","- C30 H53 K O6 P -","- C240 H424 K8 O48 P8 -","8","1","","Rabe, Gerd W.; Heise, Henrike; Liable-Sands, Louise M.; Guzei, Ilia A.; Rheingold, Arnold L.","Synthesis and crystal structure determination of two monomeric alkali metal phosphide derivatives: [M{P(H)C6H2-t-Bu3-2,4,6}(18-crown-6)] (M = K or Rb)","Journal of the Chemical Society, Dalton Transactions","2000","","12","1863","","10.1039/b000653j","","","0.71073","MoKα","","0.0881","0.0572","","0.1809","0.1509","","","","1.146","1.23","1.23","","","","","has coordinates,has disorder","179797","2020-10-21","18:00:00",""
"7009400","10.598","0.003","16.124","0.006","24.43","0.008","90","","92.41","0.03","90","","4171","2","126","2","126","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C38 H69 Na O8 S -","- C38 H69 Na O8 S -","- C152 H276 Na4 O32 S4 -","4","1","","Chadwick, Scott; Englich, Ulrich; Ruhlandt-Senge, Karin; Watson, Charles; Bruce, Alice E.; Bruce, Mitchell R. M.","Formation of separated versus contact ion pairs in alkali metal thiolates and selenolates","Journal of the Chemical Society, Dalton Transactions","2000","","13","2167","","10.1039/b000665n","","","0.71073","MoKα","","0.1277","0.0654","","0.1687","0.1332","","","","1.015","1.07","1.07","","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009401","10.029","0.002","13.819","0.003","15.207","0.003","92.41","0.03","91.39","0.03","106.17","0.03","2021","0.8","213","2","213","2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H61 K O7 S -","- C42 H53 K O7 S -","- C84 H106 K2 O14 S2 -","2","1","","Chadwick, Scott; Englich, Ulrich; Ruhlandt-Senge, Karin; Watson, Charles; Bruce, Alice E.; Bruce, Mitchell R. M.","Formation of separated versus contact ion pairs in alkali metal thiolates and selenolates","Journal of the Chemical Society, Dalton Transactions","2000","","13","2167","","10.1039/b000665n","","","0.71073","MoKα","","0.1509","0.0642","","0.1945","0.1554","","","","1.027","1.138","1.138","","","","","has coordinates,has disorder","179798","2020-10-21","18:00:00",""
"7009402","10.68","0.005","16.11","0.001","24.857","0.001","90","","92.72","0.04","90","","4272","2","213","1","213","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C38 H69 K O8 S -","- C38 H69 K O8 S -","- C152 H276 K4 O32 S4 -","4","1","","Chadwick, Scott; Englich, Ulrich; Ruhlandt-Senge, Karin; Watson, Charles; Bruce, Alice E.; Bruce, Mitchell R. M.","Formation of separated versus contact ion pairs in alkali metal thiolates and selenolates","Journal of the Chemical Society, Dalton Transactions","2000","","13","2167","","10.1039/b000665n","","","1.54178","CuKα","","0.1471","0.0999","","0.2788","0.2416","","","","1.068","1.171","1.171","","","","","has coordinates,has disorder","179798","2020-10-21","18:00:00",""
"7009403","10.778","0.002","16.129","0.003","25.169","0.005","90","","93.6","0.03","90","","4366.7","1.4","213","2","213","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C38 H69 K O8 Se -","- C38 H69 K O8 Se -","- C152 H276 K4 O32 Se4 -","4","1","","Chadwick, Scott; Englich, Ulrich; Ruhlandt-Senge, Karin; Watson, Charles; Bruce, Alice E.; Bruce, Mitchell R. M.","Formation of separated versus contact ion pairs in alkali metal thiolates and selenolates","Journal of the Chemical Society, Dalton Transactions","2000","","13","2167","","10.1039/b000665n","","","0.71073","MoKα","","0.135","0.0575","","0.1578","0.128","","","","1.008","1.102","1.102","","","","","has coordinates,has disorder","179798","2020-10-21","18:00:00",""
"7009404","10.001","0.003","6.712","0.0013","18.633","0.002","90","","90","","90","","1250.8","0.5","293","2","293","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C3 H16 Al2 N2 O11 P2 -","- C3 H14 Al2 N2 O11 P2 -","- C12 H56 Al8 N8 O44 P8 -","4","1","","Yuan, Hong-Ming; Chen, Jie-Sheng; Shi, Zhan; Chen, Wei; Wang, Ying; Zhang, Ping; Yu, Ji-Hong; Xu, Ru-Ren","Synthesis and structural characterisation of a new layered aluminophosphate [C3H12N2][Al2P2O8(OH)2]·H2O","Journal of the Chemical Society, Dalton Transactions","2000","","13","1981","","10.1039/b000685h","","","0.71073","MoKα","","0.0306","0.0269","","","0.0648","0.0667","","","","","","1.046","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009405","8.3918","0.0006","9.8254","0.0008","9.909","0.0007","111.172","0.001","111.751","0.001","97.56","0.001","673.59","0.09","120","","120","","","","","","","","","5","P -1","-P 1","2","","mono Caesium Zinc tris monoHydrogenPhosphate di hydrate","","- Cs H7 O14 P3 Zn2.5 -","- Cs H7 O14 P3 Zn2.5 -","- Cs2 H14 O28 P6 Zn5 -","2","1","","Jensen, Torben R.; Hazell, Rita G.","New layered caesium zinc hydrogen phosphate, CsZn2.5(HPO4)3· 2H2O; synthesis, crystal structure and thermal transformation","Journal of the Chemical Society, Dalton Transactions","2000","","16","2831","","10.1039/b000714p","","","0.71073","MoKα","","","0.032","","","0.061","","","","","2.238","2.238","","","","","has coordinates","193981","2020-10-21","18:00:00",""
"7009406","12.072","0.014","13.025","0.017","17.76","0.02","89.353","0.01","72.936","0.01","70.987","0.01","2513","5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C41 H50 Cl3 N9 O16 Tl -","- C41 H48 Cl3 N9 O16 Tl -","- C82 H96 Cl6 N18 O32 Tl2 -","2","1","","Drew, Michael G. B.; Howarth, Oliver W.; Martin, Noreen; Morgan, Grace G.; Nelson, Jane","Encapsulated Tl(III) strongly retained within an iminophenolate cryptand host","Journal of the Chemical Society, Dalton Transactions","2000","","8","1275","","10.1039/b000736f","","","0.7107","MoKα","","0.1166","0.0782","","","0.1962","0.218","","","","","","1.063","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009407","9.7924","0.0003","10.3659","0.0003","12.6077","0.0003","66.602","0.001","81.966","0.001","75.804","0.001","1137.37","0.06","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H32 Cu N6 O4 -","- C22 H32 Cu N6 O4 -","- C44 H64 Cu2 N12 O8 -","2","1","","Goeta, Andrés E.; Howard, Judith A. K.; Maffeo, Davide; Puschmann, Horst; Williams, J. A. Gareth; Yufit, Dimitrii S.","Copper(II) complexes of the isomeric tetraazamacrocyclic ligands 1,11- and 1,8-bis(2-pyridylmethyl)-1,4,8,11-tetraazacyclotetradecane and of the 1,4,8,11-tetraazacyclotetradecane-5,12-dione analogue at neutral and basic pH","Journal of the Chemical Society, Dalton Transactions","2000","","12","1873","","10.1039/b000739k","","","0.71073","MoKα","","0.0938","0.0752","","","0.1469","0.1524","","","","","","1.344","","","","has coordinates,has disorder","179798","2020-10-21","18:00:00",""
"7009408","8.27","0.001","18.666","0.002","18.717","0.002","90","","97.879","0.003","90","","2862","0.6","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H38 Cl2 Cu N6 O9 -","- C23 H34 Cl2 Cu N6 O9 -","- C92 H136 Cl8 Cu4 N24 O36 -","4","1","","Goeta, Andrés E.; Howard, Judith A. K.; Maffeo, Davide; Puschmann, Horst; Williams, J. A. Gareth; Yufit, Dimitrii S.","Copper(II) complexes of the isomeric tetraazamacrocyclic ligands 1,11- and 1,8-bis(2-pyridylmethyl)-1,4,8,11-tetraazacyclotetradecane and of the 1,4,8,11-tetraazacyclotetradecane-5,12-dione analogue at neutral and basic pH","Journal of the Chemical Society, Dalton Transactions","2000","","12","1873","","10.1039/b000739k","","","0.71073","MoKα","","0.0841","0.06","","","0.1371","0.1479","","","","","","1.103","","","","has coordinates,has disorder","179798","2020-10-21","18:00:00",""
"7009409","8.679","0.0005","15.6748","0.0009","11.7179","0.0007","90","","93.064","0.003","90","","1591.84","0.16","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H26 Cu0.5 N3 O5 -","- C13 H26 Cu0.5 N3 O5 -","- C52 H104 Cu2 N12 O20 -","4","1","","Goeta, Andrés E.; Howard, Judith A. K.; Maffeo, Davide; Puschmann, Horst; Williams, J. A. Gareth; Yufit, Dimitrii S.","Copper(II) complexes of the isomeric tetraazamacrocyclic ligands 1,11- and 1,8-bis(2-pyridylmethyl)-1,4,8,11-tetraazacyclotetradecane and of the 1,4,8,11-tetraazacyclotetradecane-5,12-dione analogue at neutral and basic pH","Journal of the Chemical Society, Dalton Transactions","2000","","12","1873","","10.1039/b000739k","","","0.71073","MoKα","","0.035","0.028","","","0.0739","0.0775","","","","","","1.053","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009410","13.7841","0.0004","21.5077","0.0006","15.9374","0.0004","90","","97.544","0.001","90","","4684","0.2","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C33 H58 Cl3 Cu2 N9 O21 -","- C33 H48 Cl3 Cu2 N9 O21 -","- C132 H192 Cl12 Cu8 N36 O84 -","4","1","","Goeta, Andrés E.; Howard, Judith A. K.; Maffeo, Davide; Puschmann, Horst; Williams, J. A. Gareth; Yufit, Dimitrii S.","Copper(II) complexes of the isomeric tetraazamacrocyclic ligands 1,11- and 1,8-bis(2-pyridylmethyl)-1,4,8,11-tetraazacyclotetradecane and of the 1,4,8,11-tetraazacyclotetradecane-5,12-dione analogue at neutral and basic pH","Journal of the Chemical Society, Dalton Transactions","2000","","12","1873","","10.1039/b000739k","","","0.71073","MoKα","","0.0878","0.0531","","","0.1272","0.1434","","","","","","1.036","","","","has coordinates,has disorder","179798","2020-10-21","18:00:00",""
"7009411","9.0295","0.0002","12.6622","0.0004","10.534","0.0003","90","","96.161","0.002","90","","1197.43","0.06","123","2","123","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C24 H39 Li N4 -","- C24 H39 Li N4 -","- C48 H78 Li2 N8 -","2","1","","Andrews, Philip C.; Duggan, Peter J.; Fallon, Gary D.; McCarthy, Tom D.; Peatt, Anna C.","Solid state structures of the chiral lithium amide complexes (S )-[(Ph(Me)CH)(PhCH2)NLi·thf]2 and (R)-[(Ph(Me)CH)(PhCH2)NLi·pmdta] †","Journal of the Chemical Society, Dalton Transactions","2000","","12","1937","","10.1039/b000747l","","","0.71073","MoKα","","0.0964","0.0776","","","0.1734","0.1877","","","","","","1.089","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009412","11.527","0.001","11.527","0.001","25.481","0.001","90","","90","","90","","3385.7","0.4","123","2","123","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","","","- C19 H24 Li N O -","- C19 H24 Li N O -","- C152 H192 Li8 N8 O8 -","8","1","","Andrews, Philip C.; Duggan, Peter J.; Fallon, Gary D.; McCarthy, Tom D.; Peatt, Anna C.","Solid state structures of the chiral lithium amide complexes (S )-[(Ph(Me)CH)(PhCH2)NLi·thf]2 and (R)-[(Ph(Me)CH)(PhCH2)NLi·pmdta] †","Journal of the Chemical Society, Dalton Transactions","2000","","12","1937","","10.1039/b000747l","","","0.71073","MoKα","","0.0981","0.0682","","","0.1178","0.127","","","","","","1.082","","","","has coordinates,has disorder","179798","2020-10-21","18:00:00",""
"7009413","21.895","0.002","6.7568","0.0006","14.5776","0.0014","90","","125.668","0.002","90","","1752.1","0.3","203","2","203","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","Cobalt(III)hexamine[aquo(samariumtricarbonato)]tetraaquosolvate","","- C3 H28 Co N6 O14 Sm -","- C3 Co N6 O14 Sm -","- C12 Co4 N24 O56 Sm4 -","4","0.5","","Clark, David L.; Donohoe, Robert J.; Gordon, John C.; Gordon, Pamela L.; Keogh, D. Webster; Scott, Brian L.; Tait, C. Drew; Watkin, John G.","First single-crystal X-ray diffraction study of a lanthanide tricarbonate complex: [Co(NH3)6][Sm(CO3)3(H2O)]·4H2O","Journal of the Chemical Society, Dalton Transactions","2000","","13","1975","","10.1039/b000778l","","","0.71073","MoKα","","0.0402","0.0372","","","0.1052","0.1069","","","","","","1.157","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009414","10.432","0.004","12.851","0.005","21.164","0.006","90","","96.86","0.02","90","","2817","1.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H24 Mn N6 O2 S2 -","- C26 H24 Mn N6 O2 S2 -","- C104 H96 Mn4 N24 O8 S8 -","4","1","","Barandika, M. Gotzone; Hernández-Pino, Margarita L.; Urtiaga, M. Karmele; Cortés, Roberto; Lezama, Luis; Arriortua, M. Isabel; Rojo, Teófilo","Solvent control in the synthesis of [Mn(NCS)2(bpe)2(H2O)2] and [Mn(NCS)2(bpe)1.5(CH3OH)]n (bpe = 1,2-bis(4-pyridyl)ethene): structural analysis and magnetic properties","Journal of the Chemical Society, Dalton Transactions","2000","","9","1469","","10.1039/b000808g","","","0.7107","MoKα","","0.0652","0.0429","","0.1403","0.1144","","","","1.087","1.126","1.126","","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009415","8.807","0.002","11.13","0.002","12.972","0.001","114.5","0.01","92.07","0.01","93.87","0.01","1151.5","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C21 H18 Mn N5 O S2 -","- C21 H17 Mn N5 O S2 -","- C42 H34 Mn2 N10 O2 S4 -","2","1","","Barandika, M. Gotzone; Hernández-Pino, Margarita L.; Urtiaga, M. Karmele; Cortés, Roberto; Lezama, Luis; Arriortua, M. Isabel; Rojo, Teófilo","Solvent control in the synthesis of [Mn(NCS)2(bpe)2(H2O)2] and [Mn(NCS)2(bpe)1.5(CH3OH)]n (bpe = 1,2-bis(4-pyridyl)ethene): structural analysis and magnetic properties","Journal of the Chemical Society, Dalton Transactions","2000","","9","1469","","10.1039/b000808g","","","0.7107","MoKα","","0.0881","0.0481","","0.2361","0.1594","","","","0.663","0.548","0.548","","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009416","13.276","0.001","25.75","0.002","19.392","0.002","90","","91.46","","90","","6627.1","1","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C69 H76 K N2 Ni2 O9 P3 Pb0 -","- C69 H76 K N2 Ni2 O9 P3 -","- C276 H304 K4 N8 Ni8 O36 P12 -","4","1","","Keşanlı, Banu; Gardner, Donna Rae; Scott, Brian; Eichhorn, Bryan W.","Two new bimetallic phosphido carbonyl complexes of nickel(0): [Ni2(CO)2(PPh3)2(μ-CO)(μ-PPh2)]− and [Ni2(CO)4(μ-PPh2)2]2−","Journal of the Chemical Society, Dalton Transactions","2000","","8","1291","","10.1039/b000852o","","","0.71073","MoKα","","0.0864","0.0526","","0.1352","0.1167","","","","1.004","1.043","1.043","","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009417","11.211","0.004","13.861","0.002","13.942","0.002","76.55","","82.76","","80.78","","2071","0.9","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C72 H114 K2 N8 Ni2 O18 P2 -","- C72 H112 K2 N8 Ni2 O18 P2 -","- C72 H112 K2 N8 Ni2 O18 P2 -","1","0.5","","Keşanlı, Banu; Gardner, Donna Rae; Scott, Brian; Eichhorn, Bryan W.","Two new bimetallic phosphido carbonyl complexes of nickel(0): [Ni2(CO)2(PPh3)2(μ-CO)(μ-PPh2)]− and [Ni2(CO)4(μ-PPh2)2]2−","Journal of the Chemical Society, Dalton Transactions","2000","","8","1291","","10.1039/b000852o","","","0.71073","MoKα","","0.0781","0.0691","","0.1778","0.1735","","","","1.257","1.313","1.313","","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009418","22.6852","0.0017","16.9553","0.0013","16.2765","0.0012","90","","120.658","0.001","90","","5385.4","0.7","180","2","293","2","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C58 H46 Co F12 N6 O P2 -","- C58 H46 Co F12 N6 O P2 -","- C232 H184 Co4 F48 N24 O4 P8 -","4","1","","Alcock, Nathaniel W.; Barker, Philip R.; Haider, Johanna M.; Hannon, Michael J.; Painting, Claire L.; Pikramenou, Zoe; Plummer, Edward A.; Rissanen, Kari; Saarenketo, Pauli","Red and blue luminescent metallo-supramolecular coordination polymers assembled through π‒π interactions †","Journal of the Chemical Society, Dalton Transactions","2000","","9","1447","","10.1039/b000871k","","","0.71073","MoKα","","0.1714","0.0795","","","0.1555","0.1958","","","","","","0.974","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009419","15.975","0.001","16.982","0.001","20.326","0.001","90","","93.4","0.01","90","","5504.5","0.5","173","2","173","2","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C56.5 H47.5 B2 F8 N8.5 O6 Ru -","- C56.5 H45.5 B2 F8 N8.5 O5.995 Ru -","- C226 H182 B8 F32 N34 O23.98 Ru4 -","4","1","","Alcock, Nathaniel W.; Barker, Philip R.; Haider, Johanna M.; Hannon, Michael J.; Painting, Claire L.; Pikramenou, Zoe; Plummer, Edward A.; Rissanen, Kari; Saarenketo, Pauli","Red and blue luminescent metallo-supramolecular coordination polymers assembled through π‒π interactions †","Journal of the Chemical Society, Dalton Transactions","2000","","9","1447","","10.1039/b000871k","","","0.71073","MoKα","","0.0784","0.0586","","","0.1566","0.1667","","","","","","1.069","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7009420","42.304","0.002","17.223","0.001","16.649","0.001","90","","108.91","0.01","90","","11475.8","1.3","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C58.5 H46 Cu F12 N7 O2.5 P2 -","- C58.5 H46 Cu F12 N7 O2.5 P2 -","- C468 H368 Cu8 F96 N56 O20 P16 -","8","1","","Alcock, Nathaniel W.; Barker, Philip R.; Haider, Johanna M.; Hannon, Michael J.; Painting, Claire L.; Pikramenou, Zoe; Plummer, Edward A.; Rissanen, Kari; Saarenketo, Pauli","Red and blue luminescent metallo-supramolecular coordination polymers assembled through π‒π interactions †","Journal of the Chemical Society, Dalton Transactions","2000","","9","1447","","10.1039/b000871k","","","0.71073","MoKα","","0.267","0.1542","","","0.39","0.441","","","","","","1.274","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009421","16.5047","0.0004","17.1444","0.0004","20.3835","0.0002","90","","90","","90","","5767.8","0.2","180","2","180","2","","","","","","","","7","P b a m","-P 2 2ab","55","","","","- C54 H38 F12 N6 Ni O P2 -","- C62.25 H38 F12 N6 Ni O P2 -","- C249 H152 F48 N24 Ni4 O4 P8 -","4","0.5","","Alcock, Nathaniel W.; Barker, Philip R.; Haider, Johanna M.; Hannon, Michael J.; Painting, Claire L.; Pikramenou, Zoe; Plummer, Edward A.; Rissanen, Kari; Saarenketo, Pauli","Red and blue luminescent metallo-supramolecular coordination polymers assembled through π‒π interactions †","Journal of the Chemical Society, Dalton Transactions","2000","","9","1447","","10.1039/b000871k","","","0.71073","MoKα","","0.176","0.1243","","","0.2877","0.3072","","","","","","1.77","","","","has coordinates,has disorder","179798","2020-10-21","18:00:00",""
"7009422","9.289","0.001","13.688","0.001","20.278","0.001","97.01","0.01","99.5","0.01","93.07","0.01","2516.8","0.4","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C58 H45 B2 F8 N8 O0.5 Zn -","- C58 H44 B2 F8 N8 O0.5 Zn -","- C116 H88 B4 F16 N16 O Zn2 -","2","1","","Alcock, Nathaniel W.; Barker, Philip R.; Haider, Johanna M.; Hannon, Michael J.; Painting, Claire L.; Pikramenou, Zoe; Plummer, Edward A.; Rissanen, Kari; Saarenketo, Pauli","Red and blue luminescent metallo-supramolecular coordination polymers assembled through π‒π interactions †","Journal of the Chemical Society, Dalton Transactions","2000","","9","1447","","10.1039/b000871k","","","0.71073","MoKα","","0.1332","0.0725","","","0.1345","0.1566","","","","","","1.027","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7009423","13.864","0.001","18.72","0.001","21.85","0.001","98.35","0.01","98.92","0.01","107.12","0.01","5243.5","0.7","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C115 H85 Cd2 F24 N13 O2 P4 -","- C115 H85 Cd2 F24 N13 O2 P4 -","- C230 H170 Cd4 F48 N26 O4 P8 -","2","1","","Alcock, Nathaniel W.; Barker, Philip R.; Haider, Johanna M.; Hannon, Michael J.; Painting, Claire L.; Pikramenou, Zoe; Plummer, Edward A.; Rissanen, Kari; Saarenketo, Pauli","Red and blue luminescent metallo-supramolecular coordination polymers assembled through π‒π interactions †","Journal of the Chemical Society, Dalton Transactions","2000","","9","1447","","10.1039/b000871k","","","0.71073","MoKα","","0.1478","0.0606","","","0.1159","0.1418","","","","","","1.015","","","","has coordinates,has disorder","179798","2020-10-21","18:00:00",""
"7009424","8.824","0.001","20.473","0.001","24.087","0.001","90","","93.34","0.01","90","","4344","0.6","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C42 H30 Cl2 N6 O10.5 Ru -","- C42 H30 Cl2 N6 O10.5 Ru -","- C168 H120 Cl8 N24 O42 Ru4 -","4","1","","Alcock, Nathaniel W.; Barker, Philip R.; Haider, Johanna M.; Hannon, Michael J.; Painting, Claire L.; Pikramenou, Zoe; Plummer, Edward A.; Rissanen, Kari; Saarenketo, Pauli","Red and blue luminescent metallo-supramolecular coordination polymers assembled through π‒π interactions †","Journal of the Chemical Society, Dalton Transactions","2000","","9","1447","","10.1039/b000871k","","","0.71073","MoKα","","0.2577","0.1134","","","0.2394","0.3122","","","","","","1.031","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009425","12.292","0.014","17.784","0.019","19.35","0.02","92.31","0.01","96.64","0.01","108.04","0.01","3982","7","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C72 H90.5 Cl3 Cu2 Fe4 I N8 O1.25 -","- C72 H88 Cl3 Cu2 Fe4 I N8 O1.25 -","- C144 H176 Cl6 Cu4 Fe8 I2 N16 O2.5 -","2","1","","Costa, Judite; Delgado, Rita; Drew, Michael G. B.; Félix, Vitor; Saint-Maurice, André","A new redox-responsive 14-membered tetraazamacrocycle with ferrocenylmethyl arms as receptor for sensing transition-metal ions","Journal of the Chemical Society, Dalton Transactions","2000","","12","1907","","10.1039/b000938p","","","0.71073","MoKα","","0.1595","0.0967","","","0.2597","0.3011","","","","","","1.054","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009426","41.98","0.05","10.348","0.013","18.95","0.02","90","","107.62","0.01","90","","7846","16","293","2","293","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C36 H46 Cl Fe2 I N4 O2 Zn -","- C36 H44 Cl Fe2 I N4 O2 Zn -","- C288 H352 Cl8 Fe16 I8 N32 O16 Zn8 -","8","1","","Costa, Judite; Delgado, Rita; Drew, Michael G. B.; Félix, Vitor; Saint-Maurice, André","A new redox-responsive 14-membered tetraazamacrocycle with ferrocenylmethyl arms as receptor for sensing transition-metal ions","Journal of the Chemical Society, Dalton Transactions","2000","","12","1907","","10.1039/b000938p","","","0.71073","MoKα","","0.2573","0.0899","","","0.2287","0.2911","","","","","","0.854","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009427","17.21","0.02","11.537","0.016","18.55","0.02","90","","95.43","0.01","90","","3667","8","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C36 H44 Cl2 Fe2 N4 Ni -","- C36 H44 Cl2 Fe2 N4 Ni -","- C144 H176 Cl8 Fe8 N16 Ni4 -","4","1","","Costa, Judite; Delgado, Rita; Drew, Michael G. B.; Félix, Vitor; Saint-Maurice, André","A new redox-responsive 14-membered tetraazamacrocycle with ferrocenylmethyl arms as receptor for sensing transition-metal ions","Journal of the Chemical Society, Dalton Transactions","2000","","12","1907","","10.1039/b000938p","","","0.71073","MoKα","","0.2926","0.1662","","","0.4149","0.463","","","","","","1.311","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009428","12.4568","0.0015","15.476","0.002","10.9876","0.0013","96.259","0.008","98.24","0.005","101.269","0.009","2035.3","0.4","150","","","","","","","","","","see text","5","P -1","-P 1","2","","","","- C42 H37 Fe N11 O9 -","- C42 H30 Fe N11 O8.99 -","- C84 H60 Fe2 N22 O17.98 -","2","1","","Constable, Edwin C.; Housecroft, Catherine E.; Neuburger, Markus; Phillips, David; Raithby, Paul R.; Schofield, Emma; Sparr, Emma; Tocher, Derek A.; Zehnder, Margareta; Zimmermann, Yves","Development of supramolecular structure through alkylation of pendant pyridyl functionality","Journal of the Chemical Society, Dalton Transactions","2000","","13","2219","","10.1039/b000940g","","","0.71069","MoKα","","0.0923","0.0872","","","0.2186","0.2235","","","","","","1.13","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009429","15.844","0.009","16.94","0.007","13.393","0.003","97.31","0.03","106.67","0.03","65.5","0.03","3133","2","293","2","150","","","","","","","","","6","P -1","-P 1","2","","","","- C58 H48 F24 Fe N10 P4 -","- C58 H48 F24 Fe N10 P4 -","- C116 H96 F48 Fe2 N20 P8 -","2","1","","Constable, Edwin C.; Housecroft, Catherine E.; Neuburger, Markus; Phillips, David; Raithby, Paul R.; Schofield, Emma; Sparr, Emma; Tocher, Derek A.; Zehnder, Margareta; Zimmermann, Yves","Development of supramolecular structure through alkylation of pendant pyridyl functionality","Journal of the Chemical Society, Dalton Transactions","2000","","13","2219","","10.1039/b000940g","","","0.71069","MoKα","","0.1546","0.0827","","0.2177","0.1736","","","","1.022","1.112","1.112","","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009430","11.1385","0.0003","11.4375","0.0005","12.1929","0.0005","90","","90","","90","","1553.33","0.1","293","","293","","","","","","","","?","3","P b c n","-P 2n 2ab","60","","","","- C20 H14 N4 -","- C20 H14 N4 -","- C80 H56 N16 -","4","0.5","","Constable, Edwin C.; Housecroft, Catherine E.; Neuburger, Markus; Phillips, David; Raithby, Paul R.; Schofield, Emma; Sparr, Emma; Tocher, Derek A.; Zehnder, Margareta; Zimmermann, Yves","Development of supramolecular structure through alkylation of pendant pyridyl functionality","Journal of the Chemical Society, Dalton Transactions","2000","","13","2219","","10.1039/b000940g","","","0.71073","MoKα","","","0.0532","","","0.0447","","","","","0.8204","0.8204","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009431","10.1186","0.0003","10.4515","0.0002","13.5992","0.0005","110.415","0.002","94.794","0.002","107.592","0.002","1255.73","0.07","293","","293","","","","","","","","?","5","P -1","-P 1","2","","","","- C27 H21 F6 N4 P -","- C27 H21 F6 N4 P -","- C54 H42 F12 N8 P2 -","2","1","","Constable, Edwin C.; Housecroft, Catherine E.; Neuburger, Markus; Phillips, David; Raithby, Paul R.; Schofield, Emma; Sparr, Emma; Tocher, Derek A.; Zehnder, Margareta; Zimmermann, Yves","Development of supramolecular structure through alkylation of pendant pyridyl functionality","Journal of the Chemical Society, Dalton Transactions","2000","","13","2219","","10.1039/b000940g","","","0.71073","MoKα","","","0.0623","","","0.0812","","","","","0.929","0.929","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009432","7.4272","0.0004","8.5344","0.0003","13.7739","0.0006","89.929","0.003","79.954","0.003","86.459","0.002","858.01","0.07","110","","110","2","","","","","","","","4","P -1","-P 1","2","","","","- C17 H26 Cl2 Mo -","- C17 H26 Cl2 Mo -","- C34 H52 Cl4 Mo2 -","2","1","","Le Grognec, Erwan; Poli, Rinaldo; Richard, Philippe","Synthesis, characterisation, and molecular and electronic structure of CpMoCl2(R1CCR2) (R1, R2 = Ph, Et, Me): a new class of half-sandwich 17-electron molybdenum(III) organometallics","Journal of the Chemical Society, Dalton Transactions","2000","","9","1499","","10.1039/b000948m","","","0.71073","MoKα","","0.0378","0.0312","","0.0716","","0.0673","","","1.098","","","1.088","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009433","18.958","0.006","12.485","0.001","7.187","0.001","90","","90","","90","","1701.1","0.6","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C19 H15 Cl2 Mo -","- C19 H15 Cl2 Mo -","- C76 H60 Cl8 Mo4 -","4","1","","Le Grognec, Erwan; Poli, Rinaldo; Richard, Philippe","Synthesis, characterisation, and molecular and electronic structure of CpMoCl2(R1CCR2) (R1, R2 = Ph, Et, Me): a new class of half-sandwich 17-electron molybdenum(III) organometallics","Journal of the Chemical Society, Dalton Transactions","2000","","9","1499","","10.1039/b000948m","","","0.71073","MoKα","","0.0231","0.0198","","0.0526","","0.0512","","","1.072","","","1.075","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009434","13.786","0.002","11.755","0.002","16.049","0.003","90","","108.433","0.003","90","","2467.4","0.7","294","2","294","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Hg(OAc)(imypyimy)(PF6)","","- C15 H17 F12 Hg N5 O2 P2 -","- C15 H17 F12 Hg N5 O2 P2 -","- C60 H68 F48 Hg4 N20 O8 P8 -","4","1","","Chen, Jack C. C.; Lin, Ivan J. B.","The first dicarbene double helical mercury complex","Journal of the Chemical Society, Dalton Transactions","2000","","6","839","","10.1039/b000971g","","","0.71073","MoKα","","0.0524","0.0374","","","0.1029","0.1078","","","","","","1.102","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009435","23.7267","0.0016","23.8877","0.0017","30.6","0.002","90","","90","","90","","17343","2","296","2","296","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","Hg2(imypyimy)2(PF6)4","","- C26 H26 F24 Hg2 N10 P4 -","- C26 H26 F24 Hg2 N10 P4 -","- C416 H416 F384 Hg32 N160 P64 -","16","0.5","","Chen, Jack C. C.; Lin, Ivan J. B.","The first dicarbene double helical mercury complex","Journal of the Chemical Society, Dalton Transactions","2000","","6","839","","10.1039/b000971g","","","0.71073","MoKα","","0.144","0.1239","","","0.2813","0.2918","","","","","","1.004","","","","has coordinates,has disorder","179798","2020-10-21","18:00:00",""
"7009436","8.7545","0.0008","17.979","0.003","14.108","0.0009","90","","103.527","0.008","90","","2159","0.4","293","2","293","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C24 H41 Cl6 N5 O4 P2 Pt -","- C24 H39 Cl6 N5 O4 P2 Pt -","- C48 H78 Cl12 N10 O8 P4 Pt2 -","2","1","","Xu, Xingling; James, Stuart L.; Mingos, D. Michael P.; White, Andrew J. P.; Williams, David J.","Platinum(II) phosphine and orotate complexes with aminopyridine co-ligands, and their molecular recognition via hydrogen bonding †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3783","","10.1039/b000974l","","","1.54178","CuKα","","0.1147","0.0881","","0.2943","0.1415","","","","1.001","1.096","1.096","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009437","14.072","0.003","17.826","0.003","17.462","0.004","90","","104.024","0.015","90","","4249.7","1.5","203","2","203","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C29 H48 Cl6 N8 O4 P2 Pt -","- C29 H47 Cl6 N8 O4 P2 Pt -","- C116 H188 Cl24 N32 O16 P8 Pt4 -","4","1","","Xu, Xingling; James, Stuart L.; Mingos, D. Michael P.; White, Andrew J. P.; Williams, David J.","Platinum(II) phosphine and orotate complexes with aminopyridine co-ligands, and their molecular recognition via hydrogen bonding †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3783","","10.1039/b000974l","","","0.71073","MoKα","","0.0874","0.0539","","0.1416","0.1226","","","","1.029","1.072","1.072","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009438","11.8544","0.0006","28.854","0.002","13.197","0.001","90","","94.226","0.005","90","","4501.7","0.5","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C39 H40 F6 N4 O7 P2 Pt S2 -","- C39 H38 F6 N4 O7 P2 Pt S2 -","- C156 H152 F24 N16 O28 P8 Pt4 S8 -","4","1","","Xu, Xingling; James, Stuart L.; Mingos, D. Michael P.; White, Andrew J. P.; Williams, David J.","Platinum(II) phosphine and orotate complexes with aminopyridine co-ligands, and their molecular recognition via hydrogen bonding †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3783","","10.1039/b000974l","","","1.54178","CuKα","","0.064","0.0509","","0.1354","0.1241","","","","1.04","1.076","1.076","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7009439","20.233","0.005","15.0501","0.0015","25.667","0.004","90","","107.143","0.013","90","","7469","2","293","2","293","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C65 H68 Cl4 F6 N3 O7.5 P4 Pt2 S2 -","- C65 H65 Cl4 F6 N3 O7.5 P4 Pt2 S2 -","- C260 H260 Cl16 F24 N12 O30 P16 Pt8 S8 -","4","1","","Xu, Xingling; James, Stuart L.; Mingos, D. Michael P.; White, Andrew J. P.; Williams, David J.","Platinum(II) phosphine and orotate complexes with aminopyridine co-ligands, and their molecular recognition via hydrogen bonding †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3783","","10.1039/b000974l","","","0.71073","MoKα","","0.1211","0.0633","","0.1775","0.1415","","","","1.001","1.096","1.096","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7009440","25.8326","0.0011","7.2184","0.0005","17.9962","0.0007","90","","123.669","0.003","90","","2792.8","0.3","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C32 H38 N2 O5 -","- C32 H24 N2 O5 -","- C128 H96 N8 O20 -","4","0.5","","Thuéry, Pierre; Nierlich, Martine; Asfari, Zouhair; Vicens, Jacques","Complexation of uranyl ions by polyphenols. Crystal structures of two linear oligomers and one uranyl ion complex","Journal of the Chemical Society, Dalton Transactions","2000","","8","1297","","10.1039/b001083i","","","0.71073","MoKα","","0.0791","0.0624","","","0.1771","0.1915","","","","","","1.068","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009441","9.6578","0.0004","18.3287","0.0016","19.7321","0.0017","67.485","0.003","77.104","0.005","82.634","0.005","3141.7","0.4","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C69 H95 N O8 -","- C69 H77 N O8 -","- C138 H154 N2 O16 -","2","1","","Thuéry, Pierre; Nierlich, Martine; Asfari, Zouhair; Vicens, Jacques","Complexation of uranyl ions by polyphenols. Crystal structures of two linear oligomers and one uranyl ion complex","Journal of the Chemical Society, Dalton Transactions","2000","","8","1297","","10.1039/b001083i","","","0.71073","MoKα","","0.1213","0.0819","","","0.1733","0.1994","","","","","","1.017","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009442","17.452","0.003","17.58","0.003","17.809","0.003","64.591","0.007","69.983","0.009","75.936","0.01","4607.4","1.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C81 H118 N4 O9 U -","- C81 H111 N4 O9 U -","- C162 H222 N8 O18 U2 -","2","1","","Thuéry, Pierre; Nierlich, Martine; Asfari, Zouhair; Vicens, Jacques","Complexation of uranyl ions by polyphenols. Crystal structures of two linear oligomers and one uranyl ion complex","Journal of the Chemical Society, Dalton Transactions","2000","","8","1297","","10.1039/b001083i","","","0.71073","MoKα","","0.1348","0.094","","","0.2175","0.2414","","","","","","1.062","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009443","12.698","0.003","18.833","0.003","19.677","0.003","90","0.003","107.16","0.01","90","0.01","4496.1","1.5","293","2","150.2","0.5","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C46 H43 Cl3 N3 Ni3 O3 P3 -","- C46 H43 Cl3 N3 Ni3 O3 P3 -","- C184 H172 Cl12 N12 Ni12 O12 P12 -","4","1","","Scherhag, Gunter; Spicer, Mark D.","Preparation of a cyclic trimer with a Ni3P3 core: aggregation and conformation driven by steric demand †","Journal of the Chemical Society, Dalton Transactions","2000","","8","1237","","10.1039/b001098g","","","0.7107","MoKα","","0.1243","0.0427","","0.1085","0.0893","","","","1.013","1.123","1.123","","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009444","15.4564","0.0003","8.4266","0.0002","10.056","0.0002","90","","90","","90","","1309.74","0.05","106","2","106","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C4 H18 Cl3 N5 O2 Ru -","- C4 H18 Cl3 N5 O2 Ru -","- C16 H72 Cl12 N20 O8 Ru4 -","4","1","","Kawano, Masaki; Ishikawa, Ayako; Morioka, Yoshiyuki; Tomizawa, Hiroshi; Miki, Ei-ichi; Ohashi, Yuji","X-Ray diffraction and spectroscopic studies of the light-induced metastable state of a ethylenediamine nitrosyl ruthenium complex","Journal of the Chemical Society, Dalton Transactions","2000","","14","2425","","10.1039/b001132k","","","0.71073","MoKα","","0.0184","0.0152","","","0.0316","0.0322","","","","","","0.981","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009445","15.4889","0.0003","8.4263","0.0002","10.0578","0.0002","90","","90","","90","","1312.68","0.05","106","2","106","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C4 H18 Cl3 N5 O2 Ru -","- C4 H16.56 Cl3 N5 O2 Ru -","- C16 H66.24 Cl12 N20 O8 Ru4 -","4","1","","Kawano, Masaki; Ishikawa, Ayako; Morioka, Yoshiyuki; Tomizawa, Hiroshi; Miki, Ei-ichi; Ohashi, Yuji","X-Ray diffraction and spectroscopic studies of the light-induced metastable state of a ethylenediamine nitrosyl ruthenium complex","Journal of the Chemical Society, Dalton Transactions","2000","","14","2425","","10.1039/b001132k","","","0.71073","MoKα","","0.0238","0.0184","","","0.0367","0.0375","","","","","","1.01","","","","has coordinates,has disorder","179798","2020-10-21","18:00:00",""
"7009446","13.154","0.002","14.724","0.002","19.69","0.003","90","","94.93","0.02","90","","3799.4","1","293","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C42 H38 Ag B N4 P2 -","- C42 H38 Ag B N4 P2 -","- C168 H152 Ag4 B4 N16 P8 -","4","1","","Lobbia, Giancarlo Gioia; Pellei, Maura; Pettinari, Claudio; Santini, Carlo; Skelton, Brian W.; White, Allan H.","Solution and solid-state structural properties of silver(I) dihydrobis(pyrazolyl)borate compounds with tertiary mono(phosphine) ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","13","2123","","10.1039/b001168l","","","0.71073","MoKα","","0.069","0.0457","","0.052","","0.0477","","","1.553","","","1.761","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009447","8.939","0.001","13.815","0.002","20.376","0.003","93.451","0.002","91.594","0.002","96.641","0.002","2493.3","0.6","153","","153","","","","","","","","","6","P -1","-P 1","2","","","","- C24 H31 Ag B N4 P -","- C24 H31 Ag B N4 P -","- C96 H124 Ag4 B4 N16 P4 -","4","2","","Lobbia, Giancarlo Gioia; Pellei, Maura; Pettinari, Claudio; Santini, Carlo; Skelton, Brian W.; White, Allan H.","Solution and solid-state structural properties of silver(I) dihydrobis(pyrazolyl)borate compounds with tertiary mono(phosphine) ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","13","2123","","10.1039/b001168l","","","0.71073","MoKα","","0.054","0.044","","0.064","","0.062","","","1.267","","","1.335","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009448","12.712","0.001","18.682","0.002","25.41","0.002","90","","90","","90","","6034.5","0.9","150","","150","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C28 H49 Ag B N4 P -","- C28 H49 Ag B N4 P -","- C224 H392 Ag8 B8 N32 P8 -","8","1","","Lobbia, Giancarlo Gioia; Pellei, Maura; Pettinari, Claudio; Santini, Carlo; Skelton, Brian W.; White, Allan H.","Solution and solid-state structural properties of silver(I) dihydrobis(pyrazolyl)borate compounds with tertiary mono(phosphine) ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","13","2123","","10.1039/b001168l","","","0.71073","MoKα","","0.04","0.031","","0.047","","0.045","","","1.178","","","1.229","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009449","14.222","0.006","10.378","0.004","17.861","0.006","90","","104.16","0.03","90","","2556.1","1.7","180","2","180","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H22 Mo2 O4 P2 -","- C26 H22 Mo2 O4 P2 -","- C104 H88 Mo8 O16 P8 -","4","1","","Davies, John E.; Feeder, Neil; Gray, Caspar A.; Mays, Martin J.; Woods, Anthony D.","The reactions of the anions [Cp2(CO)4Mo2(μ-PRR')]− (R, R' = H, Ph) towards chloroarsines and chlorophosphines; synthesis of complexes containing both bridging phosphido and arsenido groups","Journal of the Chemical Society, Dalton Transactions","2000","","11","1695","","10.1039/b001193m","","","0.71069","MoKα","","0.066","0.0438","","","0.1008","0.1109","","","","","","1.043","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009450","9.7396","0.0005","17.1917","0.0007","15.3458","0.0011","90","","97.401","0.003","90","","2548.1","0.2","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","COMPLEX 9","","","- C24 H26 Mo2 O6 P2 -","- C24 H26 Mo2 O6 P2 -","- C96 H104 Mo8 O24 P8 -","4","1","","Davies, John E.; Feeder, Neil; Gray, Caspar A.; Mays, Martin J.; Woods, Anthony D.","The reactions of the anions [Cp2(CO)4Mo2(μ-PRR')]− (R, R' = H, Ph) towards chloroarsines and chlorophosphines; synthesis of complexes containing both bridging phosphido and arsenido groups","Journal of the Chemical Society, Dalton Transactions","2000","","11","1695","","10.1039/b001193m","","","0.71069","MoKα","","0.0496","0.0307","","","0.0637","0.0705","","","","","","0.92","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009451","10.945","0.004","21.547","0.006","8.022","0.005","90","","90","","90","","1891.8","1.5","180","2","180","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C16 H18 As Mo2 O4 P -","- C16 H18 As Mo2 O4 P -","- C64 H72 As4 Mo8 O16 P4 -","4","1","","Davies, John E.; Feeder, Neil; Gray, Caspar A.; Mays, Martin J.; Woods, Anthony D.","The reactions of the anions [Cp2(CO)4Mo2(μ-PRR')]− (R, R' = H, Ph) towards chloroarsines and chlorophosphines; synthesis of complexes containing both bridging phosphido and arsenido groups","Journal of the Chemical Society, Dalton Transactions","2000","","11","1695","","10.1039/b001193m","","","0.71069","MoKα","","0.1658","0.0811","","","0.1645","0.2039","","","","","","1.001","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009452","12.219","0.003","14.26","0.005","15.304","0.003","90","","90","","90","","2666.6","1.3","180","2","180","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C17 H35 Cl Co Ge O9 P3 -","- C17 H35 Cl Co Ge O9 P3 -","- C68 H140 Cl4 Co4 Ge4 O36 P12 -","4","1","","Filippou, Alexander C.; Portius, Peter; Kociok-Köhn, Gabriele; Albrecht, Volker","Oxidation of germanium(II) azides with HN3: a convenient route to six-co-ordinate triazidogermanium(IV) compounds","Journal of the Chemical Society, Dalton Transactions","2000","","11","1759","","10.1039/b001198n","","","0.71073","MoKα","","0.0322","0.0248","","","0.0442","0.0455","","","","","","0.944","","","","has coordinates,has disorder","179798","2020-10-21","18:00:00",""
"7009453","11.378","0.007","10.918","0.013","17.719","0.009","90","","101.04","0.04","90","","2160","3","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H22 B Ge N15 -","- C15 H22 B Ge N15 -","- C60 H88 B4 Ge4 N60 -","4","1","","Filippou, Alexander C.; Portius, Peter; Kociok-Köhn, Gabriele; Albrecht, Volker","Oxidation of germanium(II) azides with HN3: a convenient route to six-co-ordinate triazidogermanium(IV) compounds","Journal of the Chemical Society, Dalton Transactions","2000","","11","1759","","10.1039/b001198n","","","0.71073","MoKα","","0.0441","0.0413","","","0.1135","0.1166","","","","","","1.046","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009454","8.458","0.0012","17.226","0.002","18.673","0.004","90","","93.29","0.02","90","","2716.1","0.8","180","2","180","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C17 H35 Co Ge N3 O9 P3 -","- C17 H35 Co Ge N3 O9 P3 -","- C68 H140 Co4 Ge4 N12 O36 P12 -","4","1","","Filippou, Alexander C.; Portius, Peter; Kociok-Köhn, Gabriele; Albrecht, Volker","Oxidation of germanium(II) azides with HN3: a convenient route to six-co-ordinate triazidogermanium(IV) compounds","Journal of the Chemical Society, Dalton Transactions","2000","","11","1759","","10.1039/b001198n","","","0.71073","MoKα","","0.0897","0.0425","","","0.0845","0.095","","","","","","0.878","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009455","17.1284","0.0014","12.0633","0.001","14.6659","0.0008","90","","97.283","0.008","90","","3005.9","0.4","193","2","193","2","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C17 H35 Co Ge N9 O9 P3 -","- C17 H35 Co Ge N9 O9 P3 -","- C68 H140 Co4 Ge4 N36 O36 P12 -","4","1","","Filippou, Alexander C.; Portius, Peter; Kociok-Köhn, Gabriele; Albrecht, Volker","Oxidation of germanium(II) azides with HN3: a convenient route to six-co-ordinate triazidogermanium(IV) compounds","Journal of the Chemical Society, Dalton Transactions","2000","","11","1759","","10.1039/b001198n","","","0.71073","MoKα","","0.0565","0.0522","","","0.136","0.1411","","","","","","1.069","","","","has coordinates,has disorder","179798","2020-10-21","18:00:00",""
"7009456","14.438","0.002","14.438","0.002","19.673","0.004","90","","90","","120","","3551.5","1","293","2","293","2","","","","","","","","6","P 32 2 1","P 32 2""","154","","","","- C20 H25 Br N O7 Re -","- C20 H25 Br N O7 Re -","- C120 H150 Br6 N6 O42 Re6 -","6","1","","Heard, Peter J.; King, Paul M.; Tocher, Derek A.","Tricarbonylrhenium(I) halide complexes of 2-[(4R,6R)-4,6-dimethyl-1,3-dioxan-2-yl]pyridine (L1) and 2,6-bis[(4R,6R)-4,6-dimethyl-1,3-dioxan-2-yl]pyridine (L2): structure and solution stereodynamics","Journal of the Chemical Society, Dalton Transactions","2000","","11","1769","","10.1039/b001206h","","","0.71073","MoKα","","0.0405","0.0348","","0.0856","0.0814","","","","1.007","1.028","1.028","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7009457","16.403","0.002","16.403","0.002","27.497","0.005","90","","90","","120","","6407.1","1.6","293","2","293","2","","","","","","","","6","R 3 2 :H","R 3 2""","155","","","","- C78 H70 Cl3 N20 Nd O14 -","- C78 H66 Cl3 N20 Nd O14 -","- C234 H198 Cl9 N60 Nd3 O42 -","3","0.166667","","Su, Cheng-Yong; Kang, Bei-Sheng; Yang, Qing-Chuan; Mak, Thomas C. W.","Doubly interpenetrating stereoisomeric three-dimensional frameworks of tripodal neodymium(III) complexes from potentially spacer-controlled enantioselective self-assembly","Journal of the Chemical Society, Dalton Transactions","2000","","12","1857","","10.1039/b001236j","","","0.71073","MoKα","","0.0523","0.0478","","0.1466","0.123","","","","1.062","1.06","1.06","","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009458","22.147","0.004","16.082","0.003","26.748","0.005","90","","113.66","0.03","90","","8726","3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C84 H74 Cl3 N20 Nd O13 -","- C84 H66 Cl3 N20 Nd O13 -","- C336 H264 Cl12 N80 Nd4 O52 -","4","0.5","","Su, Cheng-Yong; Kang, Bei-Sheng; Yang, Qing-Chuan; Mak, Thomas C. W.","Doubly interpenetrating stereoisomeric three-dimensional frameworks of tripodal neodymium(III) complexes from potentially spacer-controlled enantioselective self-assembly","Journal of the Chemical Society, Dalton Transactions","2000","","12","1857","","10.1039/b001236j","","","0.71073","MoKα","","0.0887","0.0836","","","0.2338","0.2404","","","","","","1.112","","","","has coordinates,has disorder","179798","2020-10-21","18:00:00",""
"7009459","18.408","0.003","8.1421","0.0009","14.335","0.002","90","","109.071","0.018","90","","2030.6","0.5","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C15 H34 As Cl2 P Pd -","- C15 H34 As Cl2 P Pd -","- C60 H136 As4 Cl8 P4 Pd4 -","4","1","","Schmidt, Ulrich; Ilg, Kerstin; Werner, Helmut","The first palladium(II) complexes containing arsino(phosphino)methanes as ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","7","1005","","10.1039/b001237h","","","0.71073","MoKα","","0.0476","0.0378","","","0.096","0.1001","","","","","","1.01","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009460","14.487","0.009","17.323","0.011","17.554","0.012","112.46","0.08","96.69","0.08","101.79","0.08","3892","6","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C65 H88 As2 B Cl3 F24 P2 Pd2 -","- C65 H88 As2 B Cl3 F24 P2 Pd2 -","- C130 H176 As4 B2 Cl6 F48 P4 Pd4 -","2","1","","Schmidt, Ulrich; Ilg, Kerstin; Werner, Helmut","The first palladium(II) complexes containing arsino(phosphino)methanes as ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","7","1005","","10.1039/b001237h","","","0.71073","MoKα","","0.0792","0.0404","","","0.0827","0.0928","","","","","","0.84","","","","has coordinates,has disorder","179798","2020-10-21","18:00:00",""
"7009461","26.484","0.007","11.022","0.005","27.76","0.005","90","","107.93","0.01","90","","7710","4","296.2","","296.2","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C93 H93 B2 Cl Ir2 P2 -","- C93 H92 B2 Cl Ir2 P2 -","- C372 H368 B8 Cl4 Ir8 P8 -","4","1","","Fujita, Ken-ichi; Hamada, Taro; Yamaguchi, Ryohei","dppm and hydrido-bridged dinuclear complexes of iridium. Synthesis and structures of [(IrCp*)2(μ-dppm)(μ-H)(μ-X)]2+ (X = Cl, OMe, OH, or H)","Journal of the Chemical Society, Dalton Transactions","2000","","12","1931","","10.1039/b001239o","","","0.7107","MoKα","","0.0579","0.058","","0.061","","0.061","","","1.958","","","1.96","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009462","26.481","0.009","11.13","0.01","27.771","0.009","90","","107.96","0.03","90","","7786","8","291.2","","291.2","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C94 H96 B2 Ir2 O P2 -","- C94 H95 B2 Ir2 O P2 -","- C376 H380 B8 Ir8 O4 P8 -","4","1","","Fujita, Ken-ichi; Hamada, Taro; Yamaguchi, Ryohei","dppm and hydrido-bridged dinuclear complexes of iridium. Synthesis and structures of [(IrCp*)2(μ-dppm)(μ-H)(μ-X)]2+ (X = Cl, OMe, OH, or H)","Journal of the Chemical Society, Dalton Transactions","2000","","12","1931","","10.1039/b001239o","","","0.7107","MoKα","","0.0399","0.04","","0.037","","0.037","","","1.277","","","1.28","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009463","26.435","0.002","10.988","0.003","27.771","0.002","90","","108.701","0.005","90","","7641","2","291.2","","291.2","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C93 H94 B2 Ir2 O P2 -","- C93 H93 B2 Ir2 O P2 -","- C372 H372 B8 Ir8 O4 P8 -","4","1","","Fujita, Ken-ichi; Hamada, Taro; Yamaguchi, Ryohei","dppm and hydrido-bridged dinuclear complexes of iridium. Synthesis and structures of [(IrCp*)2(μ-dppm)(μ-H)(μ-X)]2+ (X = Cl, OMe, OH, or H)","Journal of the Chemical Society, Dalton Transactions","2000","","12","1931","","10.1039/b001239o","","","0.7107","MoKα","","0.0491","0.049","","0.056","","0.056","","","1.764","","","1.76","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009464","26.362","0.006","11.023","0.008","27.701","0.008","90","","108.5","0.02","90","","7634","6","296.2","","296.2","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C93 H94 B2 Ir2 P2 -","- C93 H94 B2 Ir2 P2 -","- C372 H376 B8 Ir8 P8 -","4","1","","Fujita, Ken-ichi; Hamada, Taro; Yamaguchi, Ryohei","dppm and hydrido-bridged dinuclear complexes of iridium. Synthesis and structures of [(IrCp*)2(μ-dppm)(μ-H)(μ-X)]2+ (X = Cl, OMe, OH, or H)","Journal of the Chemical Society, Dalton Transactions","2000","","12","1931","","10.1039/b001239o","","","0.7107","MoKα","","0.062","0.062","","0.071","","0.071","","","2.1","","","2.1","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009465","9.889","0.001","17.607","0.002","10.282","0.001","90","","107.9","0.01","90","","1703.6","0.3","298.2","","298.2","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C38 H30 Cl2 N2 P2 Pd2 -","- C38 H30 Cl2 N2 P2 Pd2 -","- C76 H60 Cl4 N4 P4 Pd4 -","2","0.5","","Wong, Wai-Kwok; Zhang, Li-Lu; Chen, Yang; Wong, Wai-Yeung; Wong, Wing-Tak; Xue, Feng; Mak, Thomas C. W.","Reactivity of chiral diiminodiphosphine ligands towards PdCl2(PhCN)2: synthesis and crystal structures of two unexpected dinuclear palladium(II) complexes","Journal of the Chemical Society, Dalton Transactions","2000","","9","1397","","10.1039/b001245i","","","0.7107","MoKalpha","","","0.0468","","","0.0362","","","","","1.699","1.699","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009466","12.574","0.001","13.636","0.001","20.058","0.001","80.03","0.01","75.67","0.01","81.04","0.01","3258.8","0.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C65 H55 Cl4 N2 O P3 Pd2 -","- C65 H55 Cl4 N2 O P3 Pd2 -","- C130 H110 Cl8 N4 O2 P6 Pd4 -","2","1","","Wong, Wai-Kwok; Zhang, Li-Lu; Chen, Yang; Wong, Wai-Yeung; Wong, Wing-Tak; Xue, Feng; Mak, Thomas C. W.","Reactivity of chiral diiminodiphosphine ligands towards PdCl2(PhCN)2: synthesis and crystal structures of two unexpected dinuclear palladium(II) complexes","Journal of the Chemical Society, Dalton Transactions","2000","","9","1397","","10.1039/b001245i","","","0.71073","MoKα","","0.0722","0.0611","","","0.1642","0.1741","","","","","","1.051","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009467","9.5281","0.0006","18.3692","0.0013","14.2891","0.001","90","","93.154","0.007","90","","2497.1","0.3","220","2","220","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C26 H38 Mg N4 -","- C26 H38 Mg N4 -","- C104 H152 Mg4 N16 -","4","1","","Bailey, Philip J.; Dick, Caroline M. E.; Fabre, Sylvie; Parsons, Simon","Synthesis and characterisation of magnesium methyl complexes with monoanionic chelating nitrogen donor ligands and their reaction with dioxygen","Journal of the Chemical Society, Dalton Transactions","2000","","10","1655","","10.1039/b001316l","","","1.54178","CuKα","","0.0418","0.0346","","","0.0888","0.0931","","","","","","1.028","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009468","15.56","0.011","8.838","0.007","22.162","0.016","90","","90","","90","","3048","4","220","2","220","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C28 H44 Mg2 N4 O2 -","- C28 H44 Mg2 N4 O2 -","- C112 H176 Mg8 N16 O8 -","4","0.5","","Bailey, Philip J.; Dick, Caroline M. E.; Fabre, Sylvie; Parsons, Simon","Synthesis and characterisation of magnesium methyl complexes with monoanionic chelating nitrogen donor ligands and their reaction with dioxygen","Journal of the Chemical Society, Dalton Transactions","2000","","10","1655","","10.1039/b001316l","","","1.54178","CuKα","","0.0995","0.0582","","","0.1586","0.1871","","","","","","1.029","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"7009469","14.068","0.005","14.903","0.007","14.11","0.005","90","","108.02","0.03","90","","2813","2","220","2","220","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C60 H88 Mg2 N4 -","- C60 H88 Mg2 N4 -","- C120 H176 Mg4 N8 -","2","0.5","","Bailey, Philip J.; Dick, Caroline M. E.; Fabre, Sylvie; Parsons, Simon","Synthesis and characterisation of magnesium methyl complexes with monoanionic chelating nitrogen donor ligands and their reaction with dioxygen","Journal of the Chemical Society, Dalton Transactions","2000","","10","1655","","10.1039/b001316l","","","1.54178","CuKα","","0.1054","0.072","","","0.191","0.2189","","","","","","1.021","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"7009470","9.136","0.003","12.69","0.005","16.004","0.006","99","0.03","96.17","0.03","95.19","0.02","1811.1","1.2","220","2","220","2","","","","","","","","5","P -1","-P 1","2","","","","- C37 H59 Mg N2 O -","- C37 H59 Mg N2 O -","- C74 H118 Mg2 N4 O2 -","2","1","","Bailey, Philip J.; Dick, Caroline M. E.; Fabre, Sylvie; Parsons, Simon","Synthesis and characterisation of magnesium methyl complexes with monoanionic chelating nitrogen donor ligands and their reaction with dioxygen","Journal of the Chemical Society, Dalton Transactions","2000","","10","1655","","10.1039/b001316l","","","1.54178","CuKα","","0.1767","0.084","","","0.1912","0.2445","","","","","","0.961","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"7009471","14.605","0.004","12.551","0.003","11.021","0.003","106.74","0.02","75.19","0.03","71.34","0.02","1692.9","1","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","Bis(2-[2-{2',5'-dihydroxybenzaldimino}ethyl]pyridine)dicopper(II) ditetrafluoroborate nitromethane solvate","","- C29 H29 B2 Cu2 F8 N5 O6 -","- C29 H29 B2 Cu2 F8 N5 O6 -","- C58 H58 B4 Cu4 F16 N10 O12 -","2","1","","Li, Peiyi; Solanki, Nayan K.; Ehrenberg, Helmut; Feeder, Neil; Davies, John E.; Rawson, Jeremy M.; Halcrow, Malcolm A.","Copper(II) complexes of hydroquinone-containing Schiff bases. Towards a structural model for copper amine oxidases","Journal of the Chemical Society, Dalton Transactions","2000","","10","1559","","10.1039/b001320j","","","0.71069","MoKα","","0.1087","0.0666","","","0.1577","0.1825","","","","","","1.028","","","","has coordinates,has disorder","179798","2020-10-21","18:00:00",""
"7009472","7.683","0.001","11.404","0.001","19.242","0.001","90","","99.56","0.01","90","","1662.5","0.3","180","2","180","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[N-(2-{pyrid-2-ylmethylamino}ethyl)-2,5-dihydroxybenzaldimino]copper(II) perchlorate","","- C15 H16 Cl Cu N3 O6 -","- C15 H16 Cl Cu N3 O6 -","- C60 H64 Cl4 Cu4 N12 O24 -","4","1","","Li, Peiyi; Solanki, Nayan K.; Ehrenberg, Helmut; Feeder, Neil; Davies, John E.; Rawson, Jeremy M.; Halcrow, Malcolm A.","Copper(II) complexes of hydroquinone-containing Schiff bases. Towards a structural model for copper amine oxidases","Journal of the Chemical Society, Dalton Transactions","2000","","10","1559","","10.1039/b001320j","","","0.71069","MoKα","","0.0871","0.0635","","","0.1344","0.1452","","","","","","1.129","","","","has coordinates,has disorder","179798","2020-10-21","18:00:00",""
"7009473","11.177","0.003","13.746","0.003","15.173","0.004","70.146","0.01","87.83","0.02","89.668","0.019","2191","1","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","","","- C35.5 H58 Li N8 S2 Sb3 -","- C35.5 H54 Li N8 S2 Sb3 -","- C71 H108 Li2 N16 S4 Sb6 -","2","1","","Bashall, Alan; Beswick, Michael A.; Feeder, Neil; Hopkins, Alexander D.; Kidd, Sara J.; McPartlin, Mary; Raithby, Paul R.; Wright, Dominic S.","Reactions of the spiro monoanion [{(Me2N)Sb(μ-NCy)2}2Sb]− with alcohols and thiols (REH; E = O or S); syntheses of nido-[Sb3(μ-NCy)3(μ3-NCy)(ER)2] anions and the unique antimony(III) imido cubane [(2-NC5H4O)Sb(μ3-NCy)]4 (Cy= cyclohexyl)","Journal of the Chemical Society, Dalton Transactions","2000","","12","1841","","10.1039/b001322f","","","0.71073","MoKα","","0.1047","0.0616","","","0.1645","0.205","","","","","","1.03","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7009474","12.793","0.003","14.864","0.003","15.34","0.003","65.45","0.03","74.73","0.03","80.35","0.03","2554","1.2","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C47.5 H66 N8 O4 Sb4 -","- C47.5 H60 N8 O4 Sb4 -","- C95 H120 N16 O8 Sb8 -","2","1","","Bashall, Alan; Beswick, Michael A.; Feeder, Neil; Hopkins, Alexander D.; Kidd, Sara J.; McPartlin, Mary; Raithby, Paul R.; Wright, Dominic S.","Reactions of the spiro monoanion [{(Me2N)Sb(μ-NCy)2}2Sb]− with alcohols and thiols (REH; E = O or S); syntheses of nido-[Sb3(μ-NCy)3(μ3-NCy)(ER)2] anions and the unique antimony(III) imido cubane [(2-NC5H4O)Sb(μ3-NCy)]4 (Cy= cyclohexyl)","Journal of the Chemical Society, Dalton Transactions","2000","","12","1841","","10.1039/b001322f","","","0.71073","MoKα","","0.0862","0.0439","","","0.0961","0.1316","","","","","","1.026","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009475","9.599","0.002","21.379","0.004","17.097","0.003","90","","99.82","0.03","90","","3457.2","1.2","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H56 N6 Na Sb3 -","- C28 H56 N6 Na Sb3 -","- C112 H224 N24 Na4 Sb12 -","4","1","","Bashall, Alan; Beswick, Michael A.; Feeder, Neil; Hopkins, Alexander D.; Kidd, Sara J.; McPartlin, Mary; Raithby, Paul R.; Wright, Dominic S.","Reactions of the spiro monoanion [{(Me2N)Sb(μ-NCy)2}2Sb]− with alcohols and thiols (REH; E = O or S); syntheses of nido-[Sb3(μ-NCy)3(μ3-NCy)(ER)2] anions and the unique antimony(III) imido cubane [(2-NC5H4O)Sb(μ3-NCy)]4 (Cy= cyclohexyl)","Journal of the Chemical Society, Dalton Transactions","2000","","12","1841","","10.1039/b001322f","","","0.71073","MoKα","","0.1155","0.0787","","","0.1986","0.2259","","","","","","1.002","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009476","12.755","0.004","13.169","0.004","5.51","0.001","90","","90","","90","","925.5","0.4","293","2","293","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C14 H10 Mn N6 S4 -","- C14 H10 Mn N6 S4 -","- C28 H20 Mn2 N12 S8 -","2","0.5","","Chen, Hong-Ji; Zhang, Ling-Zhi; Cai, Zhi-Gang; Yang, Guang; Chen, Xiao-Ming","Organic‒inorganic hybrid materials assembled through weak intermolecular interactions. Synthesis, structures and non-linear optical properties of [4,4'-bipyH2][M(NCS)4] (M = Mn2+, Co2+ or Zn2+; 4,4'-bipy = 4,4'-bipyridine)","Journal of the Chemical Society, Dalton Transactions","2000","","14","2463","","10.1039/b001323o","","","0.71073","MoKα","","0.0458","0.0387","","","0.1011","0.1093","","","","","","1.133","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009477","12.858","0.004","13.019","0.002","5.452","0.002","90","","90","","90","","912.7","0.5","293","2","293","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C14 H10 Co N6 S4 -","- C14 H10 Co N6 S4 -","- C28 H20 Co2 N12 S8 -","2","0.5","","Chen, Hong-Ji; Zhang, Ling-Zhi; Cai, Zhi-Gang; Yang, Guang; Chen, Xiao-Ming","Organic‒inorganic hybrid materials assembled through weak intermolecular interactions. Synthesis, structures and non-linear optical properties of [4,4'-bipyH2][M(NCS)4] (M = Mn2+, Co2+ or Zn2+; 4,4'-bipy = 4,4'-bipyridine)","Journal of the Chemical Society, Dalton Transactions","2000","","14","2463","","10.1039/b001323o","","","0.71073","MoKα","","0.0327","0.0291","","","0.0769","0.0787","","","","","","1.175","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009478","12.895","0.007","13.008","0.004","5.458","0.002","90","","90","","90","","915.5","0.7","293","2","293","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C14 H10 N6 S4 Zn -","- C14 H10 N6 S4 Zn -","- C28 H20 N12 S8 Zn2 -","2","0.5","","Chen, Hong-Ji; Zhang, Ling-Zhi; Cai, Zhi-Gang; Yang, Guang; Chen, Xiao-Ming","Organic‒inorganic hybrid materials assembled through weak intermolecular interactions. Synthesis, structures and non-linear optical properties of [4,4'-bipyH2][M(NCS)4] (M = Mn2+, Co2+ or Zn2+; 4,4'-bipy = 4,4'-bipyridine)","Journal of the Chemical Society, Dalton Transactions","2000","","14","2463","","10.1039/b001323o","","","0.71073","MoKα","","0.0629","0.0514","","","0.1378","0.1425","","","","","","1.243","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009479","11.453","0.002","14.51","0.003","17.654","0.004","114.07","0.03","93.8","0.03","90.24","0.03","2671.2","1.1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C8 H106 Ca5 Mo18 N4 O106 -","- C8 H8 Ca5 Mo18 N4 O106 -","- C8 H8 Ca5 Mo18 N4 O106 -","1","0.5","","Liu, Guang; Wei, Yong-Ge; Liu, Jian; Liu, Qun; Zhang, Shi-Wei; Tang, You-Qi","Synthesis and crystal structure of novel ring-like polyoxomolybdate and its 2-D self-assembly","Journal of the Chemical Society, Dalton Transactions","2000","","7","1013","","10.1039/b001361g","","","0.71073","MoKα","","0.0677","0.0568","","","0.1569","0.1663","","","","","","1.035","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009480","11.921","0.002","14.689","0.003","15.169","0.003","74.73","0.03","87.91","0.03","66.73","0.03","2347.1","1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C10 H93 Ca4 Mo18 N5 O98 -","- C10 H25 Ca4 Mo18 N5 O97.98 -","- C10 H25 Ca4 Mo18 N5 O97.98 -","1","0.5","","Liu, Guang; Wei, Yong-Ge; Liu, Jian; Liu, Qun; Zhang, Shi-Wei; Tang, You-Qi","Synthesis and crystal structure of novel ring-like polyoxomolybdate and its 2-D self-assembly","Journal of the Chemical Society, Dalton Transactions","2000","","7","1013","","10.1039/b001361g","","","0.71073","MoKα","","0.0326","0.0306","","","0.0838","0.0847","","","","","","1.16","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009481","12.293","0.002","10.021","0.002","8.811","0.002","90","","106.75","0.03","90","","1039.4","0.4","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C10 H20 Cl2 F6 N4 O2 Rh Sb -","- C10 H20 Cl2 F6 N4 O2 Rh Sb -","- C20 H40 Cl4 F12 N8 O4 Rh2 Sb2 -","2","0.5","","Kukushkin, Vadim Yu.; Ilichev, Igor V.; Zhdanova, Maria A.; Wagner, Gabriele; Pombeiro, Armando J. L.","Metal-mediated hydrolysis of the oxime CN bond to produce RhIII-bound O-iminoacylated MeC(NH)ONH2 species","Journal of the Chemical Society, Dalton Transactions","2000","","10","1567","","10.1039/b001384f","","","0.71073","MoKα","","0.0439","0.0439","","","0.1098","0.1098","","","","","","1.054","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009482","8.483","0.002","8.508","0.002","8.617","0.002","87.86","0.03","79.59","0.03","80.42","0.03","603.1","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C4 H12 Cl3 N4 O2 Rh -","- C4 H12 Cl3 N4 O2 Rh -","- C8 H24 Cl6 N8 O4 Rh2 -","2","1","","Kukushkin, Vadim Yu.; Ilichev, Igor V.; Zhdanova, Maria A.; Wagner, Gabriele; Pombeiro, Armando J. L.","Metal-mediated hydrolysis of the oxime CN bond to produce RhIII-bound O-iminoacylated MeC(NH)ONH2 species","Journal of the Chemical Society, Dalton Transactions","2000","","10","1567","","10.1039/b001384f","","","0.56083","AgKα","","0.0276","0.0276","","","0.078","0.078","","","","","","1.087","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009483","15.282","0.003","11.3423","0.0019","28.242","0.005","90","","90","","90","","4895.3","1.5","423","2","423","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C19 H33 Br3 Cu2 N4 O -","- C19 H33 Br3 Cu2 N4 O -","- C152 H264 Br24 Cu16 N32 O8 -","8","1","","Adams, Harry; Fenton, David E.; Haque, Shabana R.; Heath, Sarah L.; Ohba, Masaaki; Okawa, Hisashi; Spey, Sharon E.","Diversity in the reactions of unsymmetric dinucleating Schiff base ligands with CuII and NiII","Journal of the Chemical Society, Dalton Transactions","2000","","12","1849","","10.1039/b001395l","","","0.71073","MoKα","","0.1135","0.0678","","","0.152","0.177","","","","","","1.005","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009484","13.138","0.003","12.8","0.004","18.132","0.005","90","","107.87","0.01","90","","2902.1","1.4","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H36 Cl2 Cu2 N4 O10 -","- C20 H36 Cl2 Cu2 N4 O10 -","- C80 H144 Cl8 Cu8 N16 O40 -","4","1","","Adams, Harry; Fenton, David E.; Haque, Shabana R.; Heath, Sarah L.; Ohba, Masaaki; Okawa, Hisashi; Spey, Sharon E.","Diversity in the reactions of unsymmetric dinucleating Schiff base ligands with CuII and NiII","Journal of the Chemical Society, Dalton Transactions","2000","","12","1849","","10.1039/b001395l","","","0.71073","MoKα","","0.1055","0.0688","","","0.1724","0.1988","","","","","","1.023","","","","has coordinates,has disorder","179798","2020-10-21","18:00:00",""
"7009485","22.938","0.006","10.148","0.002","17.916","0.004","90","","111.963","0.004","90","","3867.7","1.5","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C30 H58 Cl2 N4 Ni2 O18 -","- C30 H46 Cl2 N4 Ni2 O18 -","- C120 H184 Cl8 N16 Ni8 O72 -","4","0.5","","Adams, Harry; Fenton, David E.; Haque, Shabana R.; Heath, Sarah L.; Ohba, Masaaki; Okawa, Hisashi; Spey, Sharon E.","Diversity in the reactions of unsymmetric dinucleating Schiff base ligands with CuII and NiII","Journal of the Chemical Society, Dalton Transactions","2000","","12","1849","","10.1039/b001395l","","","0.71073","MoKα","","0.2391","0.1264","","","0.3124","0.378","","","","","","0.991","","","","has coordinates,has disorder","179798","2020-10-21","18:00:00",""
"7009486","10.3948","0.0015","10.6991","0.0015","10.8277","0.0014","73.874","0.003","85.768","0.003","62.618","0.002","1025.2","0.2","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C31 H58 Cl2 N4 Ni2 O17 -","- C31 H50 Cl2 N4 Ni2 O17 -","- C31 H50 Cl2 N4 Ni2 O17 -","1","0.5","","Adams, Harry; Fenton, David E.; Haque, Shabana R.; Heath, Sarah L.; Ohba, Masaaki; Okawa, Hisashi; Spey, Sharon E.","Diversity in the reactions of unsymmetric dinucleating Schiff base ligands with CuII and NiII","Journal of the Chemical Society, Dalton Transactions","2000","","12","1849","","10.1039/b001395l","","","0.71073","MoKα","","0.1126","0.0892","","","0.2436","0.2946","","","","","","1.202","","","","has coordinates,has disorder","179798","2020-10-21","18:00:00",""
"7009487","53.242","0.011","33.671","0.007","33.537","0.007","90","","90","","90","","60122","2","293","2","293","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C193 H308 Co8 N107 O32 S24 -","- C193 H306 Co8 N107 O29 S24 -","- C1544 H2448 Co64 N856 O232 S192 -","8","1","","Coxall, Robert A.; Harris, Steven G.; Henderson, David K.; Parsons, Simon; Tasker, Peter A.; Winpenny, Richard E. P.","Inter-ligand reactions: in situ formation of new polydentate ligands","Journal of the Chemical Society, Dalton Transactions","2000","","14","2349","","10.1039/b001404o","","","1.54187","CuKα","","0.2941","0.1373","","","0.3361","0.4236","","","","","","1.127","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7009488","7.5234","0.0015","16.689","0.003","16.472","0.003","90","","101.145","0.017","90","","2029.2","0.7","220","2","220","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H20 N8 Ni S4 -","- C14 H20 N8 Ni S4 -","- C56 H80 N32 Ni4 S16 -","4","1","","Coxall, Robert A.; Harris, Steven G.; Henderson, David K.; Parsons, Simon; Tasker, Peter A.; Winpenny, Richard E. P.","Inter-ligand reactions: in situ formation of new polydentate ligands","Journal of the Chemical Society, Dalton Transactions","2000","","14","2349","","10.1039/b001404o","","","1.54178","CuKα","","0.1003","0.074","","","0.1875","0.2095","","","","","","1.006","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"7009489","9.03","0.002","13.949","0.004","9.394","0.002","90","","111.079","0.013","90","","1104.1","0.5","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C7 H12 N4 S2 -","- C7 H12 N4 S2 -","- C28 H48 N16 S8 -","4","1","","Coxall, Robert A.; Harris, Steven G.; Henderson, David K.; Parsons, Simon; Tasker, Peter A.; Winpenny, Richard E. P.","Inter-ligand reactions: in situ formation of new polydentate ligands","Journal of the Chemical Society, Dalton Transactions","2000","","14","2349","","10.1039/b001404o","","","1.54178","CuKα","","0.1113","0.0989","","","0.2872","0.3011","","","","","","1.088","","","","has coordinates,has disorder","179798","2020-10-21","18:00:00",""
"7009490","7.789","0.003","7.043","0.002","17.452","0.008","90","","93.36","0.04","90","","955.7","0.6","220","2","220","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7 H12 N4 O S -","- C7 H12 N4 O S -","- C28 H48 N16 O4 S4 -","4","1","","Coxall, Robert A.; Harris, Steven G.; Henderson, David K.; Parsons, Simon; Tasker, Peter A.; Winpenny, Richard E. P.","Inter-ligand reactions: in situ formation of new polydentate ligands","Journal of the Chemical Society, Dalton Transactions","2000","","14","2349","","10.1039/b001404o","","","1.54178","CuKα","","0.0817","0.0758","","","0.2155","0.2224","","","","","","1.082","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"7009491","19.6882","0.0008","19.7229","0.0008","39.7227","0.0018","90","","94.844","0.002","90","","15369.6","1.1","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C107 H155 Co6 N52 Na O18 S9 -","- C107 H155 Co6 N52 Na O18 S9 -","- C428 H620 Co24 N208 Na4 O72 S36 -","4","1","","Coxall, Robert A.; Harris, Steven G.; Henderson, David K.; Parsons, Simon; Tasker, Peter A.; Winpenny, Richard E. P.","Inter-ligand reactions: in situ formation of new polydentate ligands","Journal of the Chemical Society, Dalton Transactions","2000","","14","2349","","10.1039/b001404o","","","0.71073","MoKα","","0.2824","0.0998","","","0.2219","0.3073","","","","","","0.961","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009492","18.677","0.005","10.799","0.005","16.916","0.005","90","","110.22","0.01","90","","3202","2","290","2","290","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C24 H10 As Mo2 O14 P W2 -","- C24 H10 As Mo2 O14 P W2 -","- C96 H40 As4 Mo8 O56 P4 W8 -","4","0.5","","Davies, John E.; Mays, Martin J.; Raithby, Paul R.; Shields, Gregory P.; Tompkin, Peter K.; Woods, Anthony D.","The preparation of [M2Cp2(CO)4(μ-η2-PE)] (E = As or Sb), the first complexes with naked heterodiatomic Group 15 ligands, and of their adducts with W(CO)5","Journal of the Chemical Society, Dalton Transactions","2000","","12","1925","","10.1039/b001409p","","","0.71073","MoKα","","0.0786","0.0409","","0.082","0.0702","","","","0.999","1.054","1.054","","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009493","15.974","0.005","16.236","0.008","10.623","0.002","97.85","0.03","96.34","0.02","118.86","0.02","2340.4","1.6","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C19 H10 Mo2 O9 P Sb W -","- C19 H10 Mo2 O9 P Sb W -","- C76 H40 Mo8 O36 P4 Sb4 W4 -","4","2","","Davies, John E.; Mays, Martin J.; Raithby, Paul R.; Shields, Gregory P.; Tompkin, Peter K.; Woods, Anthony D.","The preparation of [M2Cp2(CO)4(μ-η2-PE)] (E = As or Sb), the first complexes with naked heterodiatomic Group 15 ligands, and of their adducts with W(CO)5","Journal of the Chemical Society, Dalton Transactions","2000","","12","1925","","10.1039/b001409p","","","0.71069","MoKα","","0.0389","0.035","","0.0922","0.0896","","","","1.092","1.111","1.111","","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009494","19.306","0.003","8.103","0.002","32.374","0.002","90","","107.987","0.007","90","","4817","1.4","294","2","294","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C19 H10 As O9 P W3 -","- C19 H10 As O9 P W3 -","- C152 H80 As8 O72 P8 W24 -","8","1","","Davies, John E.; Mays, Martin J.; Raithby, Paul R.; Shields, Gregory P.; Tompkin, Peter K.; Woods, Anthony D.","The preparation of [M2Cp2(CO)4(μ-η2-PE)] (E = As or Sb), the first complexes with naked heterodiatomic Group 15 ligands, and of their adducts with W(CO)5","Journal of the Chemical Society, Dalton Transactions","2000","","12","1925","","10.1039/b001409p","","","0.71069","MoKα","","0.1051","0.044","","0.173","0.115","","","","0.829","0.799","0.799","","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009495","19.255","0.003","8.095","0.004","31.957","0.004","90","","106.51","0.01","90","","4776","3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C19 H10 O9 P2 W3 -","- C19 H10 O9 P2 W3 -","- C152 H80 O72 P16 W24 -","8","1","","Davies, John E.; Mays, Martin J.; Raithby, Paul R.; Shields, Gregory P.; Tompkin, Peter K.; Woods, Anthony D.","The preparation of [M2Cp2(CO)4(μ-η2-PE)] (E = As or Sb), the first complexes with naked heterodiatomic Group 15 ligands, and of their adducts with W(CO)5","Journal of the Chemical Society, Dalton Transactions","2000","","12","1925","","10.1039/b001409p","","","0.71069","MoKα","","0.1189","0.0444","","0.224","0.0891","","","","1.028","1.095","1.095","","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009496","13.9032","0.0007","23.4916","0.0013","30.3394","0.0011","79.858","0.003","83.279","0.003","78.716","0.002","9530.6","0.8","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C89 H91 Bi4 O0.5 P Se13 -","- C89 Bi4 O0.5 P Se13 -","- C356 Bi16 O2 P4 Se52 -","4","2","","DeGroot, Marty W.; Corrigan, John F.","Polynuclear bismuth selenolates: rings en route to clusters","Journal of the Chemical Society, Dalton Transactions","2000","","8","1235","","10.1039/b001417f","","","0.71073","MoKα","","0.1531","0.0799","","","0.1907","0.2208","","","","","","0.976","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7009497","11.5193","0.0007","14.9695","0.0016","16.6252","0.0018","66.26","0.004","83.972","0.006","81.496","0.006","2592.1","0.4","200","2","200","2","","","","","","","","5","P -1","-P 1","2","","","","- C96 H80 Bi6 Br2 Se16 -","- C96 H80 Bi6 Br2 Se16 -","- C96 H80 Bi6 Br2 Se16 -","1","0.5","","DeGroot, Marty W.; Corrigan, John F.","Polynuclear bismuth selenolates: rings en route to clusters","Journal of the Chemical Society, Dalton Transactions","2000","","8","1235","","10.1039/b001417f","","","0.71073","MoKα","","0.0707","0.0484","","","0.1118","0.119","","","","","","0.982","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009498","29.042","0.002","7.1266","0.0006","20.5464","0.0017","90","","124.922","0.001","90","","3486.8","0.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","C6F4Hg2Cl2-THF-0.5benzene","","","- C13 H11 Cl2 F4 Hg2 O -","- C13 H11 Cl2 F4 Hg2 O -","- C104 H88 Cl16 F32 Hg16 O8 -","8","1","","Gardinier, James R.; Gabbaï, François P.","Interaction of benzene and 1,2-bis(chloromercurio)tetrafluorobenzene. Supramolecular frameworks based on Hg · · · Cl, Hg · · · F, Hg · · · π and π‒π interactions","Journal of the Chemical Society, Dalton Transactions","2000","","16","2861","","10.1039/b001420f","","","0.71073","MoKα","","0.0637","0.0546","","","0.1312","0.1377","","","","","","0.943","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009499","7.9488","0.0007","32.206","0.003","6.6881","0.0006","90","","99.195","0.002","90","","1690.1","0.3","90","2","90","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","C6F4Hg2Cl2-1.5benzene","","","- C15 H9 Cl2 F4 Hg2 -","- C15 H9 Cl2 F4 Hg2 -","- C60 H36 Cl8 F16 Hg8 -","4","1","","Gardinier, James R.; Gabbaï, François P.","Interaction of benzene and 1,2-bis(chloromercurio)tetrafluorobenzene. Supramolecular frameworks based on Hg · · · Cl, Hg · · · F, Hg · · · π and π‒π interactions","Journal of the Chemical Society, Dalton Transactions","2000","","16","2861","","10.1039/b001420f","","","0.71073","MoKα","","0.0519","0.0455","","","0.1071","0.1103","","","","","","1.058","","","","has coordinates","179798","2020-10-21","18:00:00",""
"7009500","14.785","0.01","17.559","0.005","27.448","0.005","90","","90","","90","","7126","5","293","2","293","2","","","","","","","synthesis as described","6","P b c a","-P 2ac 2ab","61","","Trans-1,4bis(diphenylphosphine)-4-methylpyridinetrichlororuthenium(III)","","- C34.5 H35.5 Cl4 N P2 Ru -","- C34.5 H35 Cl4.004 N P2 Ru -","- C276 H280 Cl32.032 N8 P16 Ru8 -","8","1","","Wohnrath, Karen; de Araujo, Márcio Peres; Dinelli, Luis Rogério; Batista, Alzir Azevedo; de Sousa Moreira, Icaro; Castellano, Eduardo Ernesto; Ellena, Javier","Electrosynthesis of binuclear ruthenium complexes from [RuCl3(dppb)(L)] precursors [L = pyridine, 4-methylpyridine or dimethyl sulfoxide; dppb = 1,4-bis(diphenylphosphino)butane]","Journal of the Chemical Society, Dalton Transactions","2000","","19","3383","","10.1039/b001422m","","","1.54184","CuKα","","0.2352","0.0565","","0.1589","0.1228","","","","1.189","1.619","1.619","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7009501","10.456","0.002","7.553","0.001","19.935","0.002","90","","100.641","0.013","90","","1547.3","0.4","150","2","396","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C30 H36 Cl2 N2 O2 P2 Pd -","- C30 H36 Cl2 N2 O2 P2 Pd -","- C60 H72 Cl4 N4 O4 P4 Pd2 -","2","0.5","","Burrows, Andrew D.; Mahon, Mary F.; Palmer, Mark T.","Ether functionalised aminophosphines: synthesis and co-ordination chemistry of palladium(II) and platinum(II) complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","10","1669","","10.1039/b001436m","","","0.71069","MoKα","","0.0451","0.0383","","0.1098","0.1084","","","","1.146","1.25","1.25","","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009502","8.396","0.002","10.146","0.002","10.849","0.003","94.97","0.02","111.01","0.02","94.71","0.02","853.1","0.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C32 H40 Cl2 N2 O4 P2 Pd -","- C32 H40 Cl2 N2 O4 P2 Pd -","- C32 H40 Cl2 N2 O4 P2 Pd -","1","0.5","","Burrows, Andrew D.; Mahon, Mary F.; Palmer, Mark T.","Ether functionalised aminophosphines: synthesis and co-ordination chemistry of palladium(II) and platinum(II) complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","10","1669","","10.1039/b001436m","","","0.71069","MoKα","","0.062","0.0518","","0.1459","0.1298","","","","1.223","1.292","1.292","","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009504","9.576","0.002","24.119","0.005","14.306","0.002","90","","105.09","0.02","90","","3190.2","1.1","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C30 H36 Br N3 O4 P2 Pt -","- C30 H36 Br N3 O4 P2 Pt -","- C120 H144 Br4 N12 O16 P8 Pt4 -","4","1","","Burrows, Andrew D.; Mahon, Mary F.; Palmer, Mark T.","Ether functionalised aminophosphines: synthesis and co-ordination chemistry of palladium(II) and platinum(II) complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","10","1669","","10.1039/b001436m","","","0.71069","MoKα","","0.0454","0.0325","","0.0949","0.0887","","","","1.091","1.181","1.181","","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009505","14.07","0.002","17.08","0.003","18.899","0.004","90","","90","","90","","4541.7","1.4","293","2","293","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C24 H30 Cl N2 O P Pd -","- C24 H30 Cl N2 O P Pd -","- C192 H240 Cl8 N16 O8 P8 Pd8 -","8","1","","Burrows, Andrew D.; Mahon, Mary F.; Palmer, Mark T.","Ether functionalised aminophosphines: synthesis and co-ordination chemistry of palladium(II) and platinum(II) complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","10","1669","","10.1039/b001436m","","","0.71069","MoKα","","0.0874","0.0534","","0.1446","0.1366","","","","1.104","1.296","1.296","","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009506","16.835","0.002","8.335","0.0009","19.59","0.002","90","","111.922","0.002","90","","2550.1","0.5","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C25 H32 Cl N2 O P Pd -","- C25 H32 Cl N2 O P Pd -","- C100 H128 Cl4 N8 O4 P4 Pd4 -","4","1","","Burrows, Andrew D.; Mahon, Mary F.; Palmer, Mark T.","Ether functionalised aminophosphines: synthesis and co-ordination chemistry of palladium(II) and platinum(II) complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","10","1669","","10.1039/b001436m","","","0.71073","MoKα","","0.0581","0.0392","","0.1028","0.0942","","","","0.906","0.985","0.985","","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009507","13.877","0.005","20.984","0.007","15.345","0.005","90","","107.09","0.03","90","","4271","3","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C43 H46 Cl2 N2 O2 P2 Pt2 -","- C43 H46 Cl2 N2 O2 P2 Pt2 -","- C172 H184 Cl8 N8 O8 P8 Pt8 -","4","1","","Burrows, Andrew D.; Mahon, Mary F.; Palmer, Mark T.","Ether functionalised aminophosphines: synthesis and co-ordination chemistry of palladium(II) and platinum(II) complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","10","1669","","10.1039/b001436m","","","0.71069","MoKα","","0.1541","0.0715","","0.1776","0.1449","","","","0.951","1.189","1.189","","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009508","9.8789","0.001","13.2748","0.0014","16.7055","0.0017","90","","90","","90","","2190.8","0.4","293","","293","","","","","","","","","7","P 21 n m","P -2 2ac","31","","","","- C40 H72 B F4 N2 P2 Rh -","- C40 H72 B F4 N2 P2 Rh -","- C80 H144 B2 F8 N4 P4 Rh2 -","2","0.5","","Chisholm, Malcolm H.; Huffman, John C.; Iyer, Suri S.","Some studies of the substitution chemistry of [Rh2(OAc)2(CH3CN)4][BF4]2 with monodentate and bidentate tertiary phosphines †","Journal of the Chemical Society, Dalton Transactions","2000","","9","1483","","10.1039/b001444n","","","0.71069","MoKα","","","0.0257","","","","0.0261","","","","","","1.4544","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7009509","7.976","0.003","8.806","0.003","11.83","0.004","102.15","0.02","93.4","0.02","108.16","0.02","764.8","0.5","220","2","220","2","","","","","","","","4","P -1","-P 1","2","","4,5-Bis(trifluoromethyl)-1,3,2-dithiazol-2-yl","","- C4 F6 N S2 -","- C4 F6 N S2 -","- C16 F24 N4 S8 -","4","2","","Brownridge, Scott; Du, Hongbin; Fairhurst, Shirley A.; Haddon, Robert C.; Oberhammer, Heinz; Parsons, Simon; Passmore, Jack; Schriver, Melbourne J.; Sutcliffe, Leslie H.; Westwood, Nicholas P. C.","The isolation, characterisation, gas phase electron diffraction and crystal structure of the thermally stable radical [CF3CSNSCCF3]˙ †","Journal of the Chemical Society, Dalton Transactions","2000","","19","3365","","10.1039/b001489n","","","0.71073","MoKα","","0.0641","0.0404","","0.1077","0.0956","","","","1.034","1.108","1.108","","","","","has coordinates,has disorder","179799","2020-10-21","18:00:00",""
"7009510","7.247","0.002","24.982","0.004","9.436","0.003","90","","92.17","0.03","90","","1707.1","0.8","473.2","","473.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H30 N4 Ni O8 -","- C10 H30 N4 Ni O8 -","- C40 H120 N16 Ni4 O32 -","4","1","","Yaroslaw D. Lampeka; Sergey P. Gavrish; Robert W. Hay; Tanja Eisenblätter; Philip Lightfoot","The crystal and molecular structures of the nickel(II) complexes of malonamide-derived unsubstituted 14- and 13-membered tetraazamacrocycles and NMR study of the complexes in aqueous solution","J. Chem. Soc., Dalton Trans.","2000","","13","2023","2029","10.1039/b001510p","","","0.7107","MoKalpha","","","0.0476","","","0.0541","","","","","3.464","3.464","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009511","9.892","0.003","11.279","0.004","7.352","0.002","94.48","0.02","102.43","0.02","83.95","0.03","795.3","0.4","293.2","","293.2","","","","","","","","","5","P -1","-P 1","2","","","","- C9 H26 N4 Ni O7 -","- C9 H26 N4 Ni O7 -","- C18 H52 N8 Ni2 O14 -","2","1","","Yaroslaw D. Lampeka; Sergey P. Gavrish; Robert W. Hay; Tanja Eisenblätter; Philip Lightfoot","The crystal and molecular structures of the nickel(II) complexes of malonamide-derived unsubstituted 14- and 13-membered tetraazamacrocycles and NMR study of the complexes in aqueous solution","J. Chem. Soc., Dalton Trans.","2000","","13","2023","2029","10.1039/b001510p","","","0.7107","MoKalpha","","","0.0407","","","0.0398","","","","","2.909","2.909","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009512","12.7188","0.0014","13.5675","0.0013","22.289","0.003","77.372","0.01","85.719","0.01","62.299","0.007","3321.4","0.7","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C58.5 H70 F18 N10 O6.5 P3 Ru -","- C59 H64 F18 N10 O6 P3 Ru -","- C118 H128 F36 N20 O12 P6 Ru2 -","2","1","","Encinas, Susana; Bushell, Karen L.; Couchman, Samantha M.; Jeffery, John C.; Ward, Michael D.; Flamigni, Lucia; Barigelletti, Francesco","Switching of the inter-component photoinduced electron- and energy-transfer properties of a Ru(II)‒aza-crown‒Re(I) complex; effects of changing temperature, and of incorporation of Ba2+ ion into the macrocyclic spacer between the chromophores","Journal of the Chemical Society, Dalton Transactions","2000","","11","1783","","10.1039/b001594f","","","0.71073","MoKα","","0.0837","0.0561","","0.1724","0.1555","","","","1.041","1.12","1.12","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009513","14.758","0.003","10.064","0.001","14.86","0.007","90","","118.32","0.02","90","","1942.9","1.1","178","2","178","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C15 H29 N2 O3 Re S3 -","- C15 H29 N2 O3 Re S3 -","- C60 H116 N8 O12 Re4 S12 -","4","1","","Friebe, Matthias; Spies, Hartmut; Seichter, Wilhelm; Leibnitz, Peter; Johannsen, Bernd","Neutral '3 + 1' mixed-ligand oxorhenium(V) complexes with tridentate [S,N,S] chelates and aminoalkanethiols: synthesis, characterization and structure determination ‡","Journal of the Chemical Society, Dalton Transactions","2000","","14","2471","","10.1039/b001600o","","","1.5418","CuKα","","0.0489","0.0457","","0.1612","0.1247","","","","1.112","1.123","1.123","","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009514","12.63","0.004","12.017","0.002","14.817","0.004","90","","114.68","0.01","90","","2043.4","0.9","298","2","298","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C14 H27 N2 O2 Re S3 -","- C14 H27 N2 O2 Re S3 -","- C56 H108 N8 O8 Re4 S12 -","4","1","","Friebe, Matthias; Spies, Hartmut; Seichter, Wilhelm; Leibnitz, Peter; Johannsen, Bernd","Neutral '3 + 1' mixed-ligand oxorhenium(V) complexes with tridentate [S,N,S] chelates and aminoalkanethiols: synthesis, characterization and structure determination ‡","Journal of the Chemical Society, Dalton Transactions","2000","","14","2471","","10.1039/b001600o","","","0.71073","MoKα","","0.083","0.0695","","0.1853","0.1714","","","","1.071","1.11","1.11","","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009515","11.767","0.003","11.422","0.009","13.299","0.006","90","","111.11","0.04","90","","1667.5","1.6","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C11 H23 N2 O2 Re S3 -","- C10.5 H22 N2 O2 Re S3 -","- C42 H88 N8 O8 Re4 S12 -","4","1","","Friebe, Matthias; Spies, Hartmut; Seichter, Wilhelm; Leibnitz, Peter; Johannsen, Bernd","Neutral '3 + 1' mixed-ligand oxorhenium(V) complexes with tridentate [S,N,S] chelates and aminoalkanethiols: synthesis, characterization and structure determination ‡","Journal of the Chemical Society, Dalton Transactions","2000","","14","2471","","10.1039/b001600o","","","0.71069","MoKα","","0.0905","0.0542","","","0.1632","0.1725","","","","","","1.286","","","","has coordinates,has disorder","179799","2020-10-21","18:00:00",""
"7009516","34.899","0.004","9.2258","0.0014","17.409","0.003","90","","90","","90","","5605.2","1.4","298","2","298","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C24 H31 B N9 O3 Tl -","- C24 H31 B N9 O3 Tl -","- C192 H248 B8 N72 O24 Tl8 -","8","1","","Rheingold, Arnold L.; Incarvito, Christopher D.; Trofimenko, Swiatoslaw","Hydrotris[3-(carboxypyrrolidido)pyrazol-1-yl]borate, the first proven N3O3-hexadentate homoscorpionate ligand","Journal of the Chemical Society, Dalton Transactions","2000","","8","1233","","10.1039/b001651i","","","0.71073","MoKα","","0.1331","0.0403","","0.1222","0.0882","","","","0.625","0.71","0.71","","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009517","25.7439","0.0003","19.9574","0.0002","25.715","0.0003","90","","101.106","0.0005","90","","12964.5","0.3","173","2","173","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C54 H68 B2 F6 La N18 O10 P -","- C48 H63 B2 F6 La N18 O6 P -","- C384 H504 B16 F48 La8 N144 O48 P8 -","8","1","","Rheingold, Arnold L.; Incarvito, Christopher D.; Trofimenko, Swiatoslaw","Hydrotris[3-(carboxypyrrolidido)pyrazol-1-yl]borate, the first proven N3O3-hexadentate homoscorpionate ligand","Journal of the Chemical Society, Dalton Transactions","2000","","8","1233","","10.1039/b001651i","","","0.71073","MoKα","","0.0818","0.0781","","","0.2581","0.2616","","","","","","2.205","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009518","26.0247","0.0004","19.8463","0.0003","26.3284","0.0004","90","","103.933","0.0007","90","","13198.4","0.4","173","2","173","2","","","","","","","","9","C 1 2/c 1","-C 2yc","15","","","","- C50 H65 B2 Cl5 F6 N18 Nd O6 P -","- C50 H65 B2 Cl5 F6 N18 Nd O6 P -","- C400 H520 B16 Cl40 F48 N144 Nd8 O48 P8 -","8","1","","Rheingold, Arnold L.; Incarvito, Christopher D.; Trofimenko, Swiatoslaw","Hydrotris[3-(carboxypyrrolidido)pyrazol-1-yl]borate, the first proven N3O3-hexadentate homoscorpionate ligand","Journal of the Chemical Society, Dalton Transactions","2000","","8","1233","","10.1039/b001651i","","","0.71073","MoKα","","0.1033","0.0852","","","0.2425","0.2638","","","","","","2.04","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009519","25.7018","0.0002","19.6629","0.0002","25.5878","0.0003","90","","100.436","0.0008","90","","12717.4","0.2","173","2","173","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C52.5 H72 B2 F6 N18 O8 P Sm -","- C52.5 H68 B2 F6 N18 O8 P Sm -","- C420 H544 B16 F48 N144 O64 P8 Sm8 -","8","1","","Rheingold, Arnold L.; Incarvito, Christopher D.; Trofimenko, Swiatoslaw","Hydrotris[3-(carboxypyrrolidido)pyrazol-1-yl]borate, the first proven N3O3-hexadentate homoscorpionate ligand","Journal of the Chemical Society, Dalton Transactions","2000","","8","1233","","10.1039/b001651i","","","0.71073","MoKα","","0.0922","0.0816","","","0.2035","0.2119","","","","","","1.168","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009520","9.22","0.001","19.906","0.003","15.722","0.003","90","","90.76","0.01","90","","2885.3","0.8","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C29 H24 Cl N5 O6 Ru -","- C29 H24 Cl N5 O6 Ru -","- C116 H96 Cl4 N20 O24 Ru4 -","4","1","","Chakraborty, Soma; Walawalkar, Mrinalini G.; Lahiri, Goutam Kumar","Ruthenium(II)/(III) bipyridine heterochelates incorporating phenolato imine functionalities. Synthesis, crystal structure, spectroscopic and electron-transfer properties and solution reactivities †","Journal of the Chemical Society, Dalton Transactions","2000","","16","2875","","10.1039/b001663m","","","0.7093","","","0.0548","0.0493","","","0.1924","0.203","","","","","","1.118","","","","has coordinates,has disorder","179799","2020-10-21","18:00:00",""
"7009521","12.958","0.004","15.683","0.003","11.773","0.002","103.87","0.01","102.67","0.02","113.47","0.02","1993","1","296.2","","296.2","","","","","","","","","6","P -1","-P 1","2","","","","- C36 H24 Ag6 N6 O12 S6 -","- C25 H36 Ag3 N3 O9.35 S6.5 -","- C50 H72 Ag6 N6 O18.7 S13 -","2","1","","Nomiya, Kenji; Takahashi, Satoshi; Noguchi, Ryusuke","Synthesis and crystal structure of a hexanuclear silver(I) cluster [Ag(Hmna)]6·4H2O (H2mna = 2-mercaptonicotinic acid) and a supramolecular gold(I) complex H[Au(Hmna)2] in the solid state, and their antimicrobial activities","Journal of the Chemical Society, Dalton Transactions","2000","","13","2091","","10.1039/b001664k","","","0.7107","MoKα","","0.0398","0.04","","0.057","","0.057","","","1.469","","","1.47","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009522","15.554","0.003","15.5541","","31.26","0.005","90","","90","","120","","6549.5","1.6","296.2","","296.2","","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","","","- C12 H9 Au N2 O4 S2 -","- C13.5 H10.125 Au0.5625 N2.25 O4.5 S2.25 -","- C216 H162 Au9 N36 O72 S36 -","16","0.444444","","Nomiya, Kenji; Takahashi, Satoshi; Noguchi, Ryusuke","Synthesis and crystal structure of a hexanuclear silver(I) cluster [Ag(Hmna)]6·4H2O (H2mna = 2-mercaptonicotinic acid) and a supramolecular gold(I) complex H[Au(Hmna)2] in the solid state, and their antimicrobial activities","Journal of the Chemical Society, Dalton Transactions","2000","","13","2091","","10.1039/b001664k","","","0.7107","MoKα","","0.038","0.038","","0.038","","0.038","","","1.222","","","1.22","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009523","8.5","0.002","14.877","0.002","18.743","0.003","90","","90","","90","","2370.1","0.7","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C24 H26 O7 Ru2 -","- C24 H26 O7 Ru2 -","- C96 H104 O28 Ru8 -","4","1","","King, Philip J.; Knox, Selby A. R.; Legge, Matthew S.; Orpen, A. Guy; Wilkinson, Jon N.; Hill, E. Alexander","Transformation of dimethyl acetylenedicarboxylate to bis(methylcarboxylate)vinylidene at a diruthenium centre: unprecedented 1,2-migration of a CO2Me group","Journal of the Chemical Society, Dalton Transactions","2000","","10","1547","","10.1039/b001666g","","","0.71073","MoKα","","0.0522","0.0336","","0.0569","0.0521","","","","0.986","1.008","1.008","","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009524","8.784","0.002","8.853","0.002","16.052","0.003","77.99","0.015","83.95","0.02","63.96","0.02","1096.9","0.5","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H20 F6 O3 Ru2 -","- C22 H20 F6 O3 Ru2 -","- C44 H40 F12 O6 Ru4 -","2","1","","King, Philip J.; Knox, Selby A. R.; Legge, Matthew S.; Orpen, A. Guy; Wilkinson, Jon N.; Hill, E. Alexander","Transformation of dimethyl acetylenedicarboxylate to bis(methylcarboxylate)vinylidene at a diruthenium centre: unprecedented 1,2-migration of a CO2Me group","Journal of the Chemical Society, Dalton Transactions","2000","","10","1547","","10.1039/b001666g","","","0.71073","MoKα","","0.0318","0.0211","","0.0453","0.0435","","","","0.934","1.011","1.011","","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009525","10.249","0.005","10.628","0.004","17.289","0.005","90","","100.76","0.03","90","","1850.1","1.3","150","2","150","2","","","","","","","","6","P 1 n 1","P -2yac","7","","tris(nitrato-O,O')bis(triphenylphosphineoxide)scandium(III)","","- C36 H30 N3 O11 P2 Sc -","- C36 H30 N3 O11 P2 Sc -","- C72 H60 N6 O22 P4 Sc2 -","2","1","","Deakin, Lucy; Levason, William; Popham, Michael C.; Reid, Gillian; Webster, Michael","Syntheses, structures and multinuclear NMR (45Sc, 89Y, 31P) studies of Ph3PO, Ph2MePO and Me3PO complexes of scandium and yttrium nitrates","Journal of the Chemical Society, Dalton Transactions","2000","","14","2439","","10.1039/b001669l","","","0.71073","MoKα","","0.1084","0.0515","","","0.1268","0.1546","","","","","","1.03","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009526","11.118","0.002","19.342","0.003","27.244","0.003","90","","94.569","0.016","90","","5840.1","1.5","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","tris(nitrato-O,O')tris(triphenylphosphineoxide)yttrium(III) dichloromethane solvate","","- C55.78 H48.56 Cl3.57 N3 O12 P3 Y -","- C55.784 H45 Cl3.568 N3 O12 P3 Y -","- C223.136 H180 Cl14.272 N12 O48 P12 Y4 -","4","1","","Deakin, Lucy; Levason, William; Popham, Michael C.; Reid, Gillian; Webster, Michael","Syntheses, structures and multinuclear NMR (45Sc, 89Y, 31P) studies of Ph3PO, Ph2MePO and Me3PO complexes of scandium and yttrium nitrates","Journal of the Chemical Society, Dalton Transactions","2000","","14","2439","","10.1039/b001669l","","","0.71073","MoKα","","0.1926","0.0656","","","0.1708","0.2206","","","","","","1.035","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009527","20.111","0.001","10.8636","0.0004","20.648","0.001","90","","106.83","0.002","90","","4317.9","0.3","150","","150","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","tris(nitrato-O,O')tris(diphenylmethylphosphineoxide)yttrium(III)","","- C39 H39 N3 O12 P3 Y -","- C39 H39 N3 O12 P3 Y -","- C156 H156 N12 O48 P12 Y4 -","4","1","","Deakin, Lucy; Levason, William; Popham, Michael C.; Reid, Gillian; Webster, Michael","Syntheses, structures and multinuclear NMR (45Sc, 89Y, 31P) studies of Ph3PO, Ph2MePO and Me3PO complexes of scandium and yttrium nitrates","Journal of the Chemical Society, Dalton Transactions","2000","","14","2439","","10.1039/b001669l","","","0.71073","MoKα","","","0.0623","","","","0.0422","","","","","","1.497","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009528","13.712","0.005","23.412","0.004","18.65","0.004","90","","98.4","0.02","90","","5923","3","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","bis(nitrato-O,O')tetrakis(diphenylmethylphosphineoxide)scandium(III) nitrate dichloromethane solvate","","- C53.3 H54.6 Cl2.6 N3 O13 P4 Sc -","- C53.3 H40 Cl2.6 N3 O13 P4 Sc -","- C213.2 H160 Cl10.4 N12 O52 P16 Sc4 -","4","1","","Deakin, Lucy; Levason, William; Popham, Michael C.; Reid, Gillian; Webster, Michael","Syntheses, structures and multinuclear NMR (45Sc, 89Y, 31P) studies of Ph3PO, Ph2MePO and Me3PO complexes of scandium and yttrium nitrates","Journal of the Chemical Society, Dalton Transactions","2000","","14","2439","","10.1039/b001669l","","","0.71073","MoKα","","0.2183","0.0846","","","0.246","0.3322","","","","","","1.031","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009529","16.975","0.002","10.745","0.002","22.024","0.003","90","","105.877","0.008","90","","3863.9","1","150","","150","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","tris(nitrato-O,O')bis(triphenylphosphineoxide)ethanolyttrium(III)","","- C38 H36 N3 O12 P2 Y -","- C38 H30 N3 O12 P2 Y -","- C152 H120 N12 O48 P8 Y4 -","4","1","","Deakin, Lucy; Levason, William; Popham, Michael C.; Reid, Gillian; Webster, Michael","Syntheses, structures and multinuclear NMR (45Sc, 89Y, 31P) studies of Ph3PO, Ph2MePO and Me3PO complexes of scandium and yttrium nitrates","Journal of the Chemical Society, Dalton Transactions","2000","","14","2439","","10.1039/b001669l","","","0.71073","MoKα","","0.0969","0.0969","","0.0954","","0.0954","","","1.361","","","1.361","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009530","14.578","0.01","15.39","0.02","10.57","0.02","100","0.1","93","0.1","96.91","0.09","2312","6","150","","150","","","","","","","","","6","P -1","-P 1","2","","tris(nitrato-O,O')tris(trimethylphosphineoxide)yttrium(III)","","- C9 H27 N3 O12 P3 Y -","- C9 N3 O12 P3 Y -","- C36 N12 O48 P12 Y4 -","4","2","","Deakin, Lucy; Levason, William; Popham, Michael C.; Reid, Gillian; Webster, Michael","Syntheses, structures and multinuclear NMR (45Sc, 89Y, 31P) studies of Ph3PO, Ph2MePO and Me3PO complexes of scandium and yttrium nitrates","Journal of the Chemical Society, Dalton Transactions","2000","","14","2439","","10.1039/b001669l","","","0.71073","MoKα","","0.0602","0.0602","","0.0624","","0.0624","","","5.688","","","5.688","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009531","11.17","0.006","11.411","0.004","41.504","0.006","90","","93.48","0.03","90","","5280","3","150","","150","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","tris(nitrato-O,O')tris(triphenylphosphineoxide)yttrium(III)","","- C54 H45 N3 O12 P3 Y -","- C54 H40 N3 O12 P3 Y -","- C216 H160 N12 O48 P12 Y4 -","4","1","","Deakin, Lucy; Levason, William; Popham, Michael C.; Reid, Gillian; Webster, Michael","Syntheses, structures and multinuclear NMR (45Sc, 89Y, 31P) studies of Ph3PO, Ph2MePO and Me3PO complexes of scandium and yttrium nitrates","Journal of the Chemical Society, Dalton Transactions","2000","","14","2439","","10.1039/b001669l","","","0.71073","MoKα","","0.0868","0.0868","","0.0947","","0.0947","","","2.695","","","2.695","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009532","10.618","0.002","11.047","0.002","11.621","0.002","69.48","0.03","68.38","0.03","72.25","0.03","1162.4","0.5","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C22 H20 Ag Cl N2 O5 S2 -","- C22 H20 Ag Cl N2 O5 S2 -","- C44 H40 Ag2 Cl2 N4 O10 S4 -","2","1","","Su, Cheng-Yong; Liao, Sen; Zhu, Hai-Liang; Kang, Bei-Sheng; Chen, Xiao-Ming; Liu, Han-Qin","Silver(I) complexes with quinoline based linear multidentate ligands: self-assembly of sulfur-bridged tetrametallotricyclic boxes †","Journal of the Chemical Society, Dalton Transactions","2000","","13","1985","","10.1039/b001723j","","","0.71073","MoKα","","0.0533","0.0439","","","0.1231","0.1289","","","","","","1.03","","","","has coordinates,has disorder","179799","2020-10-21","18:00:00",""
"7009533","9.088","0.001","11.064","0.001","14.898","0.002","92.9","0.01","105.69","0.02","113.98","0.02","1295.6","0.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C24 H24 Ag Cl N2 O6 S2 -","- C24 H24 Ag Cl N2 O6 S2 -","- C48 H48 Ag2 Cl2 N4 O12 S4 -","2","1","","Su, Cheng-Yong; Liao, Sen; Zhu, Hai-Liang; Kang, Bei-Sheng; Chen, Xiao-Ming; Liu, Han-Qin","Silver(I) complexes with quinoline based linear multidentate ligands: self-assembly of sulfur-bridged tetrametallotricyclic boxes †","Journal of the Chemical Society, Dalton Transactions","2000","","13","1985","","10.1039/b001723j","","","0.71073","MoKα","","0.0359","0.031","","","0.0831","0.0868","","","","","","1.035","","","","has coordinates,has disorder","179799","2020-10-21","18:00:00",""
"7009534","14.981","0.004","16.923","0.004","21.999","0.007","90","","90","","90","","5577","3","293","2","293","2","","","","","","","","6","P c a b","-P 2bc 2ac","61","","","","- C48 H48 Ag4 N8 O16 S4 -","- C48 H48 Ag4 N8 O16 S4 -","- C192 H192 Ag16 N32 O64 S16 -","4","0.5","","Su, Cheng-Yong; Liao, Sen; Zhu, Hai-Liang; Kang, Bei-Sheng; Chen, Xiao-Ming; Liu, Han-Qin","Silver(I) complexes with quinoline based linear multidentate ligands: self-assembly of sulfur-bridged tetrametallotricyclic boxes †","Journal of the Chemical Society, Dalton Transactions","2000","","13","1985","","10.1039/b001723j","","","0.71073","MoKα","","0.1","0.0506","","","0.1035","0.1238","","","","","","1.027","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009535","17.211","0.003","14.572","0.003","21.81","0.004","90","","90","","90","","5469.9","1.8","293","2","293","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C46 H46 Ag4 N8 O16 S4 -","- C46 H44 Ag4 N8 O16 S4 -","- C184 H176 Ag16 N32 O64 S16 -","4","0.5","","Su, Cheng-Yong; Liao, Sen; Zhu, Hai-Liang; Kang, Bei-Sheng; Chen, Xiao-Ming; Liu, Han-Qin","Silver(I) complexes with quinoline based linear multidentate ligands: self-assembly of sulfur-bridged tetrametallotricyclic boxes †","Journal of the Chemical Society, Dalton Transactions","2000","","13","1985","","10.1039/b001723j","","","0.71073","MoKα","","0.1541","0.062","","","0.1868","0.2264","","","","","","1.038","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009536","10.192","0.002","13.922","0.002","19.286","0.004","91.22","0.02","97.58","0.02","105.838","0.014","2604.9","0.9","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C56 H52 Cl2 Co Mn N O2 P4 -","- C56 H52 Cl2 Co Mn N O2 P4 -","- C112 H104 Cl4 Co2 Mn2 N2 O4 P8 -","2","1","","Connelly, Neil G.; Hicks, Owen M.; Lewis, Gareth R.; Orpen, A. Guy; Wood, Andrew J.","Coordination chemistry of a bulky redox-active cyanomanganese carbonyl ligand: N-bound tetrahedral complexes of 3d metals","Journal of the Chemical Society, Dalton Transactions","2000","","10","1637","","10.1039/b001782p","","","0.71073","MoKα","","0.0925","0.0582","","0.1289","0.1033","","","","1.226","1.156","1.156","","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009537","13.3946","0.0013","14.366","0.0008","16.995","0.002","110.087","0.009","106.829","0.008","99.213","0.008","2814.6","0.6","173","2","73","2","","","","","","","","7","P -1","-P 1","2","","","","- C60 H60 Cl2 Mn2 N O3 P4 -","- C60 H58.8 Cl2 Mn2 N O3 P4 -","- C120 H117.6 Cl4 Mn4 N2 O6 P8 -","2","1","","Connelly, Neil G.; Hicks, Owen M.; Lewis, Gareth R.; Orpen, A. Guy; Wood, Andrew J.","Coordination chemistry of a bulky redox-active cyanomanganese carbonyl ligand: N-bound tetrahedral complexes of 3d metals","Journal of the Chemical Society, Dalton Transactions","2000","","10","1637","","10.1039/b001782p","","","0.71073","MoKα","","0.042","0.0363","","0.0978","0.0885","","","","1.072","1.026","1.026","","","","","has coordinates,has disorder","179799","2020-10-21","18:00:00",""
"7009538","13.3705","0.0012","14.325","0.002","17.179","0.002","111.382","0.007","106.904","0.006","98.725","0.01","2806.2","0.6","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C60 H60 Cl2 Mn N Ni O3 P4 -","- C60 H60 Cl2 Mn N Ni O3 P4 -","- C120 H120 Cl4 Mn2 N2 Ni2 O6 P8 -","2","1","","Connelly, Neil G.; Hicks, Owen M.; Lewis, Gareth R.; Orpen, A. Guy; Wood, Andrew J.","Coordination chemistry of a bulky redox-active cyanomanganese carbonyl ligand: N-bound tetrahedral complexes of 3d metals","Journal of the Chemical Society, Dalton Transactions","2000","","10","1637","","10.1039/b001782p","","","0.71073","MoKα","","0.0799","0.0657","","0.1914","0.1656","","","","1.142","1.085","1.085","","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009539","21.332","0.003","11.742","0.002","37.409","0.004","90","","92.516","0.015","90","","9361","2","173","2","173","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C104 H88 Cl2 Co Mn2 N2 O2 P8 -","- C104 H88 Cl2 Co Mn2 N2 O2 P8 -","- C416 H352 Cl8 Co4 Mn8 N8 O8 P32 -","4","0.5","","Connelly, Neil G.; Hicks, Owen M.; Lewis, Gareth R.; Orpen, A. Guy; Wood, Andrew J.","Coordination chemistry of a bulky redox-active cyanomanganese carbonyl ligand: N-bound tetrahedral complexes of 3d metals","Journal of the Chemical Society, Dalton Transactions","2000","","10","1637","","10.1039/b001782p","","","0.71073","MoKα","","0.0503","0.0383","","0.0878","0.0786","","","","1.167","1.14","1.14","","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009540","12.629","0.003","23.525","0.004","18.306","0.004","90","","104.31","0.02","90","","5270","2","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C53 H46 Cl5 Mn2 N O P4 -","- C53 H46 Cl5 Mn2 N O P4 -","- C212 H184 Cl20 Mn8 N4 O4 P16 -","4","1","","Connelly, Neil G.; Hicks, Owen M.; Lewis, Gareth R.; Orpen, A. Guy; Wood, Andrew J.","Coordination chemistry of a bulky redox-active cyanomanganese carbonyl ligand: N-bound tetrahedral complexes of 3d metals","Journal of the Chemical Society, Dalton Transactions","2000","","10","1637","","10.1039/b001782p","","","0.71073","MoKα","","0.0932","0.0521","","0.1416","0.1193","","","","1.017","1.088","1.088","","","","","has coordinates,has disorder","179799","2020-10-21","18:00:00",""
"7009541","6.144","0.004","11.233","0.006","13.461","0.007","112.48","0.04","93.13","0.05","90.09","0.05","856.9","0.9","173","2","173","2","","","","","","","synthesis as described","4","P -1","-P 1","2","[In(P2C3tBu3)]","","","- C15 H27 In P2 -","- C7.5 H13.5 In0.5 P -","- C30 H54 In2 P4 -","4","2","","Guy K. B. Clentsmith; F. Geoffrey N. Cloke; Matthew D. Francis; Jennifer C. Green,; Peter B. Hitchcock; John F. Nixon; James L. Suter; David M. Vickers","A study of the molecular and electronic structures of the indium(I) phospholyls [In(η5-P2C3But3)] and [In(η5-P3C2But2)] by X-ray diffraction, photoelectron spectroscopy and density functional theory","J. Chem. Soc., Dalton Trans.","2000","","11","1715","1721","10.1039/b001793k","","","0.71073","MoKα","","0.1069","0.0682","","","0.1542","0.1727","","","","","","0.994","","","","has coordinates,has disorder","179799","2020-10-21","18:00:00",""
"7009542","16.956","0.002","14.131","0.001","14.927","0.002","90","","90.09","0.01","90","","3576.6","0.7","293","2","293","2","","","","","","","synthesis as described","4","P 1 21/n 1","-P 2yn","14","","","","- C40 H100 O30 Ta8 -","- C40 H100 O30 Ta8 -","- C80 H200 O60 Ta16 -","2","0.5","","Isaac Abrahams; Donald C. Bradley; Halina Chudzynska; Majid Motevalli; Paul O'Shaughnessy","Polynuclear tantalum oxoalkoxides. Crystal structures of [Ta8O10(OEt)20], [Ta7O9(OPri)17] and [Ta5O7(OBut)11]·C6H5Me","J. Chem. Soc., Dalton Trans.","2000","","16","2685","2691","10.1039/b001797n","","x-ray","0.71073","MoKα","","0.115","0.0688","","","0.1799","0.2045","","","","","","0.982","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7009543","21.847","0.009","13.626","0.005","27.917","0.009","90","","98.56","0.06","90","","8218","5","293","2","293","2","","","","","","","synthesis as described","4","C 1 2/c 1","-C 2yc","15","","","","- C51 H119 O26 Ta7 -","- C51 H119 O26 Ta7 -","- C204 H476 O104 Ta28 -","4","0.5","","Isaac Abrahams; Donald C. Bradley; Halina Chudzynska; Majid Motevalli; Paul O'Shaughnessy","Polynuclear tantalum oxoalkoxides. Crystal structures of [Ta8O10(OEt)20], [Ta7O9(OPri)17] and [Ta5O7(OBut)11]·C6H5Me","J. Chem. Soc., Dalton Trans.","2000","","16","2685","2691","10.1039/b001797n","","x-ray","0.71073","MoKα","","0.1425","0.0643","","","0.1409","0.1584","","","","","","1.055","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7009544","12.421","0.003","12.854","0.002","22.921","0.004","78.78","0.09","79.79","0.02","80.63","0.03","3501.4","1.6","293","2","293","2","","","","","","","synthesis as described","4","P -1","-P 1","2","","","","- C51 H107 O18 Ta5 -","- C51 H107 O18 Ta5 -","- C102 H214 O36 Ta10 -","2","1","","Isaac Abrahams; Donald C. Bradley; Halina Chudzynska; Majid Motevalli; Paul O'Shaughnessy","Polynuclear tantalum oxoalkoxides. Crystal structures of [Ta8O10(OEt)20], [Ta7O9(OPri)17] and [Ta5O7(OBut)11]·C6H5Me","J. Chem. Soc., Dalton Trans.","2000","","16","2685","2691","10.1039/b001797n","","x-ray","0.71073","MoKα","","0.1546","0.0876","","","0.2345","0.2645","","","","","","1.065","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7009545","13.11","0.003","13.611","0.005","15.009","0.002","105.679","0.013","92.656","0.018","98.31","0.03","2541.2","1.2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C51 H40.5 Ag2 B2 F8 N9.5 O2 -","- C51 H40.5 Ag2 B2 F8 N9.5 O2 -","- C102 H81 Ag4 B4 F16 N19 O4 -","2","1","","He Cheng; Duan Chun-ying; Fang Chen-jie; Meng Qing-jin","Self-assembled dinuclear molecular box [Ag2L2]2+ and triple helicates [Co2L3]4+, [Ni2L3]4+{L = bis[4-(2-pyridylmethyleneamino)phenyl] ether}","J. Chem. Soc., Dalton Trans.","2000","","14","2419","2424","10.1039/b001820l","","","0.71073","MoKα","","0.134","0.0695","","","0.167","0.205","","","","","","1.009","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7009546","22.78","0.004","18.385","0.003","20.144","0.006","90","","112.93","0.02","90","","7770","3","293","2","293","2","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C74.5 H59 B4 Co2 F16 N13 O3.5 -","- C74.5 H57 B4 Co2 F16 N13 O3.5 -","- C298 H228 B16 Co8 F64 N52 O14 -","4","1","","He Cheng; Duan Chun-ying; Fang Chen-jie; Meng Qing-jin","Self-assembled dinuclear molecular box [Ag2L2]2+ and triple helicates [Co2L3]4+, [Ni2L3]4+{L = bis[4-(2-pyridylmethyleneamino)phenyl] ether}","J. Chem. Soc., Dalton Trans.","2000","","14","2419","2424","10.1039/b001820l","","","0.71073","MoKα","","0.1781","0.0772","","0.2185","0.1606","","","","1.083","1.316","1.316","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7009547","22.723","0.008","18.472","0.006","20.184","0.009","90","","112.71","0.04","90","","7815","6","293","2","293","2","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C74.5 H59 B4 F16 N13 Ni2 O3.5 -","- C74.5 H57 B4 F16 N13 Ni2 O3.5 -","- C298 H228 B16 F64 N52 Ni8 O14 -","4","1","","He Cheng; Duan Chun-ying; Fang Chen-jie; Meng Qing-jin","Self-assembled dinuclear molecular box [Ag2L2]2+ and triple helicates [Co2L3]4+, [Ni2L3]4+{L = bis[4-(2-pyridylmethyleneamino)phenyl] ether}","J. Chem. Soc., Dalton Trans.","2000","","14","2419","2424","10.1039/b001820l","","","0.71073","MoKα","","0.1892","0.0745","","","0.1426","0.182","","","","","","0.993","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7009548","9.784","0.003","17.088","0.006","7.499","0.002","94.83","0.02","100.86","0.02","95.77","0.02","1218.2","0.7","296.2","","296.2","","","","","","","","","6","P -1","-P 1","2","","","","- C22 H16 Cl4 Co N2 O12 -","- C22 H16 Cl4 Co0.5 N2 O12 -","- C44 H32 Cl8 Co N4 O24 -","2","1","","Kawata, Satoshi; Kumagai, Hitoshi; Adachi, Keiichi; Kitagawa, Susumu","Novel layered structures constructed from metal(II)‒chloranilate monomer compounds","Journal of the Chemical Society, Dalton Transactions","2000","","14","2409","","10.1039/b001822h","","","0.71069","MoKα","","","0.0823","","","0.0444","","","","","1.516","1.516","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009549","9.028","0.002","9.797","0.002","8.764","0.002","113.17","0.02","117.23","0.01","71.65","0.02","625","0.3","296.2","","296.2","","","","","","","","","6","P -1","-P 1","2","","","","- C22 H16 Cl4 Cu N2 O12 -","- C22 H16 Cl4 Cu0.5 N2 O12 -","- C22 H16 Cl4 Cu0.5 N2 O12 -","1","0.5","","Kawata, Satoshi; Kumagai, Hitoshi; Adachi, Keiichi; Kitagawa, Susumu","Novel layered structures constructed from metal(II)‒chloranilate monomer compounds","Journal of the Chemical Society, Dalton Transactions","2000","","14","2409","","10.1039/b001822h","","","0.71073","MoKα","","","0.0349","","","0.0335","","","","","1.583","1.583","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009550","13.72","0.004","9.562","0.005","9.656","0.002","90","","90.53","0.02","90","","1266.7","0.8","296.2","","296.2","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H16 Cl4 Cu N2 O12 -","- C22 H16 Cl4 Cu0.5 N2 O12 -","- C44 H32 Cl8 Cu N4 O24 -","2","0.5","","Kawata, Satoshi; Kumagai, Hitoshi; Adachi, Keiichi; Kitagawa, Susumu","Novel layered structures constructed from metal(II)‒chloranilate monomer compounds","Journal of the Chemical Society, Dalton Transactions","2000","","14","2409","","10.1039/b001822h","","","0.71069","MoKα","","","0.052","","","0.0529","","","","","1.664","1.664","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009551","19.985","0.005","19.711","0.002","16.547","0.003","90","","90","","90","","6518","2","293.2","","293.2","","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C26 H35 Cl2 Co N5 O12 Pb -","- C26 H33 Cl2 Co N5 O12 Pb -","- C208 H264 Cl16 Co8 N40 O96 Pb8 -","8","1","","Furutachi, Hideki; Fujinami, Shuhei; Suzuki, Masatatsu; Ōkawa, Hisashi","Dinuclear CoIIMII (M = Pb or Co) complexes having a “Co(salen)” entity in a macrocyclic framework: ligand modulation effect and neighboring metal(II) effect upon oxygenation at the “Co(salen)” center","Journal of the Chemical Society, Dalton Transactions","2000","","16","2761","","10.1039/b001881n","","","0.7107","MoK","","","0.032","","","0.023","","","","","1.4","1.4","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009552","10.8","0.002","36.598","0.005","9.393","0.003","89","","112.17","0.02","90","","3437.6","1.4","288.2","","288.2","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H33 Cl2 Co2 N7 O10 -","- C28 H33 Cl2 Co2 N7 O10 -","- C112 H132 Cl8 Co8 N28 O40 -","4","1","","Furutachi, Hideki; Fujinami, Shuhei; Suzuki, Masatatsu; Ōkawa, Hisashi","Dinuclear CoIIMII (M = Pb or Co) complexes having a “Co(salen)” entity in a macrocyclic framework: ligand modulation effect and neighboring metal(II) effect upon oxygenation at the “Co(salen)” center","Journal of the Chemical Society, Dalton Transactions","2000","","16","2761","","10.1039/b001881n","","","0.7107","MoK","","","0.0477","","","0.0599","","","","","1.051","1.051","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009553","13.563","0.007","13.56","0.01","35.8","0.02","90","","90","","120","","5702","6","296.2","","296.2","","","","","","","","","6","P 65","P 65","170","","","","- C32 H41 Cl2 Co2 N7 O10 -","- C32 H41 Cl2 Co2 N7 O10 -","- C192 H246 Cl12 Co12 N42 O60 -","6","1","","Furutachi, Hideki; Fujinami, Shuhei; Suzuki, Masatatsu; Ōkawa, Hisashi","Dinuclear CoIIMII (M = Pb or Co) complexes having a “Co(salen)” entity in a macrocyclic framework: ligand modulation effect and neighboring metal(II) effect upon oxygenation at the “Co(salen)” center","Journal of the Chemical Society, Dalton Transactions","2000","","16","2761","","10.1039/b001881n","","","0.7107","MoK","","","0.0833","","","0.1156","","","","","2.106","2.106","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009554","16.593","0.008","12.024","0.006","20.068","0.006","90","","109.72","0.03","90","","3769","3","293.2","","293.2","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C30 H43 Cl2 Co N5 O12 Pb -","- C30 H41 Cl2 Co N5 O12 Pb -","- C120 H164 Cl8 Co4 N20 O48 Pb4 -","4","1","","Furutachi, Hideki; Fujinami, Shuhei; Suzuki, Masatatsu; Ōkawa, Hisashi","Dinuclear CoIIMII (M = Pb or Co) complexes having a “Co(salen)” entity in a macrocyclic framework: ligand modulation effect and neighboring metal(II) effect upon oxygenation at the “Co(salen)” center","Journal of the Chemical Society, Dalton Transactions","2000","","16","2761","","10.1039/b001881n","","","0.7107","MoK(","","","0.0511","","","0.0772","","","","","1.459","1.459","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009555","44.812","0.007","27.865","0.007","18.344","0.003","90","","90","","90","","22906","8","153.15","","153.15","","","","","","","","","8","P b c a","-P 2ac 2ab","61","","","","- C108 H105 B2 Cl2 Co2 N16 O19.5 Pb2 -","- C108 H103 B2 Cl2 Co2 N16 O19.5 Pb2 -","- C864 H824 B16 Cl16 Co16 N128 O156 Pb16 -","8","1","","Furutachi, Hideki; Fujinami, Shuhei; Suzuki, Masatatsu; Ōkawa, Hisashi","Dinuclear CoIIMII (M = Pb or Co) complexes having a “Co(salen)” entity in a macrocyclic framework: ligand modulation effect and neighboring metal(II) effect upon oxygenation at the “Co(salen)” center","Journal of the Chemical Society, Dalton Transactions","2000","","16","2761","","10.1039/b001881n","","","0.7107","MoK(","","","0.065","","","0.0709","","","","","1.278","1.278","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009556","11.695","0.004","17.567","0.007","22.437","0.006","90","","90","","90","","4610","3","203","","203","","","","","","","","see paper","5","P 21 21 21","P 2ac 2ab","19","polynuclear carbonyl derivative Cu4(CCl3COO)6(CHCl2COOH)(CO)2","","","- C16 H2 Cl20 Cu4 O16 -","- C16 H2 Cl20 Cu4 O16 -","- C64 H8 Cl80 Cu16 O64 -","4","1","","Daniela Belli Dell'Amico; Rocco Alessio; Fausto Calderazzo; Fabrizio Della Pina; Ulli Englert; Guido Pampaloni; Vincenzo Passarelli","Synproportionation reactions between copper(II) trihalogenoacetates Cu(CX3CO2)2, X = F, Cl or Br, and copper in the presence of carbon monoxide","J. Chem. Soc., Dalton Trans.","2000","","13","2067","2075","10.1039/b001889i","","","0.71073","Mo-Kα","","0.1506","0.091","","0.2706","0.2259","","","","1.024","1.116","1.116","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"7009557","9.354","0.004","9.65","0.001","10.875","0.005","79","0.02","67.62","0.03","73.08","0.02","864.9","0.6","203","","203","","","","","","","","","5","P -1","-P 1","2","chloroacetato derivative Cu2(CCl3COO)4(CCl3COOH)2","","","- C12 H2 Cl18 Cu2 O12 -","- C14 H2 Cl24 Cu2 O12 -","- C14 H2 Cl24 Cu2 O12 -","1","0.5","","Daniela Belli Dell'Amico; Rocco Alessio; Fausto Calderazzo; Fabrizio Della Pina; Ulli Englert; Guido Pampaloni; Vincenzo Passarelli","Synproportionation reactions between copper(II) trihalogenoacetates Cu(CX3CO2)2, X = F, Cl or Br, and copper in the presence of carbon monoxide","J. Chem. Soc., Dalton Trans.","2000","","13","2067","2075","10.1039/b001889i","","","0.71073","Mo-Kα","","","0.069","","","0.075","","","","","1.952","1.952","","","","","has coordinates","277878","2022-09-15","13:04:32",""
"7009558","11.1896","0.0008","19.063","0.001","23.732","0.002","90","","90","","90","","5062.2","0.6","213","2","213","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C47 H37 Cl11 P2 Ru S2 -","- C47 H37 Cl11 P2 Ru S2 -","- C188 H148 Cl44 P8 Ru4 S8 -","4","1","","Clot, Olivier; Wolf, Michael O.; Yap, Glenn P. A.; Patrick, Brian O.","Synthesis and reactivity of ruthenium(II) complexes containing hemilabile phosphine‒thiophene ligands","Journal of the Chemical Society, Dalton Transactions","2000","","16","2729","","10.1039/b001898h","","","0.71073","MoKα","","0.0748","0.0486","","","0.1151","0.1225","","","","","","1.025","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009559","17.069","0.007","12.857","0.007","24.092","0.007","90","","105.325","0.009","90","","5099","4","238","2","238","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C50 H35 Cl5 O P2 Ru S6 -","- C50 H35 Cl5 O P2 Ru S5.999 -","- C200 H140 Cl20 O4 P8 Ru4 S23.996 -","4","1","","Clot, Olivier; Wolf, Michael O.; Yap, Glenn P. A.; Patrick, Brian O.","Synthesis and reactivity of ruthenium(II) complexes containing hemilabile phosphine‒thiophene ligands","Journal of the Chemical Society, Dalton Transactions","2000","","16","2729","","10.1039/b001898h","","","0.71073","MoKα","","0.1242","0.0621","","","0.1369","0.1584","","","","","","1.066","","","","has coordinates,has disorder","179799","2020-10-21","18:00:00",""
"7009560","15.7595","0.0006","15.5059","0.0005","22.323","0.001","90","","93.506","0.003","90","","5444.8","0.4","173.2","","173.2","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C52 H45 Cl8 P3 Ru S3 -","- C52.92 H45 Cl8 P3 Ru S2.688 -","- C211.68 H180 Cl32 P12 Ru4 S10.752 -","4","1","","Clot, Olivier; Wolf, Michael O.; Yap, Glenn P. A.; Patrick, Brian O.","Synthesis and reactivity of ruthenium(II) complexes containing hemilabile phosphine‒thiophene ligands","Journal of the Chemical Society, Dalton Transactions","2000","","16","2729","","10.1039/b001898h","","","0.7107","MoKα","","0.0763","","","0.1285","","","","","1.855","","","1.855","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009561","10.9167","0.0008","16.7444","0.0011","16.9819","0.0012","63.452","0.001","78.627","0.001","84.008","0.001","2721.9","0.3","293","","293","","","","","","","","","6","P -1","-P 1","2","","","","- C56 H73 O2 P Ru Si2 -","- C56 H73 O2 P Ru Si2 -","- C112 H146 O4 P2 Ru2 Si4 -","2","1","","Bruce, Michael I.; Hall, Ben C.; Skelton, Brian W.; White, Allan H.; Zaitseva, Natasha N.","Oligomerisation of alkynes at a pentamethylcyclopentadienylruthenium centre †","Journal of the Chemical Society, Dalton Transactions","2000","","14","2279","","10.1039/b001981j","","","0.71073","MoKα","","0.068","0.0415","","0.054","","0.0505","","","1.259","","","1.421","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009562","22.569","0.005","18.155","0.004","9.376","0.003","76.66","0.02","83.89","0.02","84.74","0.02","3707.9","1.7","293","","293","","","","","","","","","5","P -1","-P 1","2","","","","- C88 H86 O8 P2 Ru2 -","- C88 H86 O8 P2 Ru2 -","- C176 H172 O16 P4 Ru4 -","2","1","","Bruce, Michael I.; Hall, Ben C.; Skelton, Brian W.; White, Allan H.; Zaitseva, Natasha N.","Oligomerisation of alkynes at a pentamethylcyclopentadienylruthenium centre †","Journal of the Chemical Society, Dalton Transactions","2000","","14","2279","","10.1039/b001981j","","","0.71073","MoKα","","0.085","0.06","","0.081","","0.073","","","1.582","","","1.748","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009563","10.386","0.004","20.927","0.006","37.598","0.014","90","","90.31","0.03","90","","8172","5","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C52 H47 P Ru -","- C52 H47 P Ru -","- C416 H376 P8 Ru8 -","8","2","","Bruce, Michael I.; Hall, Ben C.; Skelton, Brian W.; White, Allan H.; Zaitseva, Natasha N.","Oligomerisation of alkynes at a pentamethylcyclopentadienylruthenium centre †","Journal of the Chemical Society, Dalton Transactions","2000","","14","2279","","10.1039/b001981j","","","0.71073","MoKα","","0.052","0.052","","0.052","","0.052","","","1.689","","","1.689","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009564","18.013","0.006","10.666","0.005","10.382","0.002","108.41","0.03","95.62","0.02","91.7","0.03","1879.6","1.2","293","","293","","","","","","","","","5","P -1","-P 1","2","","","","- C44 H43 O4 P Ru -","- C44 H43 O4 P Ru -","- C88 H86 O8 P2 Ru2 -","2","1","","Bruce, Michael I.; Hall, Ben C.; Skelton, Brian W.; White, Allan H.; Zaitseva, Natasha N.","Oligomerisation of alkynes at a pentamethylcyclopentadienylruthenium centre †","Journal of the Chemical Society, Dalton Transactions","2000","","14","2279","","10.1039/b001981j","","","0.71073","MoKα","","0.066","0.049","","0.056","","0.053","","","1.638","","","1.803","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009565","38.14","0.02","9.478","0.004","21.88","0.03","90","","109.66","0.07","90","","7448","12","293","","293","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C42.5 H45 O2 P Ru -","- C42.5 H45 O2 P Ru -","- C340 H360 O16 P8 Ru8 -","8","1","","Bruce, Michael I.; Hall, Ben C.; Skelton, Brian W.; White, Allan H.; Zaitseva, Natasha N.","Oligomerisation of alkynes at a pentamethylcyclopentadienylruthenium centre †","Journal of the Chemical Society, Dalton Transactions","2000","","14","2279","","10.1039/b001981j","","","0.71073","MoKα","","0.18","0.046","","0.082","","0.05","","","1.198","","","1.271","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009566","22.793","0.016","18.423","0.019","9.378","0.007","76.63","0.07","83.96","0.06","84.66","0.07","3800","6","293","","293","","","","","","","","","5","P -1","-P 1","2","","","","- C45 H45 O4 P Ru -","- C45 H45 O4 P Ru -","- C180 H180 O16 P4 Ru4 -","4","2","","Bruce, Michael I.; Hall, Ben C.; Skelton, Brian W.; White, Allan H.; Zaitseva, Natasha N.","Oligomerisation of alkynes at a pentamethylcyclopentadienylruthenium centre †","Journal of the Chemical Society, Dalton Transactions","2000","","14","2279","","10.1039/b001981j","","","0.71073","MoKα","","0.086","0.048","","0.067","","0.056","","","1.403","","","1.547","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009567","9.813","0.004","17.821","0.007","23.802","0.008","90","","94.95","0.03","90","","4147","3","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C41 H48 Cl2 N6 Ti -","- C41 H48 Cl2 N6 Ti -","- C164 H192 Cl8 N24 Ti4 -","4","0.5","","Bailey, Philip J.; Grant, Keith J.; Mitchell, Lindsey A.; Pace, Stuart; Parkin, Andrew; Parsons, Simon","Guanidinates as chelating anionic ligands for early, middle and late transition metals: syntheses and crystal structures of [Ti{η2-(NPh)2CNEt2}2Cl2], [Ru{η2-(NPh)2CNHPh}3] and [Pt{η2-(NPh)2CNHPh}2]","Journal of the Chemical Society, Dalton Transactions","2000","","12","1887","","10.1039/b001992p","","","0.71073","MoKα","","0.1185","0.0688","","","0.1945","0.2242","","","","","","1.043","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"7009568","6.455","0.005","10.971","0.008","11.591","0.008","76.11","0.05","77.68","0.04","86.81","0.06","778.5","1","0","","150","","","","","","","","?","4","P -1","-P 1","2","","","","- C38 H32 N6 Pt -","- C38 H32 N6 Pt -","- C38 H32 N6 Pt -","1","0.5","","Bailey, Philip J.; Grant, Keith J.; Mitchell, Lindsey A.; Pace, Stuart; Parkin, Andrew; Parsons, Simon","Guanidinates as chelating anionic ligands for early, middle and late transition metals: syntheses and crystal structures of [Ti{η2-(NPh)2CNEt2}2Cl2], [Ru{η2-(NPh)2CNHPh}3] and [Pt{η2-(NPh)2CNHPh}2]","Journal of the Chemical Society, Dalton Transactions","2000","","12","1887","","10.1039/b001992p","","","0.71073","MoKα","","","0.0388","","","0.0394","","","","","0.9389","0.9389","","","","","has coordinates","211691","2020-10-21","18:00:00",""
"7009569","22.248","0.003","20.648","0.004","11.784","0.002","90","","90","","90","","5413.3","1.6","150","2","150","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C62 H60 N9 Ru -","- C62 H60 N9 Ru -","- C248 H240 N36 Ru4 -","4","1","","Bailey, Philip J.; Grant, Keith J.; Mitchell, Lindsey A.; Pace, Stuart; Parkin, Andrew; Parsons, Simon","Guanidinates as chelating anionic ligands for early, middle and late transition metals: syntheses and crystal structures of [Ti{η2-(NPh)2CNEt2}2Cl2], [Ru{η2-(NPh)2CNHPh}3] and [Pt{η2-(NPh)2CNHPh}2]","Journal of the Chemical Society, Dalton Transactions","2000","","12","1887","","10.1039/b001992p","","","1.54184","CuKα","","0.0824","0.0544","","0.1358","0.1096","","","","1.043","1.034","1.034","","","","","has coordinates,has disorder","179799","2020-10-21","18:00:00",""
"7009570","12.122","0.003","13.084","0.002","15.155","0.003","110.42","0.02","106.75","0.02","92.59","0.02","2128.4","0.9","292","2","292","2","","","","","","","","9","P -1","-P 1","2","","","","- C32 H37 B10 Cl2 F4 O3 P2 Pt Re -","- C32 H37 B10 Cl2 F4 O3 P2 Pt Re -","- C64 H74 B20 Cl4 F8 O6 P4 Pt2 Re2 -","2","1","","Ellis, Dianne D.; Jelliss, Paul A.; Stone, F. Gordon A.","Synthesis of rhenium‒platinum complexes bearing carbaborane ligands and their unusual dynamic behavior †","Journal of the Chemical Society, Dalton Transactions","2000","","13","2113","","10.1039/b002043p","","","0.71073","MoKα","","0.1018","0.065","","0.1455","0.1311","","","","0.78","1.061","1.061","","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009571","11.3019","0.0015","13.0493","0.0012","15.508","0.004","66.198","0.014","80.29","0.015","66.735","0.01","1922.3","0.6","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C32 H36 B9 Cl2 O3 P2 Pt Re -","- C32 H36 B9 Cl2 O3 P2 Pt Re -","- C64 H72 B18 Cl4 O6 P4 Pt2 Re2 -","2","1","","Ellis, Dianne D.; Jelliss, Paul A.; Stone, F. Gordon A.","Synthesis of rhenium‒platinum complexes bearing carbaborane ligands and their unusual dynamic behavior †","Journal of the Chemical Society, Dalton Transactions","2000","","13","2113","","10.1039/b002043p","","","0.71073","MoKα","","0.0841","0.0523","","0.1256","0.1109","","","","1.129","1.23","1.23","","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009572","34.402","0.002","34.402","0.002","13.7159","0.0011","90","","90","","120","","14058","1.6","293","2","293","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C222 H180 Cu6 N6 P12 -","- C222 H180 Cu6 N6 P12 -","- C666 H540 Cu18 N18 P36 -","3","0.166667","","Zhao, Yingjun; Hong, Maochun; Su, Weiping; Cao, Rong; Zhou, Zhongyuan; Chan, Albert S. C.","Synthesis and characterization of two copper cyanide complexes with hexagonal Cu6 units","Journal of the Chemical Society, Dalton Transactions","2000","","11","1685","","10.1039/b002096f","","","0.71073","MoKα","","0.0518","0.0346","","0.1053","0.0934","","","","1.002","1.039","1.039","","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009573","14.362","0.002","19.037","0.003","8.9251","0.0014","90","","90","","90","","2440.2","0.6","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C27 H20 Cu2 N3 P -","- C28 H20 Cu2 N2 P -","- C112 H80 Cu8 N8 P4 -","4","0.5","","Zhao, Yingjun; Hong, Maochun; Su, Weiping; Cao, Rong; Zhou, Zhongyuan; Chan, Albert S. C.","Synthesis and characterization of two copper cyanide complexes with hexagonal Cu6 units","Journal of the Chemical Society, Dalton Transactions","2000","","11","1685","","10.1039/b002096f","","","0.71073","MoKα","","0.0707","0.0432","","0.1277","0.1156","","","","0.908","1.048","1.048","","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009574","12.309","0.009","13.834","0.009","14.528","0.007","90","","97.74","0.05","90","","2451","3","298","","298","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H28 Cl2 Cu N6 O8 -","- C18 H24 Cl2 Cu N6 O8 -","- C72 H96 Cl8 Cu4 N24 O32 -","4","1","","Bazzicalupi, Carla; Bencini, Andrea; Ciattini, Samuele; Giorgi, Claudia; Masotti, Andrea; Paoletti, Piero; Valtancoli, Barbara; Navon, Nadav; Meyerstein, Dan","Copper-(II) and -(I) co-ordination by hexa-amine ligands of different rigidities. A thermodynamic, structural and electrochemical investigation †","Journal of the Chemical Society, Dalton Transactions","2000","","14","2383","","10.1039/b002102o","","","0.71069","MoKα","","0.2966","0.0938","","0.3969","0.2545","","","","0.922","1.057","1.057","","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009575","8.45","0.008","22.613","0.004","16.394","0.009","90","","101.12","0.06","90","","3074","3","298","","298","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C20 H31 Br Cl3 Cu2 N6 O13.5 -","- C20 H19 Br Cl3 Cu2 N6 O13.5 -","- C80 H76 Br4 Cl12 Cu8 N24 O54 -","4","1","","Bazzicalupi, Carla; Bencini, Andrea; Ciattini, Samuele; Giorgi, Claudia; Masotti, Andrea; Paoletti, Piero; Valtancoli, Barbara; Navon, Nadav; Meyerstein, Dan","Copper-(II) and -(I) co-ordination by hexa-amine ligands of different rigidities. A thermodynamic, structural and electrochemical investigation †","Journal of the Chemical Society, Dalton Transactions","2000","","14","2383","","10.1039/b002102o","","","1.54178","CuKα","","0.1227","0.092","","0.2971","0.2405","","","","1.061","1.03","1.03","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009576","7.302","0.001","15.216","0.001","8.925","0.001","90","","104.86","0.01","90","","958.47","0.19","295","2","295","2","","","","","","","","5","P 1 21 1","P 2yb","4","[Ni(edda)(H2O)]xH2O","","","- C18 H30 N2 Ni O6 -","- C18 H26 N2 Ni O6 -","- C36 H52 N4 Ni2 O12 -","2","1","","Pennemann, Helmut; Wassmann, Suzanne; Wilken, Jörg; Gröger, Harald; Wallbaum, Sabine; Kossenjans, Michael; Haase, Detlev; Saak, Wolfgang; Pohl, Siegfried; Martens, Jürgen","Preparation of an enantiomerically pure helical nickel(II) complex using a new chiral tetradentate ligand derived from an industrial waste material †","Journal of the Chemical Society, Dalton Transactions","2000","","14","2467","","10.1039/b002130j","","","0.71073","MoKα","","0.0361","0.0349","","","0.091","0.0919","","","","","","1.067","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009577","13.396","0.0008","17.6134","0.0011","19.0634","0.0011","108.731","0.001","95.049","0.001","97.956","0.001","4176.5","0.4","150","2","150","2","","","","","","","","6","P -1","-P 1","2","Metheidi Chloride Crust","","","- C70 H201 Cl Fe19 N10 O113.5 -","- C70 H114 Cl Fe19 N10 O113.5 -","- C70 H114 Cl Fe19 N10 O113.5 -","1","0.5","","Goodwin, Jeremy C.; Sessoli, Roberta; Gatteschi, Dante; Wernsdorfer, Wolfgang; Powell, Annie K.; Heath, Sarah L.","Towards nanostructured arrays of single molecule magnets: new Fe19 oxyhydroxide clusters displaying high ground state spins and hysteresis †","Journal of the Chemical Society, Dalton Transactions","2000","","12","1835","","10.1039/b002135k","","","0.71073","MoKα","","0.1185","0.0734","","","0.2143","0.2463","","","","","","0.972","","","","has coordinates,has disorder","194037","2020-10-21","18:00:00",""
"7009578","13.309","0.003","17.273","0.005","17.6","0.004","65.201","0.01","74.514","0.016","81.3","0.02","3536","1.6","150","2","150","2","","","","","","","","5","P -1","-P 1","2","Metheidi Crust","","","- C70 H186 Fe19 N11 O109 -","- C70 H138 Fe19 N11 O109 -","- C70 H138 Fe19 N11 O109 -","1","0.5","","Goodwin, Jeremy C.; Sessoli, Roberta; Gatteschi, Dante; Wernsdorfer, Wolfgang; Powell, Annie K.; Heath, Sarah L.","Towards nanostructured arrays of single molecule magnets: new Fe19 oxyhydroxide clusters displaying high ground state spins and hysteresis †","Journal of the Chemical Society, Dalton Transactions","2000","","12","1835","","10.1039/b002135k","","","0.71073","MoKα","","0.11","0.0536","","","0.1235","0.1418","","","","","","0.887","","","","has coordinates,has disorder","179799","2020-10-21","18:00:00",""
"7009579","13.044","0.003","17.624","0.004","18.621","0.004","110.472","0.004","94.82","0.005","98.137","0.004","3928.6","1.5","150","2","150","2","","","","","","","","5","P -1","-P 1","2","Etheidi Crust","","","- C80 H194 Fe19 N11 O103 -","- C80 H116 Fe19 N11 O103 -","- C80 H116 Fe19 N11 O103 -","1","0.5","","Goodwin, Jeremy C.; Sessoli, Roberta; Gatteschi, Dante; Wernsdorfer, Wolfgang; Powell, Annie K.; Heath, Sarah L.","Towards nanostructured arrays of single molecule magnets: new Fe19 oxyhydroxide clusters displaying high ground state spins and hysteresis †","Journal of the Chemical Society, Dalton Transactions","2000","","12","1835","","10.1039/b002135k","","","0.71073","MoKα","","0.4014","0.1097","","","0.2493","0.3579","","","","","","0.818","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009580","6.9549","0.0008","9.3819","0.0011","9.913","0.0012","67.995","0.002","88.68","0.002","74.027","0.002","574.22","0.12","150","2","150","2","","","","","","","","5","P -1","-P 1","2","Metheidi dimer","","","- C14 H32 Fe2 N2 O16 -","- C14 H32 Fe2 N2 O16 -","- C14 H32 Fe2 N2 O16 -","1","0.5","","Goodwin, Jeremy C.; Sessoli, Roberta; Gatteschi, Dante; Wernsdorfer, Wolfgang; Powell, Annie K.; Heath, Sarah L.","Towards nanostructured arrays of single molecule magnets: new Fe19 oxyhydroxide clusters displaying high ground state spins and hysteresis †","Journal of the Chemical Society, Dalton Transactions","2000","","12","1835","","10.1039/b002135k","","","0.71073","MoKα","","0.0608","0.0488","","","0.1192","0.1242","","","","","","1.022","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009581","13.4249","0.0014","18.7748","0.0019","20.099","0.002","117.717","0.002","91.271","0.002","91.711","0.002","4478.9","0.8","150","2","150","2","","","","","","","","6","P -1","-P 1","2","Etheidi Chloride Crust","","","- C80 H255 Cl Fe19 N10 O130.5 -","- C80 H134 Cl Fe19 N10 O130.5 -","- C80 H134 Cl Fe19 N10 O130.5 -","1","0.5","","Goodwin, Jeremy C.; Sessoli, Roberta; Gatteschi, Dante; Wernsdorfer, Wolfgang; Powell, Annie K.; Heath, Sarah L.","Towards nanostructured arrays of single molecule magnets: new Fe19 oxyhydroxide clusters displaying high ground state spins and hysteresis †","Journal of the Chemical Society, Dalton Transactions","2000","","12","1835","","10.1039/b002135k","","","0.71073","MoKα","","0.1502","0.0668","","","0.1577","0.186","","","","","","0.881","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7009582","11.309","0.002","13.627","0.003","15.91","0.002","111.977","0.014","104.098","0.011","90.74","0.02","2190.4","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C43 H25 O11 Os3 P3 -","- C43 H25 O11 Os3 P3 -","- C86 H50 O22 Os6 P6 -","2","1","","Ang, How Ghee; Ang, Siau Gek; Wang, Xiao","Formation of new cluster derivatives of triphospholene via ligand substitution and cleavage of P‒P bond(s)","Journal of the Chemical Society, Dalton Transactions","2000","","19","3429","","10.1039/b002140g","","","0.71073","MoKα","","0.0586","0.0359","","0.0879","0.0775","","","","0.991","1.019","1.019","","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009583","12.195","0.002","18.653","0.002","18.832","0.002","90","","90.03","0.011","90","","4283.8","1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C42 H25 O10 Os3 P3 -","- C42 H25 O10 Os3 P3 -","- C168 H100 O40 Os12 P12 -","4","1","","Ang, How Ghee; Ang, Siau Gek; Wang, Xiao","Formation of new cluster derivatives of triphospholene via ligand substitution and cleavage of P‒P bond(s)","Journal of the Chemical Society, Dalton Transactions","2000","","19","3429","","10.1039/b002140g","","","0.71073","MoKα","","0.048","0.0322","","0.0809","0.0727","","","","1.023","1.038","1.038","","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009584","12.9826","0.0012","15.074","0.004","17.282","0.002","108.455","0.009","100.079","0.012","98.27","0.02","3085.9","1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C54 H25 O22 Os6 P3 -","- C54 H25 O22 Os6 P3 -","- C108 H50 O44 Os12 P6 -","2","1","","Ang, How Ghee; Ang, Siau Gek; Wang, Xiao","Formation of new cluster derivatives of triphospholene via ligand substitution and cleavage of P‒P bond(s)","Journal of the Chemical Society, Dalton Transactions","2000","","19","3429","","10.1039/b002140g","","","0.71073","MoKα","","0.0949","0.0625","","0.1846","0.1625","","","","1.031","1.101","1.101","","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009585","17.538","0.002","19.0324","0.0001","13.54","0.002","90","","91.959","0.005","90","","4516.9","0.8","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C43 H27 Cl2 O10 Os3 P3 -","- C43 H27 Cl2 O10 Os3 P3 -","- C172 H108 Cl8 O40 Os12 P12 -","4","1","","Ang, How Ghee; Ang, Siau Gek; Wang, Xiao","Formation of new cluster derivatives of triphospholene via ligand substitution and cleavage of P‒P bond(s)","Journal of the Chemical Society, Dalton Transactions","2000","","19","3429","","10.1039/b002140g","","","0.71073","MoKα","","0.1001","0.0727","","","0.1892","0.2079","","","","","","1.164","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009586","9.5096","0.0001","11.5621","0.0001","20.148","0.0002","82.181","0.001","82.532","0.001","68.51","","2034.39","0.03","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C41 H25 O9 Os3 P3 -","- C41 H25 O9 Os3 P3 -","- C82 H50 O18 Os6 P6 -","2","1","","Ang, How Ghee; Ang, Siau Gek; Wang, Xiao","Formation of new cluster derivatives of triphospholene via ligand substitution and cleavage of P‒P bond(s)","Journal of the Chemical Society, Dalton Transactions","2000","","19","3429","","10.1039/b002140g","","","0.71073","MoKα","","0.0683","0.0551","","0.1418","0.1351","","","","0.989","1.078","1.078","","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009587","13.366","0.003","19.244","0.003","16.43","0.002","90","","102.984","0.01","90","","4118","1.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C41 H25 O9 Os3 P3 -","- C41 H25 O9 Os3 P3 -","- C164 H100 O36 Os12 P12 -","4","1","","Ang, How Ghee; Ang, Siau Gek; Wang, Xiao","Formation of new cluster derivatives of triphospholene via ligand substitution and cleavage of P‒P bond(s)","Journal of the Chemical Society, Dalton Transactions","2000","","19","3429","","10.1039/b002140g","","","0.71073","MoKα","","0.0439","0.0275","","0.0667","0.0576","","","","0.9","0.877","0.877","","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009588","12.698","0.002","12.698","0.002","6.858","0.001","90","","90","","120","","957.6","0.3","293","2","293","2","","","","","","","","4","R 3 :H","R 3","146","","","","- C12 H12 Cr O6 -","- C12 H12 Cr O6 -","- C36 H36 Cr3 O18 -","3","0.333333","","Christofi, A. Maria; Garratt, Peter J.; Hogarth, Graeme; Steed, Jonathan W.","Synthesis and structures of chromium tricarbonyl complexes of benzylic halides and benzylic alcohols †","Journal of the Chemical Society, Dalton Transactions","2000","","13","2137","","10.1039/b002142n","","","0.71073","MoKα","","0.0239","0.0231","","0.0653","0.0586","","","","1.026","1.027","1.027","","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009589","10.0413","0.0003","12.5369","0.0006","10.7044","0.0005","90","","105.026","0.002","90","","1301.47","0.1","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C11 H8 Br2 Cr O3 -","- C11 H8 Br2 Cr O3 -","- C44 H32 Br8 Cr4 O12 -","4","1","","Christofi, A. Maria; Garratt, Peter J.; Hogarth, Graeme; Steed, Jonathan W.","Synthesis and structures of chromium tricarbonyl complexes of benzylic halides and benzylic alcohols †","Journal of the Chemical Society, Dalton Transactions","2000","","13","2137","","10.1039/b002142n","","","0.7107","MoKα","","0.0442","0.0387","","","0.0976","0.1009","","","","","","1.077","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009590","8.727","0.0007","11.9245","0.0011","14.714","0.001","69.767","0.005","82.21","0.006","84.463","0.005","1421.4","0.2","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C15 H18 Cr O5 -","- C15 H18 Cr O5 -","- C60 H72 Cr4 O20 -","4","2","","Christofi, A. Maria; Garratt, Peter J.; Hogarth, Graeme; Steed, Jonathan W.","Synthesis and structures of chromium tricarbonyl complexes of benzylic halides and benzylic alcohols †","Journal of the Chemical Society, Dalton Transactions","2000","","13","2137","","10.1039/b002142n","","","0.71073","MoKα","","0.0571","0.0444","","","0.1129","0.121","","","","","","1.064","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009591","6.772","0.001","8.541","0.002","9.622","0.002","83.31","0.03","88.37","0.03","88.67","0.03","552.41","0.19","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C10 H7 Br Cr O3 -","- C10 H7 Br Cr O3 -","- C20 H14 Br2 Cr2 O6 -","2","1","","Christofi, A. Maria; Garratt, Peter J.; Hogarth, Graeme; Steed, Jonathan W.","Synthesis and structures of chromium tricarbonyl complexes of benzylic halides and benzylic alcohols †","Journal of the Chemical Society, Dalton Transactions","2000","","13","2137","","10.1039/b002142n","","","0.71073","MoKα","","0.0655","0.0464","","0.1487","0.1236","","","","1.023","1.051","1.051","","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009592","12.882","0.003","13.217","0.003","14.087","0.003","90","","112.52","0.03","90","","2215.6","1","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C11 H10 Cr O5 -","- C11 H10 Cr O5 -","- C88 H80 Cr8 O40 -","8","2","","Christofi, A. Maria; Garratt, Peter J.; Hogarth, Graeme; Steed, Jonathan W.","Synthesis and structures of chromium tricarbonyl complexes of benzylic halides and benzylic alcohols †","Journal of the Chemical Society, Dalton Transactions","2000","","13","2137","","10.1039/b002142n","","","0.71073","MoKα","","0.0443","0.0375","","0.1107","0.1014","","","","1.027","1.07","1.07","","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009593","10.9696","0.0002","23.0792","0.0005","23.3276","0.0006","90","","90","","90","","5905.8","0.2","293","2","293","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C20 H40 Cu4 Mo N6 S4 -","- C20 H40 Cu4 Mo N6 S4 -","- C160 H320 Cu32 Mo8 N48 S32 -","8","0.25","","Zhang, Chi; Song, Yinglin; Xu, Yan; Fun, Hoongkun; Fang, Guangyu; Wang, Yuxiao; Xin, Xinquan","Studies on two interesting microporous polymeric clusters {[Et4N]2[MS4Cu4(CN)4]}n (M = Mo or W) with three-dimensional open frameworks: synthesis, structural characterization, strong optical non-linearities and large optical limiting properties","Journal of the Chemical Society, Dalton Transactions","2000","","16","2823","","10.1039/b002164o","","","0.71073","MoKα","","0.0594","0.0435","","","0.1215","0.132","","","","","","1.042","","","","has coordinates,has disorder","179799","2020-10-21","18:00:00",""
"7009594","10.8968","0.0001","23.0553","0.0003","23.287","0.0001","90","","90","","90","","5850.37","0.1","293","2","293","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C20 H40 Cu4 N6 S4 W -","- C20 H40 Cu4 N6 S4 W -","- C160 H320 Cu32 N48 S32 W8 -","8","0.25","","Zhang, Chi; Song, Yinglin; Xu, Yan; Fun, Hoongkun; Fang, Guangyu; Wang, Yuxiao; Xin, Xinquan","Studies on two interesting microporous polymeric clusters {[Et4N]2[MS4Cu4(CN)4]}n (M = Mo or W) with three-dimensional open frameworks: synthesis, structural characterization, strong optical non-linearities and large optical limiting properties","Journal of the Chemical Society, Dalton Transactions","2000","","16","2823","","10.1039/b002164o","","","0.71073","MoKα","","0.039","0.0347","","","0.0896","0.0924","","","","","","1.041","","","","has coordinates,has disorder","179799","2020-10-21","18:00:00",""
"7009595","8.825","0.003","13.928","0.004","14.65","0.004","90","","96.05","0.03","90","","1790.7","0.9","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","[Mn(terpy)(N(CN)2)(NO3)]n","","","- C17 H11 Mn N7 O3 -","- C17 H11 Mn N7 O3 -","- C68 H44 Mn4 N28 O12 -","4","1","","Claramunt, Albert; Escuer, Albert; Mautner, Franz A.; Sanz, Núria; Vicente, Ramon","Two new one-dimensional systems with end-to-end single dicyanamide bridges between manganese(II) centres: structural and magnetic properties","Journal of the Chemical Society, Dalton Transactions","2000","","15","2627","","10.1039/b002214o","","","0.71069","MoKα","","0.0801","0.0553","","0.1712","0.1436","","","","1.06","1.085","1.085","","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009596","7.574","0.002","8.795","0.003","14.948","0.006","78.16","0.03","79.73","0.03","81.8","0.02","953.1","0.6","300","2","300","2","","","","","","","","5","P -1","-P 1","2","[Mn(terpy)(N(CN)2)(H2O)](N(CN)2)","","","- C19 H13 Mn N9 O -","- C19 H13 Mn N9 O -","- C38 H26 Mn2 N18 O2 -","2","1","","Claramunt, Albert; Escuer, Albert; Mautner, Franz A.; Sanz, Núria; Vicente, Ramon","Two new one-dimensional systems with end-to-end single dicyanamide bridges between manganese(II) centres: structural and magnetic properties","Journal of the Chemical Society, Dalton Transactions","2000","","15","2627","","10.1039/b002214o","","","0.71069","MoKα","","0.0508","0.0372","","0.1933","0.0947","","","","1.073","1.079","1.079","","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009597","9.57","0.005","10.896","0.013","28.29","0.03","90","","93.39","0.07","90","","2945","5","203","2","203","2","","","","","","","","10","P 1 21/n 1","-P 2yn","14","","","","- C24 H27 Au Br0 Cl3 F6 N O P2 S -","- C24 H27 Au Cl3 F6 N O P2 S -","- C96 H108 Au4 Cl12 F24 N4 O4 P8 S4 -","4","1","","Parish, R. V.; Boyer, Patricia; Fowler, Anne; Kahn, Tasneem A.; Cross, Wendy I.; Pritchard, Robin G.","Gold complexes derived from diphenyl-2-styrylphosphine †","Journal of the Chemical Society, Dalton Transactions","2000","","14","2287","","10.1039/b002248i","","","0.71073","MoKα","","0.1734","0.0825","","","0.176","0.2199","","","","","","1.027","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009598","9.2143","0.0002","13.2282","0.0002","7.3919","0.0001","90","","97.1056","0.001","90","","894.07","0.03","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H20 Cd N4 O8 -","- C14 H20 Cd N4 O8 -","- C28 H40 Cd2 N8 O16 -","2","0.5","","Plater, M. John; Foreman, Mark R. St. J.; Gelbrich, Thomas; Coles, Simon J.; Hursthouse, Michael B.","Synthesis and characterisation of infinite co-ordination networks from flexible dipyridyl ligands and cadmium salts †","Journal of the Chemical Society, Dalton Transactions","2000","","18","3065","","10.1039/b002251i","","","0.71073","MoKα","","0.0301","0.0255","","","0.0711","0.0734","","","","","","1.03","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009599","11.012","0.001","15.042","0.001","18.065","0.001","79.95","0.01","80.23","0.01","72.85","0.01","2793.1","0.4","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C52 H58 Cd2 N12 O13 -","- C52 H58 Cd2 N12 O13 -","- C104 H116 Cd4 N24 O26 -","2","1","","Plater, M. John; Foreman, Mark R. St. J.; Gelbrich, Thomas; Coles, Simon J.; Hursthouse, Michael B.","Synthesis and characterisation of infinite co-ordination networks from flexible dipyridyl ligands and cadmium salts †","Journal of the Chemical Society, Dalton Transactions","2000","","18","3065","","10.1039/b002251i","","","0.71073","MoKα","","0.0623","0.0432","","","0.1083","0.118","","","","","","0.92","","","","has coordinates","179799","2020-10-21","18:00:00",""
"7009600","13.8375","0.0007","15.7403","0.0008","22.0228","0.0008","90","","98.841","0.001","90","","4739.7","0.4","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C39 H56.4 Cd2 N6 O15.2 S2 -","- C39 H51.41 Cd2 N6 O15.215 S2 -","- C156 H205.64 Cd8 N24 O60.86 S8 -","4","1","","Plater, M. John; Foreman, Mark R. St. J.; Gelbrich, Thomas; Coles, Simon J.; Hursthouse, Michael B.","Synthesis and characterisation of infinite co-ordination networks from flexible dipyridyl ligands and cadmium salts †","Journal of the Chemical Society, Dalton Transactions","2000","","18","3065","","10.1039/b002251i","","","0.71073","MoKα","","0.1288","0.0657","","","0.1183","0.131","","","","","","1.03","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7009601","7.3876","0.0002","16.7331","0.0004","9.61","0.0002","90","","109.761","0.0005","90","","1118.01","0.05","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H20 Cd N6 O6 -","- C22 H20 Cd N6 O6 -","- C44 H40 Cd2 N12 O12 -","2","0.5","","Plater, M. John; Foreman, Mark R. St. J.; Gelbrich, Thomas; Coles, Simon J.; Hursthouse, Michael B.","Synthesis and characterisation of infinite co-ordination networks from flexible dipyridyl ligands and cadmium salts †","Journal of the Chemical Society, Dalton Transactions","2000","","18","3065","","10.1039/b002251i","","","0.71073","MoKα","","0.0226","0.0201","","","0.0508","0.0518","","","","","","1.058","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009602","16.4766","0.0004","16.659","0.0003","20.4339","0.0004","90.2979","0.0012","108.124","0.001","106.547","0.001","5082.61","0.19","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C45 H56 Cd2 N10 O13 -","- C45 H55.4885 Cd2 N10 O13 -","- C180 H221.954 Cd8 N40 O52 -","4","2","","Plater, M. John; Foreman, Mark R. St. J.; Gelbrich, Thomas; Coles, Simon J.; Hursthouse, Michael B.","Synthesis and characterisation of infinite co-ordination networks from flexible dipyridyl ligands and cadmium salts †","Journal of the Chemical Society, Dalton Transactions","2000","","18","3065","","10.1039/b002251i","","","0.71073","MoKα","","0.0995","0.0545","","","0.126","0.1409","","","","","","1.029","","","","has coordinates,has disorder","179800","2020-10-21","18:00:00",""
"7009603","19.347","0.001","19.347","0.001","17.7404","0.0007","90","","90","","90","","6640.3","0.6","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C32 H40 Cd N6 O6 -","- C32 H40 Cd N6 O6 -","- C256 H320 Cd8 N48 O48 -","8","0.5","","Plater, M. John; Foreman, Mark R. St. J.; Gelbrich, Thomas; Coles, Simon J.; Hursthouse, Michael B.","Synthesis and characterisation of infinite co-ordination networks from flexible dipyridyl ligands and cadmium salts †","Journal of the Chemical Society, Dalton Transactions","2000","","18","3065","","10.1039/b002251i","","","0.71073","MoKα","","0.1707","0.0543","","","0.1197","0.1399","","","","","","0.969","","","","has coordinates,has disorder","179800","2020-10-21","18:00:00",""
"7009604","7.7676","0.0009","7.8401","0.0009","15.873","0.002","81.828","0.009","89.14","0.01","61.146","0.009","836.44","0.19","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2-forylimidazole thiosemicarbazone","","- C5 H8 N5 O0.5 S -","- C5 H8 N5 O0.5 S -","- C20 H32 N20 O2 S4 -","4","2","","Casas, José S.; Castiñeiras, Alfonso; Rodríguez-Argüelles, María C.; Sánchez, Agustín; Sordo, José; Vázquez-López, Antonia; Vázquez-López, Ezequiel M.","Diorganotin(IV) complexes of imidazole-2-carbaldehyde thiosemicarbazone (H2ImTSC). The crystal and molecular structures of the “free” ligand and of [SnMe2(ImTSC)]","Journal of the Chemical Society, Dalton Transactions","2000","","14","2267","","10.1039/b002286l","","","1.54184","CuKα","","0.0512","0.0498","","","0.1365","0.1378","","","","","","1.114","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009605","22.92","0.008","6.3651","0.0007","10.488","0.004","90","","101.655","0.016","90","","1498.5","0.8","293","2","293","2","","","","","","","","6","C 1 2 1","C 2y","5","","(2-forylimidazole thiosemicarbazonato)dimethyltin(IV) ethanol solvate","","- C9 H17 N5 O S Sn -","- C9 H17 N5 O S Sn -","- C36 H68 N20 O4 S4 Sn4 -","4","1","","Casas, José S.; Castiñeiras, Alfonso; Rodríguez-Argüelles, María C.; Sánchez, Agustín; Sordo, José; Vázquez-López, Antonia; Vázquez-López, Ezequiel M.","Diorganotin(IV) complexes of imidazole-2-carbaldehyde thiosemicarbazone (H2ImTSC). The crystal and molecular structures of the “free” ligand and of [SnMe2(ImTSC)]","Journal of the Chemical Society, Dalton Transactions","2000","","14","2267","","10.1039/b002286l","","","0.71073","MoKα","","0.0422","0.0395","","","0.104","0.1064","","","","","","1.156","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009606","11.963","0.003","12.022","0.002","9.509","0.002","91.3","0.02","109.78","0.02","118.64","0.02","1100.8","0.5","150.2","","150.2","","","","","","","","","5","P -1","-P 1","2","","","","- C12 H24 Bi Br3 Se4 -","- C12 H24 Bi Br3 Se4 -","- C24 H48 Bi2 Br6 Se8 -","2","1","","Barton, Andrew J.; Genge, Anthony R. J.; Levason, William; Reid, Gillian","Synthesis and structures of one-dimensional co-ordination polymers derived from bismuth(III) selenoether macrocyclic complexes","Journal of the Chemical Society, Dalton Transactions","2000","","13","2163","","10.1039/b002287j","","","0.71073","MoKalpha","","","0.0445","","","0.0559","","","","","2.034","2.034","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009607","9.362","0.006","12.142","0.009","11.356","0.003","90","","99.67","0.03","90","","1272.5","1.3","150","","150","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C12 H24 Bi2 Cl6 Se4 -","- C12 H24 Bi2 Cl6 Se4 -","- C24 H48 Bi4 Cl12 Se8 -","2","1","","Barton, Andrew J.; Genge, Anthony R. J.; Levason, William; Reid, Gillian","Synthesis and structures of one-dimensional co-ordination polymers derived from bismuth(III) selenoether macrocyclic complexes","Journal of the Chemical Society, Dalton Transactions","2000","","13","2163","","10.1039/b002287j","","","0.71073","MoKalpha","","","0.0432","","","0.0551","","","","","1.855","1.855","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009608","7.911","0.003","15.422","0.005","15.161","0.005","90","","95.58","0.03","90","","1840.9","1.1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C17 H21 Cl2 Cu N5 -","- C8.5 H10.5 Cl Cu0.5 N2.5 -","- C68 H84 Cl8 Cu4 N20 -","8","1","","Manikandan, Palanichamy; Justin Thomas, K. R.; Manoharan, Periakaruppan T.","Structural and spectral diversities in copper(II) complexes of 2,6-bis(3,5-dimethylpyrazol-1-ylmethyl)pyridine ‡","Journal of the Chemical Society, Dalton Transactions","2000","","16","2779","","10.1039/b002289f","","","0.71073","MoKα","","0.0445","0.0376","","0.1113","0.1041","","","","1.08","1.082","1.082","","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009609","7.8585","0.0011","15.843","0.008","15.4787","0.0013","90","","97.401","0.009","90","","1911.1","1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C17 H21 Br2 Cu N5 -","- C8.5 H10.5 Br Cu0.5 N2.5 -","- C68 H84 Br8 Cu4 N20 -","8","1","","Manikandan, Palanichamy; Justin Thomas, K. R.; Manoharan, Periakaruppan T.","Structural and spectral diversities in copper(II) complexes of 2,6-bis(3,5-dimethylpyrazol-1-ylmethyl)pyridine ‡","Journal of the Chemical Society, Dalton Transactions","2000","","16","2779","","10.1039/b002289f","","","0.71073","MoKα","","0.0417","0.0304","","0.0873","0.0768","","","","1.158","1.115","1.115","","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009610","11.119","0.007","10.541","0.003","17.65","0.004","90","","91.74","0.03","90","","2067.7","1.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H21 Cu N7 O6 -","- C17 H21 Cu N7 O6 -","- C68 H84 Cu4 N28 O24 -","4","1","","Manikandan, Palanichamy; Justin Thomas, K. R.; Manoharan, Periakaruppan T.","Structural and spectral diversities in copper(II) complexes of 2,6-bis(3,5-dimethylpyrazol-1-ylmethyl)pyridine ‡","Journal of the Chemical Society, Dalton Transactions","2000","","16","2779","","10.1039/b002289f","","","0.71073","MoKα","","0.0859","0.0514","","0.1546","0.1226","","","","1.11","1.073","1.073","","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009611","9.339","0.003","12.966","0.005","17.725","0.005","69.56","0.002","80.73","0.002","81.07","0.002","1973.5","1.1","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C36 H40 Au Mn N O12 P Ru3 -","- C36 H20 Au Mn N O12 P Ru3 -","- C72 H40 Au2 Mn2 N2 O24 P2 Ru6 -","2","1","","Braunstein, Pierre; Oswald, Benoît; Tiripicchio, Antonio; Ugozzoli, Franco","Carbonylcyanometalates as building blocks: heterometallic complexes containing Mn(μ-CN)M (M = Cu, Au, Ni, Pd or Pt), Mn(μ-CN)Pd(μ-dppm)2Mn and Mn(μ-CN)M(μ-dppm)2Pd(μ-NC)Mn (M = Pt or Pd) chains of atoms and crystal structure of the mixed-metal cluster [Ru3{(μ3-NC)MnCp(CO)2}(μ-AuPPh3)(CO)10] †","Journal of the Chemical Society, Dalton Transactions","2000","","13","2195","","10.1039/b002292f","","","0.7107","MoKα","","0.0278","0.0277","","","0.0625","0.0626","","","","","","0.715","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009612","15.746","0.008","8.634","0.004","15.837","0.007","90","","106.42","0.04","90","","2065.2","1.7","173.2","","173.2","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H16 N2 O8 Ru2 -","- C18 H16 N2 O8 Ru2 -","- C72 H64 N8 O32 Ru8 -","4","0.5","","Kepert, Christopher M.; Deacon, Glen B.; Spiccia, Leone; Fallon, Gary D.; Skelton, Brian W.; White, Allan H.","A facile and benign synthesis of binuclear ruthenium(I) “sawhorse” complexes","Journal of the Chemical Society, Dalton Transactions","2000","","16","2867","","10.1039/b002304n","","","0.7107","MoKα","","","0.0269","","","","0.0345","","","","","","3.437","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009613","28.095","0.001","10.3742","0.0004","19.3657","0.0007","90","","102.774","0.001","90","","5504.7","0.4","123","","123","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H20 N2 O8 Ru2 -","- C28 H20 N2 O8 Ru2 -","- C224 H160 N16 O64 Ru16 -","8","1","","Kepert, Christopher M.; Deacon, Glen B.; Spiccia, Leone; Fallon, Gary D.; Skelton, Brian W.; White, Allan H.","A facile and benign synthesis of binuclear ruthenium(I) “sawhorse” complexes","Journal of the Chemical Society, Dalton Transactions","2000","","16","2867","","10.1039/b002304n","","","0.7107","MoKα","","","0.0346","","","","0.0265","","","","","","1.247","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009614","11.063","0.007","15.445","0.005","15.11","0.004","90","","111.57","0.04","90","","2401","1.9","293","","293","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C20 H20 N2 O8 Ru2 -","- C20 H20 N2 O8 Ru2 -","- C80 H80 N8 O32 Ru8 -","4","2","","Kepert, Christopher M.; Deacon, Glen B.; Spiccia, Leone; Fallon, Gary D.; Skelton, Brian W.; White, Allan H.","A facile and benign synthesis of binuclear ruthenium(I) “sawhorse” complexes","Journal of the Chemical Society, Dalton Transactions","2000","","16","2867","","10.1039/b002304n","","","0.71073","Mo-Kα","","0.063","0.051","","0.068","","0.058","","","1.299","","","1.19","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009615","12.246","0.003","13.808","0.002","16.542","0.004","90","","95.9","0.02","90","","2782.3","1","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H28 N2 O8 Ru2 -","- C24 H28 N2 O8 Ru2 -","- C96 H112 N8 O32 Ru8 -","4","1","","Kepert, Christopher M.; Deacon, Glen B.; Spiccia, Leone; Fallon, Gary D.; Skelton, Brian W.; White, Allan H.","A facile and benign synthesis of binuclear ruthenium(I) “sawhorse” complexes","Journal of the Chemical Society, Dalton Transactions","2000","","16","2867","","10.1039/b002304n","","","0.71073","Mo-Kα","","0.041","0.041","","0.067","","0.067","","","1.32","","","1.32","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009616","10.89","0.003","15.706","0.002","14.39","0.004","90","","108.78","0.02","90","","2330.2","1","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H20 N2 O8 Ru2 -","- C20 H20 N2 O8 Ru2 -","- C80 H80 N8 O32 Ru8 -","4","1","","Kepert, Christopher M.; Deacon, Glen B.; Spiccia, Leone; Fallon, Gary D.; Skelton, Brian W.; White, Allan H.","A facile and benign synthesis of binuclear ruthenium(I) “sawhorse” complexes","Journal of the Chemical Society, Dalton Transactions","2000","","16","2867","","10.1039/b002304n","","","0.71073","Mo-Kα","","","0.043","","","0.061","0.072","","","1.46","","","1.555","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009617","13.519","0.003","14.205","0.007","15.858","0.003","90","","101.188","0.017","90","","2987.5","1.7","150","2","150","2","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C22 H30 Cl2 F8 N2 Ni2 P2 -","- C22 H30 Cl2 F8 N2 Ni2 P2 -","- C88 H120 Cl8 F32 N8 Ni8 P8 -","4","1","","Archibald, Stephen J.; Braun, Thomas; Gaunt, Joseph A.; Hobson, James E.; Perutz, Robin N.","Chemistry of nickel tetrafluoropyridyl derivatives: their versatile behaviour with Brønsted acids and the Lewis acid BF3 †","Journal of the Chemical Society, Dalton Transactions","2000","","13","2013","","10.1039/b002333g","","","0.71069","MoKα","","0.0963","0.0379","","","0.0915","0.1145","","","","","","0.999","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009618","10.082","0.002","20.406","0.004","18.756","0.004","90","","103.87","0.03","90","","3746.2","1.4","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C46 H37 O6 Sb -","- C46 H37 O6 Sb -","- C184 H148 O24 Sb4 -","4","1","","Barucki, Hubert; Coles, Simon J.; Costello, James F.; Gelbrich, Thomas; Hursthouse, Michael B.","Characterising secondary bonding interactions within triaryl organoantimony(V) and organobismuth(V) complexes","Journal of the Chemical Society, Dalton Transactions","2000","","14","2319","","10.1039/b002337j","","","0.71073","MoKα","","0.0474","0.0348","","","0.0959","0.1072","","","","","","0.796","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7009619","10.7855","0.0001","17.7361","0.0002","18.7408","0.0002","113.479","0.0007","104.572","0.0008","93.1164","0.0008","3133.75","0.06","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C33 H26 Cl3 O6 Sb -","- C33 H26 Cl3 O6 Sb -","- C132 H104 Cl12 O24 Sb4 -","4","2","","Barucki, Hubert; Coles, Simon J.; Costello, James F.; Gelbrich, Thomas; Hursthouse, Michael B.","Characterising secondary bonding interactions within triaryl organoantimony(V) and organobismuth(V) complexes","Journal of the Chemical Society, Dalton Transactions","2000","","14","2319","","10.1039/b002337j","","","0.71073","MoKα","","0.056","0.0466","","","0.1281","0.1335","","","","","","1.067","","","","has coordinates,has disorder","179800","2020-10-21","18:00:00",""
"7009620","10.102","0.002","20.609","0.004","18.706","0.004","90","","103.59","0.03","90","","3785.4","1.4","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C46 H37 Bi O6 -","- C46 H37 Bi O6 -","- C184 H148 Bi4 O24 -","4","1","","Barucki, Hubert; Coles, Simon J.; Costello, James F.; Gelbrich, Thomas; Hursthouse, Michael B.","Characterising secondary bonding interactions within triaryl organoantimony(V) and organobismuth(V) complexes","Journal of the Chemical Society, Dalton Transactions","2000","","14","2319","","10.1039/b002337j","","","0.71073","MoKα","","0.0319","0.0267","","","0.0794","0.0878","","","","","","0.751","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009621","10.189","0.005","21.686","0.005","22.163","0.009","86.25","0.03","80.98","0.04","76.52","0.03","4701","3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","[Li(thf)2(Me3SiNCPhCHPhNSiMe3)]","","","- C29 H45 Li N2 O2 Si2 -","- C29 H45 Li N2 O2 Si2 -","- C174 H270 Li6 N12 O12 Si12 -","6","3","","Hitchcock, Peter B.; Lappert, Michael F.; Layh, Marcus; Liu, Dian-Sheng; Sablong, Rafael; Shun, Tian","Reactions of LiCHR2 and related lithium alkyls with α-H free nitriles and the crystal structures of eleven representative lithium 1,3-diazaallyls, 1-azaallyls and β-diketiminates","Journal of the Chemical Society, Dalton Transactions","2000","","14","2301","","10.1039/b002376k","","","0.71073","MoKα","","0.1398","0.1018","","0.2984","0.2754","","","","1.121","1.267","1.267","","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009622","9.781","0.001","10.239","0.003","10.416","0.002","92.49","0.02","96.37","0.01","97.52","0.02","1026","0.4","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H64 Li2 N2 O2 Si4 -","- C36 H64 Li2 N2 O2 Si4 -","- C36 H64 Li2 N2 O2 Si4 -","1","0.5","","Hitchcock, Peter B.; Lappert, Michael F.; Layh, Marcus; Liu, Dian-Sheng; Sablong, Rafael; Shun, Tian","Reactions of LiCHR2 and related lithium alkyls with α-H free nitriles and the crystal structures of eleven representative lithium 1,3-diazaallyls, 1-azaallyls and β-diketiminates","Journal of the Chemical Society, Dalton Transactions","2000","","14","2301","","10.1039/b002376k","","","0.71073","MoKα","","0.0643","0.0437","","0.1144","0.1029","","","","1.02","1.051","1.051","","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009623","10.0529","0.0003","31.5904","0.001","8.2296","0.0002","90","","111.457","0.003","90","","2432.38","0.13","173","2","173","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","[Li(tmeda)(Me3SiNCPhCHPh)]","","","- C23 H36 Li N3 Si -","- C23 H36 Li N3 Si -","- C92 H144 Li4 N12 Si4 -","4","1","","Hitchcock, Peter B.; Lappert, Michael F.; Layh, Marcus; Liu, Dian-Sheng; Sablong, Rafael; Shun, Tian","Reactions of LiCHR2 and related lithium alkyls with α-H free nitriles and the crystal structures of eleven representative lithium 1,3-diazaallyls, 1-azaallyls and β-diketiminates","Journal of the Chemical Society, Dalton Transactions","2000","","14","2301","","10.1039/b002376k","","x-ray","0.71073","MoKα","","0.0997","0.0573","","","0.1346","0.1532","","","","","","1.021","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009624","13.688","0.004","20.777","0.008","14.787","0.002","90","","117.527","0.017","90","","3729","2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H59 Li N4 Si2 -","- C34 H59 Li N4 Si2 -","- C136 H236 Li4 N16 Si8 -","4","1","","Hitchcock, Peter B.; Lappert, Michael F.; Layh, Marcus; Liu, Dian-Sheng; Sablong, Rafael; Shun, Tian","Reactions of LiCHR2 and related lithium alkyls with α-H free nitriles and the crystal structures of eleven representative lithium 1,3-diazaallyls, 1-azaallyls and β-diketiminates","Journal of the Chemical Society, Dalton Transactions","2000","","14","2301","","10.1039/b002376k","","","0.71073","MoKα","","0.1779","0.0832","","","0.1724","0.2188","","","","","","0.993","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009625","11.075","","11.44","0.005","11.514","0.006","94.22","0.07","93.81","0.07","110.94","0.08","1352","1.2","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C50 H74 Li2 N4 O2 Si4 -","- C50 H74 Li2 N4 O2 Si4 -","- C50 H74 Li2 N4 O2 Si4 -","1","0.5","","Hitchcock, Peter B.; Lappert, Michael F.; Layh, Marcus; Liu, Dian-Sheng; Sablong, Rafael; Shun, Tian","Reactions of LiCHR2 and related lithium alkyls with α-H free nitriles and the crystal structures of eleven representative lithium 1,3-diazaallyls, 1-azaallyls and β-diketiminates","Journal of the Chemical Society, Dalton Transactions","2000","","14","2301","","10.1039/b002376k","","","0.71073","MoKα","","0.1281","0.0793","","0.2341","0.1946","","","","0.991","1.048","1.048","","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009626","9.542","0.001","15.538","0.004","22.717","0.003","90","","92.21","0.01","90","","3365.6","1","293.2","","293.2","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C30 H31 F3 N2 O5 P2 Pd S -","- C30 H31 F3 N2 O5 P2 Pd S -","- C120 H124 F12 N8 O20 P8 Pd4 S4 -","4","1","","Braunstein, Pierre; Frison, Céline; Morise, Xavier; Adams, Richard D.","Coordination properties of novel hemilabile acetamide-derived P,O phosphine ligands. Crystal structures of Ph2PNHC(O)Me and [PdMe{PPh2NHC(O)Me}{PPh2NHC(O)Me}][O3SCF3] †","Journal of the Chemical Society, Dalton Transactions","2000","","13","2205","","10.1039/b002386h","","","0.7107","MoKα","","0.0428","0.0428","","0.0511","","0.0511","","","1.327","","","1.327","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009627","8.094","0.001","9.5744","0.0005","17.02","0.001","90","","97.513","0.007","90","","1307.65","0.19","294","","294","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H14 N O P -","- C14 H14 N O P -","- C56 H56 N4 O4 P4 -","4","1","","Braunstein, Pierre; Frison, Céline; Morise, Xavier; Adams, Richard D.","Coordination properties of novel hemilabile acetamide-derived P,O phosphine ligands. Crystal structures of Ph2PNHC(O)Me and [PdMe{PPh2NHC(O)Me}{PPh2NHC(O)Me}][O3SCF3] †","Journal of the Chemical Society, Dalton Transactions","2000","","13","2205","","10.1039/b002386h","","","0.71073","Mo-Kα","","0.088","0.042","","0.076","0.063","","","","1.424","1.232","1.232","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009628","9.3325","0.0013","13.96","0.002","17.864","0.003","90","","103.771","0.013","90","","2260.5","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 H8 O9 Os3 -","- C22 H8 O9 Os3 -","- C88 H32 O36 Os12 -","4","1","","Aime, Silvio; Arce, Alejandro J.; Giusti, Daniela; Gobetto, Roberto; Steed, Jonathan W.","A novel non-facial mode of azulene cluster co-ordination. Crystal and molecular structure of the dicarbenoid Os3(μ-H)2(CO)9(μ3-η1∶η1∶η1-C10H6)","Journal of the Chemical Society, Dalton Transactions","2000","","13","2215","","10.1039/b002399j","","","0.71073","MoKα","","0.076","0.0433","","","0.0788","0.0887","","","","","","1.035","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009629","11.1707","0.0006","11.811","0.0006","12.2717","0.0008","88.024","0.003","80.438","0.002","79.718","0.003","1570.94","0.16","110","2","110","2","","","","","","","","7","P -1","-P 1","2","","","","- C32 H29 Cl5 Mo N O P -","- C32 H29 Cl5 Mo N O P -","- C64 H58 Cl10 Mo2 N2 O2 P2 -","2","1","","Camus, Jean-Michel; Morales, Dolores; Andrieu, Jacques; Richard, Philippe; Poli, Rinaldo; Braunstein, Pierre; Naud, Frédéric","Half-sandwich complexes of molybdenum-(III), -(IV) and -(V) with P‒O and P‒N bifunctional ligands Ph2PCH2X (X = 2-oxazolinyl, or C(O)NPh2)","Journal of the Chemical Society, Dalton Transactions","2000","","15","2577","","10.1039/b002403l","","","0.71073","MoKα","","0.0386","0.0304","","0.0688","0.0649","","","","1.054","","","1.071","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009630","12.354","0.001","14.895","0.001","19.937","0.001","90","","106.961","0.002","90","","3509.1","0.4","110","2","110","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C36 H37 B Cl3 F4 Mo N O P -","- C36 H37 B Cl3 F4 Mo N O P -","- C144 H148 B4 Cl12 F16 Mo4 N4 O4 P4 -","4","1","","Camus, Jean-Michel; Morales, Dolores; Andrieu, Jacques; Richard, Philippe; Poli, Rinaldo; Braunstein, Pierre; Naud, Frédéric","Half-sandwich complexes of molybdenum-(III), -(IV) and -(V) with P‒O and P‒N bifunctional ligands Ph2PCH2X (X = 2-oxazolinyl, or C(O)NPh2)","Journal of the Chemical Society, Dalton Transactions","2000","","15","2577","","10.1039/b002403l","","","0.71073","MoKα","","0.096","0.0638","","0.1537","0.1368","","","","1.044","","","1.09","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009631","8.55","0.003","24.014","0.01","16.669","0.006","90","","90.34","0.03","90","","3422","2","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H6 O17 Ru5 W -","- C26 H6 O17 Ru5 W -","- C104 H24 O68 Ru20 W4 -","4","1","","Bruce, Michael I.; Low, Paul J.; Zaitseva, Natasha N.; Kahlal, Samia; Halet, Jean-François; Skelton, Brian W.; White, Allan H.","Syntheses and reactions of some cluster complexes containing C4 ligands with iron, ruthenium and cobalt carbonyls","Journal of the Chemical Society, Dalton Transactions","2000","","17","2939","","10.1039/b002406f","","","0.71073","MoKα","","0.06","0.034","","0.039","","0.034","","","1.22","","","1.332","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009632","16.066","0.013","15.25","0.011","18.27","0.02","90","","95.15","0.08","90","","4458","7","293","","293","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C44 H28 O10 P2 Ru3 W -","- C44 H28 O10 P2 Ru3 W -","- C176 H112 O40 P8 Ru12 W4 -","4","1","","Bruce, Michael I.; Low, Paul J.; Zaitseva, Natasha N.; Kahlal, Samia; Halet, Jean-François; Skelton, Brian W.; White, Allan H.","Syntheses and reactions of some cluster complexes containing C4 ligands with iron, ruthenium and cobalt carbonyls","Journal of the Chemical Society, Dalton Transactions","2000","","17","2939","","10.1039/b002406f","","","0.71073","MoKα","","0.064","0.046","","0.052","","0.049","","","1.856","","","2.048","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009633","12.894","0.009","11.513","0.01","10.121","0.003","101.31","0.05","108.93","0.04","104.19","0.06","1314.1","1.7","293","","293","","","","","","","","","5","P -1","-P 1","2","","","","- C21 H6 O12 Ru3 W -","- C21 H5 O12 Ru3 W -","- C42 H10 O24 Ru6 W2 -","2","1","","Bruce, Michael I.; Low, Paul J.; Zaitseva, Natasha N.; Kahlal, Samia; Halet, Jean-François; Skelton, Brian W.; White, Allan H.","Syntheses and reactions of some cluster complexes containing C4 ligands with iron, ruthenium and cobalt carbonyls","Journal of the Chemical Society, Dalton Transactions","2000","","17","2939","","10.1039/b002406f","","","0.71073","MoKα","","0.062","0.056","","0.077","","0.076","","","2.1","","","2.13","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009634","8.502","0.002","23.997","0.003","16.551","0.003","90","","90.778","0.002","90","","3376.5","1.1","293","","293","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H6 Fe O17 Ru4 W -","- C27 H6 Fe0.981 O17 Ru4.019 W -","- C108 H24 Fe3.924 O68 Ru16.076 W4 -","4","1","","Bruce, Michael I.; Low, Paul J.; Zaitseva, Natasha N.; Kahlal, Samia; Halet, Jean-François; Skelton, Brian W.; White, Allan H.","Syntheses and reactions of some cluster complexes containing C4 ligands with iron, ruthenium and cobalt carbonyls","Journal of the Chemical Society, Dalton Transactions","2000","","17","2939","","10.1039/b002406f","","","0.71073","MoKα","","0.037","0.025","","0.034","","0.031","","","0.983","","","1.007","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009635","8.499","0.002","23.949","0.011","16.537","0.008","90","","90.76","0.03","90","","3366","2","293","","293","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H6 Fe O17 Ru4 W -","- C26 H5 Fe0.968 O17 Ru4.032 W -","- C104 H20 Fe3.872 O68 Ru16.128 W4 -","4","1","","Bruce, Michael I.; Low, Paul J.; Zaitseva, Natasha N.; Kahlal, Samia; Halet, Jean-François; Skelton, Brian W.; White, Allan H.","Syntheses and reactions of some cluster complexes containing C4 ligands with iron, ruthenium and cobalt carbonyls","Journal of the Chemical Society, Dalton Transactions","2000","","17","2939","","10.1039/b002406f","","","0.71073","MoKα","","0.062","0.043","","0.052","","0.047","","","1.473","","","1.611","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009636","21.83","0.011","9.293","0.004","8.991","0.005","111.73","0.04","98.27","0.04","97.96","0.04","1639.9","1.6","293","","293","","","","","","","","","6","P -1","-P 1","2","","","","- C26 H6 Co2 O17 Ru3 W -","- C26 H6 Co2 O17 Ru3 W -","- C52 H12 Co4 O34 Ru6 W2 -","2","1","","Bruce, Michael I.; Low, Paul J.; Zaitseva, Natasha N.; Kahlal, Samia; Halet, Jean-François; Skelton, Brian W.; White, Allan H.","Syntheses and reactions of some cluster complexes containing C4 ligands with iron, ruthenium and cobalt carbonyls","Journal of the Chemical Society, Dalton Transactions","2000","","17","2939","","10.1039/b002406f","","","0.71073","MoKα","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009637","8.442","0.002","23.94","0.005","16.422","0.003","90","","90.941","0.005","90","","3318.5","1.2","153","","153","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H6 Fe2 O17 Ru3 W -","- C26 H6 Fe1.999 O17 Ru3.001 W -","- C104 H24 Fe7.996 O68 Ru12.004 W4 -","4","1","","Bruce, Michael I.; Low, Paul J.; Zaitseva, Natasha N.; Kahlal, Samia; Halet, Jean-François; Skelton, Brian W.; White, Allan H.","Syntheses and reactions of some cluster complexes containing C4 ligands with iron, ruthenium and cobalt carbonyls","Journal of the Chemical Society, Dalton Transactions","2000","","17","2939","","10.1039/b002406f","","","0.71073","MoKα","","0.075","0.039","","0.047","","0.042","","","1.044","","","1.177","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009638","8.464","0.001","23.85","0.003","16.454","0.002","90","","90.798","0.002","90","","3321.2","0.7","293","","293","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H6 Fe2 O17 Ru3 W -","- C26 H6 Fe2.082 O17 Ru2.918 W -","- C104 H24 Fe8.328 O68 Ru11.672 W4 -","4","1","","Bruce, Michael I.; Low, Paul J.; Zaitseva, Natasha N.; Kahlal, Samia; Halet, Jean-François; Skelton, Brian W.; White, Allan H.","Syntheses and reactions of some cluster complexes containing C4 ligands with iron, ruthenium and cobalt carbonyls","Journal of the Chemical Society, Dalton Transactions","2000","","17","2939","","10.1039/b002406f","","","0.71073","MoKα","","0.057","0.036","","0.043","","0.04","","","1.153","","","1.249","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009639","15.758","0.001","15.758","0.001","40.459","0.004","90","","90","","120","","8700.6","1.2","293","2","293","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C51 H42 Ag3 F9 N14 O9 S3 -","- C51 H42 Ag3 F9 N14 O9 S3 -","- C306 H252 Ag18 F54 N84 O54 S18 -","6","0.333333","","Su, Cheng-Yong; Kang, Bei-Sheng; Wang, Qi-Guang; Mak, Thomas C. W.","A novel (CF3SO3−)6 cluster with multiple F · · · F interactions: crystal structure of a self-assembled trinuclear Ag(I) complex with the tripodal ligand tris(2-benzimidazolylmethyl)amine","Journal of the Chemical Society, Dalton Transactions","2000","","12","1831","","10.1039/b002411m","","","0.71073","MoKα","","0.0564","0.0509","","","0.1523","0.1568","","","","","","1.138","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009640","12.232","0.0002","18.5402","0.0003","24.4688","0.0002","90","","90","","90","","5549.13","0.14","293","2","293","2","","","","","","","-","8","P b c a","-P 2ac 2ab","61","","","","- C25 H21 Cl N2 O P2 Pd S2 -","- C25 H21 Cl N2 O P2 Pd S2 -","- C200 H168 Cl8 N16 O8 P16 Pd8 S16 -","8","1","","Bhattacharyya, Pravat; Slawin, Alexandra M. Z.; Woollins, J. Derek","Remarkable S,N,S ' tridentate chelation to palladium(II) by the monoanion derived from [Ph2P(S)NH]2CO","Journal of the Chemical Society, Dalton Transactions","2000","","10","1545","","10.1039/b002413i","","","0.71073","MoKα","","0.0967","0.0504","","0.1304","0.1015","","","","1.07","1.131","1.131","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"7009641","14.429","0.003","29.433","0.006","17.389","0.003","90","","108.4","0.03","90","","7007","3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C41 H29 Cr N O4 P2 -","- C41 H29 Cr N O4 P2 -","- C328 H232 Cr8 N8 O32 P16 -","8","2","","Ainscough, Eric W.; Brodie, Andrew M.; Buckley, Paul D.; Burrell, Anthony K.; Kennedy, Steven M. F.; Waters, Joyce M.","Synthesis, structure and kinetics of Group 6 metal carbonyl complexes containing a new 'P2N' mixed donor multidentate ligand †","Journal of the Chemical Society, Dalton Transactions","2000","","16","2663","","10.1039/b002427i","","","0.71073","MoKα","","0.1028","0.0363","","","0.103","0.1329","","","","","","1.019","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009642","12.285","0.003","16.375","0.003","12.407","0.003","90","","91.45","0.03","90","","2495.1","1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C15 H35 N6 O11 S Zn -","- C15 H21 N6 O11 S Zn -","- C60 H84 N24 O44 S4 Zn4 -","4","1","","Ma, Jian-Fang; Liu, Jing-Fu; Xing, Yan; Jia, Heng-Qing; Lin, Yong-Hua","Networks with hexagonal circuits in co-ordination polymers of metal ions (ZnII, CdII) with 1,1'-(1,4-butanediyl)bis(imidazole)","Journal of the Chemical Society, Dalton Transactions","2000","","14","2403","","10.1039/b002433n","","","0.71073","MoKα","","0.0844","0.0513","","0.1373","","0.1282","","","0.905","","","1.101","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009643","8.335","0.002","11.173","0.002","13.049","0.003","87.36","0.03","83.12","0.03","83.49","0.03","1198","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H29 N8 O10 Zn -","- C15 H21 N8 O10 Zn -","- C30 H42 N16 O20 Zn2 -","2","1","","Ma, Jian-Fang; Liu, Jing-Fu; Xing, Yan; Jia, Heng-Qing; Lin, Yong-Hua","Networks with hexagonal circuits in co-ordination polymers of metal ions (ZnII, CdII) with 1,1'-(1,4-butanediyl)bis(imidazole)","Journal of the Chemical Society, Dalton Transactions","2000","","14","2403","","10.1039/b002433n","","","0.71073","MoKα","","0.0653","0.0428","","0.1141","","0.1082","","","0.894","","","1.028","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009644","8.561","0.002","11.054","0.002","13.012","0.003","85.99","0.03","83.91","0.03","85.62","0.03","1218.5","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C15 H33 Cd N6 O10 S -","- C15 H21 Cd N6 O10 S -","- C30 H42 Cd2 N12 O20 S2 -","2","1","","Ma, Jian-Fang; Liu, Jing-Fu; Xing, Yan; Jia, Heng-Qing; Lin, Yong-Hua","Networks with hexagonal circuits in co-ordination polymers of metal ions (ZnII, CdII) with 1,1'-(1,4-butanediyl)bis(imidazole)","Journal of the Chemical Society, Dalton Transactions","2000","","14","2403","","10.1039/b002433n","","","0.71073","MoKα","","0.0627","0.0511","","0.1503","","0.1458","","","1.089","","","1.183","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009645","24.419","0.005","31.207","0.005","8.475","0.005","90","0.005","90","0.005","90","0.005","6458","4","293","2","293","2","","","","","","","","5","F d d 2","F 2 -2d","43","","","","- C14 H26 Cu N4 O4 -","- C14 H22 Cu N4 O4 -","- C224 H352 Cu16 N64 O64 -","16","1","","Barbaro, Pierluigi; Bianchini, Claudio; Capannesi, Geraldo; Di Luca, Lorella; Laschi, Franco; Petroni, Debora; Salvadori, Piero A.; Vacca, Alberto; Vizza, Francesco","Synthesis and characterization of the tetraazamacrocycle 4,10-dimethyl-1,4,7,10-tetraazacyclododecane-1,7-diacetic acid (H2Me2DO2A) and of its neutral copper(II) complex [Cu(Me2DO2A)]. A new 64Cu-labeled macrocyclic complex for positron emission tomography imaging †","Journal of the Chemical Society, Dalton Transactions","2000","","14","2393","","10.1039/b002441o","","","0.71069","MoKα","","0.0372","0.0318","","0.0864","0.0835","","","","1.071","1.076","1.076","","","","","has coordinates","206958","2020-10-21","18:00:00",""
"7009646","31.099","0.006","10.908","0.002","14.867","0.003","90","","90","","90","","5043.3","1.7","293","2","293","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C26 H51 Cu4 I6 N O12 Rb2 -","- C26 H51 Cu4 I6 N O12 Rb2 -","- C104 H204 Cu16 I24 N4 O48 Rb8 -","4","1","","Rusanova, Julia A.; Domasevitch, Konstantin V.; Vassilyeva, Olga Yu.; Kokozay, Vladimir N.; Rusanov, Eduard B.; Nedelko, Sergey G.; Chukova, Oksana V.; Ahrens, Birte; Raithby, Paul R.","New luminescent copper(I) halide complexes containing Rb+ complexes of 18-crown-6 as counter ions prepared from zerovalent copper","Journal of the Chemical Society, Dalton Transactions","2000","","13","2175","","10.1039/b002451l","","","1.54178","CuKα","","0.1063","0.0654","","","0.1404","0.1602","","","","","","1.02","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009647","28.0474","0.0006","28.0474","0.0006","28.0474","0.0006","90","","90","","90","","22063.7","0.8","220","2","220","2","","","","","","","","7","P a -3","-P 2ac 2ab 3","205","","","","- C120 H234 Cu18 I27 N6 O54 Rb9 -","- C120 H234 Cu18 I27 N6 O54 Rb9 -","- C480 H936 Cu72 I108 N24 O216 Rb36 -","4","0.166667","","Rusanova, Julia A.; Domasevitch, Konstantin V.; Vassilyeva, Olga Yu.; Kokozay, Vladimir N.; Rusanov, Eduard B.; Nedelko, Sergey G.; Chukova, Oksana V.; Ahrens, Birte; Raithby, Paul R.","New luminescent copper(I) halide complexes containing Rb+ complexes of 18-crown-6 as counter ions prepared from zerovalent copper","Journal of the Chemical Society, Dalton Transactions","2000","","13","2175","","10.1039/b002451l","","","0.71073","MoKα","","0.1292","0.0676","","","0.1753","0.2078","","","","","","1.029","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009648","7.954","0.002","24.316","0.005","25.291","0.004","90","","90","","90","","4891.5","1.8","293","2","293","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C12 H24 Br Cu3 I3 O6 Rb -","- C12 H24 Br Cu3 I3 O6 Rb -","- C96 H192 Br8 Cu24 I24 O48 Rb8 -","8","1","","Rusanova, Julia A.; Domasevitch, Konstantin V.; Vassilyeva, Olga Yu.; Kokozay, Vladimir N.; Rusanov, Eduard B.; Nedelko, Sergey G.; Chukova, Oksana V.; Ahrens, Birte; Raithby, Paul R.","New luminescent copper(I) halide complexes containing Rb+ complexes of 18-crown-6 as counter ions prepared from zerovalent copper","Journal of the Chemical Society, Dalton Transactions","2000","","13","2175","","10.1039/b002451l","","","0.71073","MoKα","","0.0915","0.0528","","0.1255","0.1049","","","","1.002","1.085","1.085","","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009649","10.624","0.002","10.862","0.002","11.206","0.002","84.36","0.03","75.44","0.03","77.33","0.03","1219.9","0.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C15 H24 Cu2 N3 O6 Rb S3 -","- C15 H24 Cu2 N3 O6 Rb S3 -","- C30 H48 Cu4 N6 O12 Rb2 S6 -","2","1","","Rusanova, Julia A.; Domasevitch, Konstantin V.; Vassilyeva, Olga Yu.; Kokozay, Vladimir N.; Rusanov, Eduard B.; Nedelko, Sergey G.; Chukova, Oksana V.; Ahrens, Birte; Raithby, Paul R.","New luminescent copper(I) halide complexes containing Rb+ complexes of 18-crown-6 as counter ions prepared from zerovalent copper","Journal of the Chemical Society, Dalton Transactions","2000","","13","2175","","10.1039/b002451l","","","0.71073","MoKα","","0.0854","0.0496","","0.1374","0.1146","","","","1.064","1.116","1.116","","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009650","6.852","0.002","19.404","0.007","18.012","0.007","90","","94.31","0.02","90","","2388","1.4","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H35 P Si3 -","- C21 H35 P Si3 -","- C84 H140 P4 Si12 -","4","1","","Avent, Anthony G.; Bonafoux, Dominique; Eaborn, Colin; Hill, Michael S.; Hitchcock, Peter B.; Smith, J. David","Crowded organometallic compounds of the alkali metals with diphenylphosphino substituents in the organic group","Journal of the Chemical Society, Dalton Transactions","2000","","13","2183","","10.1039/b002488k","","","0.71073","MoKα","","0.0846","0.0491","","0.1149","0.0982","","","","1.025","1.057","1.057","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7009651","15.1313","0.0002","13.7513","0.0002","39.8676","0.0006","90","","94.851","0.001","90","","8265.7","0.2","173","2","173","2","","","","","","","synthesis as described","4","P 1 21/c 1","-P 2ybc","14","[KPPh2].1/14(toluene)","","","- C12.5 H10.57 K P -","- C12.4286 H10 K P -","- C348 H280 K28 P28 -","28","7","","Avent, Anthony G.; Bonafoux, Dominique; Eaborn, Colin; Hill, Michael S.; Hitchcock, Peter B.; Smith, J. David","Crowded organometallic compounds of the alkali metals with diphenylphosphino substituents in the organic group","Journal of the Chemical Society, Dalton Transactions","2000","","13","2183","","10.1039/b002488k","","x-ray","0.71073","MoKα","","0.0941","0.0546","","","0.1401","0.1626","","","","","","0.981","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009652","10.77","0.002","13.683","0.002","16.542","0.004","90","","90","","90","","2437.7","0.8","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C21 H34 Na P Si3 -","- C21 H34 Na P Si3 -","- C84 H136 Na4 P4 Si12 -","4","1","","Avent, Anthony G.; Bonafoux, Dominique; Eaborn, Colin; Hill, Michael S.; Hitchcock, Peter B.; Smith, J. David","Crowded organometallic compounds of the alkali metals with diphenylphosphino substituents in the organic group","Journal of the Chemical Society, Dalton Transactions","2000","","13","2183","","10.1039/b002488k","","","0.71073","MoKα","","0.0759","0.0494","","0.1086","0.0957","","","","0.992","0.999","0.999","","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009653","13.967","0.003","13.981","0.002","16.707","0.005","67.62","0.02","65.41","0.02","60.03","0.01","2507.2","1.1","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C55 H63 Li P3 Si3 -","- C55 H63 Li P3 Si3 -","- C110 H126 Li2 P6 Si6 -","2","1","","Avent, Anthony G.; Bonafoux, Dominique; Eaborn, Colin; Hill, Michael S.; Hitchcock, Peter B.; Smith, J. David","Crowded organometallic compounds of the alkali metals with diphenylphosphino substituents in the organic group","Journal of the Chemical Society, Dalton Transactions","2000","","13","2183","","10.1039/b002488k","","","0.71073","MoKα","","0.1475","0.0706","","0.145","0.1155","","","","1.032","1.137","1.137","","","","","has coordinates,has disorder","179800","2020-10-21","18:00:00",""
"7009654","16.891","0.006","9.826","0.004","19.456","0.011","90","","98.45","0.04","90","","3194","3","173","2","173","2","","","","","","","synthesis as described","7","P 1 21/c 1","-P 2ybc","14","[(tsi)Al(SMe)3Li(thf)2]","","","- C21 H52 Al Li O2 S3 Si3 -","- C21 H52 Al Li O2 S3 Si3 -","- C84 H208 Al4 Li4 O8 S12 Si12 -","4","1","","Chen, Wu-Yong; Eaborn, Colin; Gorrell, Ian B.; Hitchcock, Peter B.; Smith, J. David","Syntheses and crystal structures of some lithium di- and tri-(thiolato)[tris(trimethylsilyl)methyl]aluminates","Journal of the Chemical Society, Dalton Transactions","2000","","14","2313","","10.1039/b002489i","","x-ray","0.71073","MoKα","","0.0921","0.0713","","0.2256","0.2032","","","","1.077","1.115","1.115","","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009655","21.737","0.004","14.61","0.003","23.04","0.004","90","","115.15","0.01","90","","6623","2","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C22 H54 Al Li O S2 Si3 -","- C22 H54 Al Li O S2 Si3 -","- C176 H432 Al8 Li8 O8 S16 Si24 -","8","2","","Chen, Wu-Yong; Eaborn, Colin; Gorrell, Ian B.; Hitchcock, Peter B.; Smith, J. David","Syntheses and crystal structures of some lithium di- and tri-(thiolato)[tris(trimethylsilyl)methyl]aluminates","Journal of the Chemical Society, Dalton Transactions","2000","","14","2313","","10.1039/b002489i","","","0.71073","MoKα","","0.107","0.0628","","0.2043","0.1568","","","","1.02","0.977","0.977","","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009656","34.256","0.007","11.863","0.003","30.519","0.004","90","","99.88","0.02","90","","12218","4","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","[Li(tmeda)2][(tsi)Al(StBu)3].2.5(benzene)","","","- C49 H101 Al Li N4 S3 Si3 -","- C49 H101 Al Li N4 S3 Si3 -","- C392 H808 Al8 Li8 N32 S24 Si24 -","8","1","","Chen, Wu-Yong; Eaborn, Colin; Gorrell, Ian B.; Hitchcock, Peter B.; Smith, J. David","Syntheses and crystal structures of some lithium di- and tri-(thiolato)[tris(trimethylsilyl)methyl]aluminates","Journal of the Chemical Society, Dalton Transactions","2000","","14","2313","","10.1039/b002489i","","","0.71073","MoKα","","0.1906","0.086","","","0.166","0.2114","","","","","","1.009","","","","has coordinates,has disorder","179800","2020-10-21","18:00:00",""
"7009657","10.757","0.002","13.287","0.003","12.309","0.002","90","","102.97","0.01","90","","1714.4","0.6","300","2","300","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","chloro-(8-hydroxyquinolinato-N,O)-(eta$6!-p-cymene)-ruthenium(II)","","- C19 H20 Cl N O Ru -","- C19 H20 Cl N O Ru -","- C76 H80 Cl4 N4 O4 Ru4 -","4","1","","Gemel, Christian; John, Roland; Slugovc, Christian; Mereiter, Kurt; Schmid, Roland; Kirchner, Karl","Synthesis and characterization of ruthenium quinolin-8-olate complexes. Unexpected formation of a κ1-hydrotris(pyrazolyl)borate complex","Journal of the Chemical Society, Dalton Transactions","2000","","15","2607","","10.1039/b002490m","","","0.71073","MoKα","","0.0272","0.0202","","0.0483","0.0431","","","","1.037","1.049","1.049","","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009658","8.412","0.004","12.927","0.005","19.141","0.008","90","","92.47","0.02","90","","2079.5","1.5","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","trans(O,O),cis(N,N)-bis(8-hydroxyquinolinato-N,O)-(eta$4!-cyclo-octa- 1,5-diene)-ruthenium(II)","","- C26 H24 N2 O2 Ru -","- C26 H24 N2 O2 Ru -","- C104 H96 N8 O8 Ru4 -","4","1","","Gemel, Christian; John, Roland; Slugovc, Christian; Mereiter, Kurt; Schmid, Roland; Kirchner, Karl","Synthesis and characterization of ruthenium quinolin-8-olate complexes. Unexpected formation of a κ1-hydrotris(pyrazolyl)borate complex","Journal of the Chemical Society, Dalton Transactions","2000","","15","2607","","10.1039/b002490m","","","0.71073","MoKα","","0.0434","0.029","","","0.0623","0.0697","","","","","","1.096","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009659","9.98","0.001","10.672","0.001","12.548","0.002","92.58","0.01","91.7","0.01","98.78","0.01","1318.5","0.3","301","2","301","2","","","","","","","","6","P -1","-P 1","2","","(hydrogen tris(pyrazolyl)borato-N)-(8-hydroxyquinolinato-N,O)- (eta$6!-p-cymene)-ruthenium(II)","","- C28 H30 B N7 O Ru -","- C28 H30 B N7 O Ru -","- C56 H60 B2 N14 O2 Ru2 -","2","1","","Gemel, Christian; John, Roland; Slugovc, Christian; Mereiter, Kurt; Schmid, Roland; Kirchner, Karl","Synthesis and characterization of ruthenium quinolin-8-olate complexes. Unexpected formation of a κ1-hydrotris(pyrazolyl)borate complex","Journal of the Chemical Society, Dalton Transactions","2000","","15","2607","","10.1039/b002490m","","","0.71073","MoKα","","0.038","0.0263","","0.0615","0.0576","","","","0.986","1.017","1.017","","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009660","9.899","0.004","12.855","0.006","12.936","0.006","115.46","0.02","99.12","0.02","93.28","0.02","1452.9","1.2","223","2","223","2","","","","","","","","8","P -1","-P 1","2","","(8-hydroxyquinolinato-N,O)-(eta$6!-p-cymene)-(pyrrole-N)-ruthenium(II) trifluoromethanesulfonate chloroform solvate (1:1)","","- C24 H25 Cl3 F3 N3 O4 Ru S -","- C23.976 H24.976 Cl2.928 F3 N3 O4 Ru S -","- C47.952 H49.952 Cl5.856 F6 N6 O8 Ru2 S2 -","2","1","","Gemel, Christian; John, Roland; Slugovc, Christian; Mereiter, Kurt; Schmid, Roland; Kirchner, Karl","Synthesis and characterization of ruthenium quinolin-8-olate complexes. Unexpected formation of a κ1-hydrotris(pyrazolyl)borate complex","Journal of the Chemical Society, Dalton Transactions","2000","","15","2607","","10.1039/b002490m","","","0.71073","MoKα","","0.0373","0.0348","","","0.0857","0.0891","","","","","","1.053","","","","has coordinates,has disorder","179800","2020-10-21","18:00:00",""
"7009661","9.894","0.002","13.846","0.003","19.856","0.006","90","","90","","90","","2720.1","1.2","150","2","150","","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C6 H15 I3 S -","- C6 H15 I3 S -","- C48 H120 I24 S8 -","8","1","","Svensson, Per H.; Kloo, Lars","A vibrational spectroscopic, structural and quantum chemical study of the triiodide ion","Journal of the Chemical Society, Dalton Transactions","2000","","14","2449","","10.1039/b002492i","","","0.7107","MoKalpha","","","0.0662","","","0.0735","","","","","2.559","2.559","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009662","15.841","0.002","9.3342","0.0011","9.363","0.002","90","","90","","90","","1384.4","0.4","150","2","150","2","","","","","","","","4","A m a 2","A 2 -2a","40","","","","- C3 H9 I5 S -","- C3 I5 S -","- C12 I20 S4 -","4","0.5","","Svensson, Per H.; Kloo, Lars","A vibrational spectroscopic, structural and quantum chemical study of the triiodide ion","Dalton (2000)","2000","","14","2449","2455","10.1039/b002492i","","","0.71073","MoKα","","0.0464","0.0455","","0.1168","0.116","","","","1.202","1.2","1.2","","","","","has coordinates","180541","2020-10-21","18:00:00",""
"7009663","15.057","0.0008","9.7571","0.0005","14.9825","0.0008","90","","115.99","","90","","1978.52","0.18","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C3 H9 Br2 I S -","- C3 H9 Br2 I S -","- C24 H72 Br16 I8 S8 -","8","1","","Svensson, Per H.; Kloo, Lars","A vibrational spectroscopic, structural and quantum chemical study of the triiodide ion","Journal of the Chemical Society, Dalton Transactions","2000","","14","2449","","10.1039/b002492i","","","0.71073","MoKα","","0.0571","0.0397","","0.0994","0.0913","","","","0.998","1.063","1.063","","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009664","26.143","0.001","10.794","0.002","17.061","0.002","90","","108.522","0.006","90","","4565","1","213.2","","213.2","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C16 H32 Cl2 Co N7 O8 -","- C16 H32 Cl2 Co N7 O8 -","- C128 H256 Cl16 Co8 N56 O64 -","8","1","","Angus, Patricia M.; Elliott, Anthony J.; Sargeson, Alan M.; Willis, Anthony C.","Template synthesis of amidine- and amide-functionalised cobalt(III) hexaaza cage complexes","Journal of the Chemical Society, Dalton Transactions","2000","","17","2933","","10.1039/b002531n","","","1.5418","CuKα","","","0.033","","","","0.026","","","","","","1.64","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009665","30.892","0.019","7.897","0.004","19.834","0.011","90","","128.53","0.03","90","","3785","4","150","","150","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C13 H32 Cl2 N6 -","- C13 H32 Cl2 N6 -","- C104 H256 Cl16 N48 -","8","1","","Pohl, Siegfried; Harmjanz, Michael; Schneider, Jörg; Saak, Wolfgang; Henkel, Gerald","1,3-Bis(N,N,N',N'-tetramethylguanidino)propane: synthesis, characterization and bonding properties of the first bidentate, peralkylated guanidine ligand †","Journal of the Chemical Society, Dalton Transactions","2000","","19","3473","","10.1039/b002554m","","","0.71073","MoKα","","0.064","0.0409","","","0.0846","0.0933","","","","","","1.033","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7009666","7.839","0.002","9.864","0.004","25.026","0.008","90","","96.72","0.02","90","","1921.8","1.1","150","","150","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H30 Cu I N6 -","- C13 H30 Cu I N6 -","- C52 H120 Cu4 I4 N24 -","4","1","","Pohl, Siegfried; Harmjanz, Michael; Schneider, Jörg; Saak, Wolfgang; Henkel, Gerald","1,3-Bis(N,N,N',N'-tetramethylguanidino)propane: synthesis, characterization and bonding properties of the first bidentate, peralkylated guanidine ligand †","Journal of the Chemical Society, Dalton Transactions","2000","","19","3473","","10.1039/b002554m","","","0.71073","MoKα","","0.0724","0.0463","","","0.1246","0.1555","","","","","","1.042","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009667","19.037","0.001","13.646","0.001","30.587","0.002","90","","90","","90","","7945.9","0.9","296","","296","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C13 H30 Cl2 Cu N6 -","- C13 H30 Cl2 Cu N6 -","- C208 H480 Cl32 Cu16 N96 -","16","2","","Pohl, Siegfried; Harmjanz, Michael; Schneider, Jörg; Saak, Wolfgang; Henkel, Gerald","1,3-Bis(N,N,N',N'-tetramethylguanidino)propane: synthesis, characterization and bonding properties of the first bidentate, peralkylated guanidine ligand †","Journal of the Chemical Society, Dalton Transactions","2000","","19","3473","","10.1039/b002554m","","","0.71073","MoKα","","0.09","0.0601","","","0.1338","0.1548","","","","","","1.164","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009668","9.466","0.002","10.473","0.003","12.86","0.003","69.3","0.02","87.65","0.02","63.96","0.02","1061.6","0.5","150","","150","","","","","","","","","5","P -1","-P 1","2","","","","- C13 H30 Fe I2 N6 -","- C13 H30 Fe I2 N6 -","- C26 H60 Fe2 I4 N12 -","2","1","","Pohl, Siegfried; Harmjanz, Michael; Schneider, Jörg; Saak, Wolfgang; Henkel, Gerald","1,3-Bis(N,N,N',N'-tetramethylguanidino)propane: synthesis, characterization and bonding properties of the first bidentate, peralkylated guanidine ligand †","Journal of the Chemical Society, Dalton Transactions","2000","","19","3473","","10.1039/b002554m","","","0.71073","MoKα","","0.0283","0.0255","","","0.0681","0.0698","","","","","","1.233","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009669","9.655","0.002","10.3403","0.0006","12.4671","0.0007","90","","90","","90","","1244.7","0.3","180.2","","180.2","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C12 H8 Fe N6 -","- C12 H8 Fe N6 -","- C48 H32 Fe4 N24 -","4","1","","Rettig, Steven J.; Sánchez, Victor; Storr, Alan; Thompson, Robert C.; Trotter, James","Polybis(4-azabenzimidazolato)-iron(II) and -cobalt(II). 3-D single diamond-like framework materials which exhibit spin canting and ferromagnetic ordering at low temperatures †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3931","","10.1039/b002574g","","","0.7107","MoKα","","0.0838","0.0838","","0.0546","","0.0546","","","1.215","","","1.215","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009670","11.786","0.002","12.189","0.002","12.849","0.002","107.22","0.01","90.88","0.02","118.53","0.01","1521.8","0.5","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C19 H39 Cu F12 N8 P2 -","- C19 H39 Cu F12 N8 P2 -","- C38 H78 Cu2 F24 N16 P4 -","2","1","","Blake, Alexander J.; Danks, Jonathan P.; Li, Wan-Sheung; Lippolis, Vito; Schröder, Martin","Synthesis and characterisation of pendant-arm amino derivatives of 1,4,7-triazacyclononane and alkyl-bridged bis(1,4,7-triazacyclononane) macrocycles and complexation to Cu(II)","Journal of the Chemical Society, Dalton Transactions","2000","","17","3034","","10.1039/b002626n","","","0.71073","MoKα","","0.0482","0.0417","","","0.104","0.1108","","","","","","1.037","","","","has coordinates,has disorder","179800","2020-10-21","18:00:00",""
"7009671","9.767","0.004","13.341","0.006","15.612","0.005","90","","90","","90","","2034.3","1.4","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C13 H31 B2 Cu F8 N5 -","- C13 H31 B2 Cu F8 N5 -","- C52 H124 B8 Cu4 F32 N20 -","4","1","","Blake, Alexander J.; Danks, Jonathan P.; Li, Wan-Sheung; Lippolis, Vito; Schröder, Martin","Synthesis and characterisation of pendant-arm amino derivatives of 1,4,7-triazacyclononane and alkyl-bridged bis(1,4,7-triazacyclononane) macrocycles and complexation to Cu(II)","Journal of the Chemical Society, Dalton Transactions","2000","","17","3034","","10.1039/b002626n","","","0.71073","MoKα","","0.0387","0.0364","","","0.0828","0.0849","","","","","","1.046","","","","has coordinates,has disorder","179800","2020-10-21","18:00:00",""
"7009672","25.231","0.003","10.1531","0.0014","25.314","0.006","90","","90.013","0.014","90","","6484.8","1.9","203","2","203","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C61 H93 Cr N2 O2 -","- C61 H81 Cr N2 O2 -","- C244 H324 Cr4 N8 O8 -","4","0.5","","Gibson, Vernon C.; Mastroianni, Sergio; Newton, Claire; Redshaw, Carl; Solan, Gregory A.; White, Andrew J. P.; Williams, David J.","A five-coordinate chromium alkyl complex stabilised by salicylaldiminato ligands","Journal of the Chemical Society, Dalton Transactions","2000","","13","1969","","10.1039/b002631j","","","0.71073","MoKα","","0.134","0.0832","","0.2684","0.2024","","","","1.072","1.172","1.172","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7009673","22.829","0.003","12.704","0.002","20.164","0.004","90","","90.726","0.011","90","","5847.5","1.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C58 H82 Cl Cr N4 O2 -","- C58 H82 Cl Cr N4 O2 -","- C232 H328 Cl4 Cr4 N16 O8 -","4","1","","Gibson, Vernon C.; Mastroianni, Sergio; Newton, Claire; Redshaw, Carl; Solan, Gregory A.; White, Andrew J. P.; Williams, David J.","A five-coordinate chromium alkyl complex stabilised by salicylaldiminato ligands","Journal of the Chemical Society, Dalton Transactions","2000","","13","1969","","10.1039/b002631j","","","0.71073","MoKα","","0.1378","0.0652","","0.1811","0.1413","","","","1.005","1.113","1.113","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7009674","16.733","0.003","22.687","0.002","8.719","0.001","90","","90","","90","","3309.9","0.8","133","2","133","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C22 H56 Cl2 N4 O Si4 -","- C22 H56 Cl2 N4 O Si4 -","- C88 H224 Cl8 N16 O4 Si16 -","4","0.5","","Jaschke, Bettina; Herbst-Irmer, Regine; Klingebiel, Uwe; Pape, Thomas","cis-2,4-Diamino-2,4-dichloro-1,3-bis(di-tert-butylmethylsilyl)cyclodisilazane—synthesis and crystal structure","Journal of the Chemical Society, Dalton Transactions","2000","","12","1827","","10.1039/b002634o","","","0.71073","MoKα","","0.0437","0.0369","","","0.0843","0.0886","","","","","","1.131","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009675","8.614","0.0002","13.4561","0.0004","10.8168","0.0004","90","","95.488","0.002","90","","1248.04","0.07","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C5 H16 Co N2 O8 P2 -","- C5 H16 Co N2 O8 P2 -","- C20 H64 Co4 N8 O32 P8 -","4","1","","Choudhury, Amitava; Natarajan, Srinivasan; Rao, C. N. R.","Simple linear-chain cobalt phosphates","Journal of the Chemical Society, Dalton Transactions","2000","","15","2595","","10.1039/b002653k","","","0.71073","MoKα","","0.0527","0.0384","","0.1112","0.1062","","","","1.057","1.125","1.125","","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009676","11.8793","0.0011","13.5078","0.0012","8.1681","0.0007","90","","90","","90","","1310.7","0.2","293","2","293","2","","","","","","","","6","P c c n","-P 2ab 2ac","56","","","","- C6 H18 Co N2 O8 P2 -","- C6 H18 Co N2 O8 P2 -","- C24 H72 Co4 N8 O32 P8 -","4","0.5","","Choudhury, Amitava; Natarajan, Srinivasan; Rao, C. N. R.","Simple linear-chain cobalt phosphates","Journal of the Chemical Society, Dalton Transactions","2000","","15","2595","","10.1039/b002653k","","","0.71073","MoKα","","0.0431","0.0261","","0.0695","0.065","","","","1.037","1.092","1.092","","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009677","12.63","0.004","19.034","0.004","12.745","0.004","90","","95.75","0.02","90","","3048.5","1.5","296.2","","296.2","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C24 H30 Cl2 Co F6 P5 -","- C24 H30 Cl2 Co F6 P5 -","- C96 H120 Cl8 Co4 F24 P20 -","4","1","","Chatterjee, Swarup; Doyle, Roy; Hockless, David C. R.; Salem, Geoffrey; Willis, Anthony C.","Completely stereoselective synthesis of a chiral tetra(tertiary phosphine). Crystal and molecular structure of [OC-6-22-(R*,R*)]-(±)-dichloro{1,2-bis[(2-dimethylphosphinophenyl)methylphosphino]benzene-P,P ',P ″,P ‴}cobalt(III) hexafluorophosphate †","Journal of the Chemical Society, Dalton Transactions","2000","","12","1829","","10.1039/b002662j","","","0.7107","MoKα","","0.1038","0.0448","","0.0518","","0.0461","","","1.6","","","1.887","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009678","33.921","0.011","10.103","0.002","17.915","0.004","90","","90","","90","","6140","3","296","2","296","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C60 H58 Cl2 Mn N12 O10 -","- C60 H54 Cl2 Mn N12 O10 -","- C240 H216 Cl8 Mn4 N48 O40 -","4","1","","Fei, Bao-Li; Sun, Wei-Yin; Zhang, Yan-An; Yu, Kai-Bei; Tang, Wen-Xia","Synthesis and crystal structure of an infinite one-dimensional chain containing a poly-metallocage of MnII with 4,4'-bis(imidazol-1-ylmethyl)biphenyl","Journal of the Chemical Society, Dalton Transactions","2000","","14","2345","","10.1039/b002692l","","","0.71073","MoKα","","0.1827","0.0496","","","0.0754","0.0999","","","","","","0.722","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009679","4.895","0.001","15.164","0.002","14.904","0.002","90","","97.21","0.01","90","","1097.5","0.3","288","2","288","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H10 Cl N2 O4 -","- C10 H10 Cl N2 O4 -","- C40 H40 Cl4 N8 O16 -","4","1","","Fei, Bao-Li; Sun, Wei-Yin; Zhang, Yan-An; Yu, Kai-Bei; Tang, Wen-Xia","Synthesis and crystal structure of an infinite one-dimensional chain containing a poly-metallocage of MnII with 4,4'-bis(imidazol-1-ylmethyl)biphenyl","Journal of the Chemical Society, Dalton Transactions","2000","","14","2345","","10.1039/b002692l","","","0.71073","MoKα","","0.1144","0.0777","","","0.2276","0.2494","","","","","","1.038","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009680","11.597","0.003","15.216","0.001","12.777","0.009","90","","101.82","0.04","90","","2206.8","1.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H32 N2 O Ti -","- C24 H32 N2 O Ti -","- C96 H128 N8 O4 Ti4 -","4","1","","Fandos, Rosa; Hernández, Carolina; Otero, Antonio; Rodríguez, Ana; Ruiz, Maria José; Terreros, Pilar","Synthesis and characterization of 2-pyridylalkoxide complexes of titanium, zirconium and tantalum. Crystal structures of TiCp*Me2(OCMePy2) and TaCp*Cl3(OCPy3) (Cp* = η5-C5Me5, Py = C5H4N)","Journal of the Chemical Society, Dalton Transactions","2000","","17","2990","","10.1039/b002693j","","","0.7107","MoKα","","0.1542","0.0585","","","0.1088","0.1662","","","","","","0.969","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009681","15.369","0.006","16.609","0.0006","12.455","0.006","90","","90","","90","","3179","2","293","2","293","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C26 H27 Cl3 N3 O Ta -","- C26 Cl3 N3 O Ta -","- C104 Cl12 N12 O4 Ta4 -","4","1","","Fandos, Rosa; Hernández, Carolina; Otero, Antonio; Rodríguez, Ana; Ruiz, Maria José; Terreros, Pilar","Synthesis and characterization of 2-pyridylalkoxide complexes of titanium, zirconium and tantalum. Crystal structures of TiCp*Me2(OCMePy2) and TaCp*Cl3(OCPy3) (Cp* = η5-C5Me5, Py = C5H4N)","Journal of the Chemical Society, Dalton Transactions","2000","","17","2990","","10.1039/b002693j","","","0.7107","MoKα","","0.0879","0.079","","","0.2214","0.2443","","","","","","1.128","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009682","8.74","0.008","15.318","0.002","11.285","0.004","90","","105.34","0.04","90","","1457","1.5","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C30 H34 Cl2 N4 O2 Zn2 -","- C30 H34 Cl2 N4 O2 Zn2 -","- C60 H68 Cl4 N8 O4 Zn4 -","2","1","","Korupoju, Srinivas R.; Mangayarkarasi, Nagarathinam; Ameerunisha, Sardar; Valente, Edward J.; Zacharias, Panthappally S.","Formation of dinuclear macrocyclic and mononuclear acyclic complexes of a new trinucleating hexaaza triphenolic Schiff base macrocycle: structure and NLO properties","Journal of the Chemical Society, Dalton Transactions","2000","","16","2845","","10.1039/b002700f","","","0.71073","MoKα","","0.0461","0.032","","","0.0728","0.0804","","","","","","1.07","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009683","16.042","0.011","19.769","0.009","12.477","0.006","90","","109.56","0.05","90","","3729","4","293","2","293","2","","","","","","","Hodgson (MSU) 1996","6","P 1 21/c 1","-P 2ybc","14","","","","- C34 H40 Cl Cu2 N5 O8 -","- C34 H40 Cl Cu2 N5 O8 -","- C136 H160 Cl4 Cu8 N20 O32 -","4","1","","Korupoju, Srinivas R.; Mangayarkarasi, Nagarathinam; Ameerunisha, Sardar; Valente, Edward J.; Zacharias, Panthappally S.","Formation of dinuclear macrocyclic and mononuclear acyclic complexes of a new trinucleating hexaaza triphenolic Schiff base macrocycle: structure and NLO properties","Journal of the Chemical Society, Dalton Transactions","2000","","16","2845","","10.1039/b002700f","","","0.71073","MoKα","","0.2134","0.0835","","0.2157","0.1809","","","","1.221","1.742","1.742","","","","","has coordinates,has disorder","179800","2020-10-21","18:00:00",""
"7009684","9","0.03","19.014","0.004","11.518","0.004","90","","106.33","0.12","90","","1892","6","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C33 H40 Cl2 N5 Ni2 O11 -","- C33 H40 Cl2 N5 Ni2 O11 -","- C66 H80 Cl4 N10 Ni4 O22 -","2","1","","Korupoju, Srinivas R.; Mangayarkarasi, Nagarathinam; Ameerunisha, Sardar; Valente, Edward J.; Zacharias, Panthappally S.","Formation of dinuclear macrocyclic and mononuclear acyclic complexes of a new trinucleating hexaaza triphenolic Schiff base macrocycle: structure and NLO properties","Journal of the Chemical Society, Dalton Transactions","2000","","16","2845","","10.1039/b002700f","","","0.71073","MoKα","","0.0694","0.0607","","","0.1703","0.1831","","","","","","1.101","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009685","20.117","0.004","58.207","0.012","9.73","0.002","90","","90","","90","","11393","4","293","2","293","2","","","","","","","","7","F 2 2 2","F 2 2","22","","","","- C48 H48 F6 Mn N4 O8 P -","- C49 H48 F6 Mn2 N4 O13 P2 -","- C392 H384 F48 Mn16 N32 O104 P16 -","8","0.5","","Korupoju, Srinivas R.; Mangayarkarasi, Nagarathinam; Ameerunisha, Sardar; Valente, Edward J.; Zacharias, Panthappally S.","Formation of dinuclear macrocyclic and mononuclear acyclic complexes of a new trinucleating hexaaza triphenolic Schiff base macrocycle: structure and NLO properties","Journal of the Chemical Society, Dalton Transactions","2000","","16","2845","","10.1039/b002700f","","","0.71073","MoKα","","0.2138","0.0821","","","0.238","0.2986","","","","","","0.966","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009686","13.9458","0.0002","14.1348","0.0003","17.199","0.0003","87.015","0.001","87.615","0.001","67.292","0.001","3122.39","0.1","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C50.5 H65 Cl5 O20 Zr3 -","- C50.5 H65 Cl5 O20 Zr3 -","- C101 H130 Cl10 O40 Zr6 -","2","1","","Chi, Yun; Lan, Jing-Wen; Ching, Wei-Li; Peng, Shie-Ming; Lee, Gene-Hsiang","Syntheses and characterization of mixed acetylacetonate‒catecholate complexes of zirconium, [Zr3(acac)4(cat)4(MeOH)2], [Zr(acac)2(DBcat)]2 (H2DBcat = 3,5-di-tert-butylcatechol) and [Zr4(μ4-O)(acac)4(DBcat)3(OMe)4(MeOH)]","Journal of the Chemical Society, Dalton Transactions","2000","","17","2923","","10.1039/b002705g","","","0.71073","MoKα","","0.0682","0.0447","","0.1299","0.1147","","","","1.044","1.077","1.077","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009687","9.439","0.002","11.641","0.003","13.567","0.004","113.63","0.03","94.22","0.03","101.89","0.03","1316","0.7","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C48 H68 O12 Zr2 -","- C48 H68 O12 Zr2 -","- C48 H68 O12 Zr2 -","1","0.5","","Chi, Yun; Lan, Jing-Wen; Ching, Wei-Li; Peng, Shie-Ming; Lee, Gene-Hsiang","Syntheses and characterization of mixed acetylacetonate‒catecholate complexes of zirconium, [Zr3(acac)4(cat)4(MeOH)2], [Zr(acac)2(DBcat)]2 (H2DBcat = 3,5-di-tert-butylcatechol) and [Zr4(μ4-O)(acac)4(DBcat)3(OMe)4(MeOH)]","Journal of the Chemical Society, Dalton Transactions","2000","","17","2923","","10.1039/b002705g","","","0.71073","MoKα","","0.0395","0.0322","","0.0925","0.0891","","","","1.057","1.095","1.095","","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009688","13.234","0.003","14.387","0.003","25.277","0.004","75.947","0.02","85.394","0.02","82.52","0.019","4623","1.7","295","","295","","","","","","","","","5","P -1","-P 1","2","","","","- C73 H118 Cl6 O23 Zr4 -","- C73 H118 Cl6 O24 Zr4 -","- C146 H236 Cl12 O48 Zr8 -","2","1","","Chi, Yun; Lan, Jing-Wen; Ching, Wei-Li; Peng, Shie-Ming; Lee, Gene-Hsiang","Syntheses and characterization of mixed acetylacetonate‒catecholate complexes of zirconium, [Zr3(acac)4(cat)4(MeOH)2], [Zr(acac)2(DBcat)]2 (H2DBcat = 3,5-di-tert-butylcatechol) and [Zr4(μ4-O)(acac)4(DBcat)3(OMe)4(MeOH)]","Journal of the Chemical Society, Dalton Transactions","2000","","17","2923","","10.1039/b002705g","","","0.71073","MolybdenumKα","","0.09","0.049","","0.086","0.052","","","","","1.27","1.27","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009689","19.306","0.008","16.0717","0.0007","19.428","0.004","90","","117.19","0.02","90","","5362","3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C17 H38 N2 Nb Si3 -","- C17 H38 N2 Nb Si3 -","- C136 H304 N16 Nb8 Si24 -","8","1","","Dorado, Iván; Garcés, Andrés; López-Mardomingo, Carmen; Fajardo, Mariano; Rodríguez, Ana; Antiñolo, Antonio; Otero, Antonio","Synthesis and structural characterization of new organo-diimido and organo-imido niobium and titanium complexes","Journal of the Chemical Society, Dalton Transactions","2000","","14","2375","","10.1039/b002743j","","","0.7107","MoKα","","0.2174","0.08","","","0.1545","0.2417","","","","","","1.008","","","","has coordinates,has disorder","179800","2020-10-21","18:00:00",""
"7009690","12.724","0.007","21.161","0.01","15.295","0.011","90","","108.7","0.05","90","","3901","4","298","","","","","","","","","","Local laboratory","6","C 1 2/c 1","-C 2yc","15","","","","?","- C42 H52 N2 Ni0.5 O2 S2 -","- C168 H208 N8 Ni2 O8 S8 -","4","0.5","","Kawamoto, Tatsuya; Kushi, Yoshihiko","CH/π interaction in nickel(II) complexes derived from 2-substituted benzothiazolines","Journal of the Chemical Society, Dalton Transactions","2000","","17","3022","","10.1039/b002745f","","","0.71073","MoKα","","","0.068","","","0.065","","","","","3.37","3.37","","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009691","12.163","0.005","14.804","0.005","7.028","0.006","90.06","0.05","106.8","0.05","86.29","0.03","1208.7","1.3","298","","","","","","","","","","Local laboratory","5","P -1","-P 1","2","","","","- C28 H24 N2 Ni S2 -","- C28 H24 N2 Ni S2 -","- C56 H48 N4 Ni2 S4 -","2","1","","Kawamoto, Tatsuya; Kushi, Yoshihiko","CH/π interaction in nickel(II) complexes derived from 2-substituted benzothiazolines","Journal of the Chemical Society, Dalton Transactions","2000","","17","3022","","10.1039/b002745f","","","0.71073","MoKα","","","0.085","","","0.098","","","","","2.134","2.134","","","","","has coordinates","277881","2022-09-15","13:34:57",""
"7009692","5.1224","0.0009","17.356","0.002","8.934","0.001","90","","100.53","0.01","90","","780.9","0.19","295.2","","295.2","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C3 H11 N2 O5 P -","- C3 H11 N2 O5 P -","- C12 H44 N8 O20 P4 -","4","1","","Sagatys, Dalius S.; Dahlgren, Cathrine; Smith, Graham; Bott, Raymond C.; White, Jonathan M.","The complex chemistry of N-(phosphonomethyl)glycine (glyphosate): preparation and characterization of the ammonium, lithium, sodium (4 polymorphs) and silver(I) complexes","Journal of the Chemical Society, Dalton Transactions","2000","","19","3404","","10.1039/b002748k","","","0.7107","MoKalpha","","","0.0388","","","0.0498","","","","","1.709","1.709","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009693","15.185","0.001","9.288","0.002","10.794","0.001","90","","93.428","0.007","90","","1519.6","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C3 H8 N Na O5.5 P -","- C3 H8 N Na O5.5 P -","- C24 H64 N8 Na8 O44 P8 -","8","2","","Sagatys, Dalius S.; Dahlgren, Cathrine; Smith, Graham; Bott, Raymond C.; White, Jonathan M.","The complex chemistry of N-(phosphonomethyl)glycine (glyphosate): preparation and characterization of the ammonium, lithium, sodium (4 polymorphs) and silver(I) complexes","Journal of the Chemical Society, Dalton Transactions","2000","","19","3404","","10.1039/b002748k","","","0.71069","MoKα","","0.0313","0.0264","","","0.0669","0.0698","","","","","","1.001","","","","has coordinates","183806","2020-10-21","18:00:00",""
"7009694","7.121","0.0004","11.2074","0.0007","9.6687","0.0008","90","","98.602","0.006","90","","762.96","0.09","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C3 H9 N Na O6 P -","- C3 H9 N Na O6 P -","- C12 H36 N4 Na4 O24 P4 -","4","1","","Sagatys, Dalius S.; Dahlgren, Cathrine; Smith, Graham; Bott, Raymond C.; White, Jonathan M.","The complex chemistry of N-(phosphonomethyl)glycine (glyphosate): preparation and characterization of the ammonium, lithium, sodium (4 polymorphs) and silver(I) complexes","Journal of the Chemical Society, Dalton Transactions","2000","","19","3404","","10.1039/b002748k","","","0.71069","MoKα","","0.0235","0.0231","","","0.0608","0.0615","","","","","","1.038","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009695","6.365","0.001","7.186","0.002","17.816","0.003","90","","94.04","0.01","90","","812.9","0.3","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C3 H24 N Na2 O14 P -","- C3 H24 N Na2 O14 P -","- C6 H48 N2 Na4 O28 P2 -","2","1","","Sagatys, Dalius S.; Dahlgren, Cathrine; Smith, Graham; Bott, Raymond C.; White, Jonathan M.","The complex chemistry of N-(phosphonomethyl)glycine (glyphosate): preparation and characterization of the ammonium, lithium, sodium (4 polymorphs) and silver(I) complexes","Journal of the Chemical Society, Dalton Transactions","2000","","19","3404","","10.1039/b002748k","","","0.71069","MoKα","","0.0266","0.024","","","0.0624","0.064","","","","","","1.013","","","","has coordinates","179800","2020-10-21","18:00:00",""
"7009696","5.4","0.002","17.168","0.003","5.01","0.002","94.49","0.02","115.75","0.02","81.95","0.02","414.1","0.2","295.2","","295.2","","","","","","","","","6","P -1","-P 1","2","","","","- C3 H6 Ag2 N O5 P -","- C5 H3 Ag2.5 N O7 P -","- C10 H6 Ag5 N2 O14 P2 -","2","1","","Sagatys, Dalius S.; Dahlgren, Cathrine; Smith, Graham; Bott, Raymond C.; White, Jonathan M.","The complex chemistry of N-(phosphonomethyl)glycine (glyphosate): preparation and characterization of the ammonium, lithium, sodium (4 polymorphs) and silver(I) complexes","Journal of the Chemical Society, Dalton Transactions","2000","","19","3404","","10.1039/b002748k","","","0.7107","MoKalpha","","","0.1389","","","0.1507","","","","","9.633","9.633","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009697","28.215","0.004","28.215","0.004","23.17","0.005","90","","90","","120","","15974","5","203","2","203","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C24 H47 La N6 O10 -","- C23.99 H33 La N6 O9.98 -","- C431.82 H594 La18 N108 O179.64 -","18","1","","Tei, Lorenzo; Baum, Gerhard; Blake, Alexander J.; Fenske, Dieter; Schröder, Martin","Lanthanide complexes of a new nonadentate ligand derived from 1,4,7-triazacyclononane: synthesis, structural characterisation and NMR spectroscopic studies","Journal of the Chemical Society, Dalton Transactions","2000","","16","2793","","10.1039/b002794o","","","0.71073","MoKα","","0.0561","0.0434","","","0.119","0.1289","","","","","","1.001","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"7009698","28.337","0.004","28.337","0.004","23.405","0.005","90","","90","","120","","16276","5","193","2","193","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C24 H46 N6 O9.5 Sm -","- C24 H33 N6 O9.5 Sm -","- C432 H594 N108 O171 Sm18 -","18","1","","Tei, Lorenzo; Baum, Gerhard; Blake, Alexander J.; Fenske, Dieter; Schröder, Martin","Lanthanide complexes of a new nonadentate ligand derived from 1,4,7-triazacyclononane: synthesis, structural characterisation and NMR spectroscopic studies","Journal of the Chemical Society, Dalton Transactions","2000","","16","2793","","10.1039/b002794o","","","0.71073","MoKα","","0.0609","0.0489","","","0.1369","0.1485","","","","","","1.004","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"7009699","28.14","0.03","28.14","0.03","23.18","0.02","90","","90","","120","","15896","3","203","2","203","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C23 H41.5 N6 O8.5 Y -","- C23 H33 N6 O8.51 Y -","- C414 H594 N108 O153.18 Y18 -","18","1","","Tei, Lorenzo; Baum, Gerhard; Blake, Alexander J.; Fenske, Dieter; Schröder, Martin","Lanthanide complexes of a new nonadentate ligand derived from 1,4,7-triazacyclononane: synthesis, structural characterisation and NMR spectroscopic studies","Journal of the Chemical Society, Dalton Transactions","2000","","16","2793","","10.1039/b002794o","","","0.71073","MoKα","","0.0805","0.0662","","","0.186","0.2004","","","","","","1.052","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"7009700","9.1698","0.001","24.026","0.003","10.8833","0.0011","90","","97.519","0.009","90","","2377.1","0.5","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C23 H27 Cl N2 O4 P Re -","- C23 H27 Cl N2 O4 P Re -","- C92 H108 Cl4 N8 O16 P4 Re4 -","4","1","","Correia, João D. G.; Domingos, Ângela; Paulo, António; Santos, Isabel","Novel six-co-ordinate oxorhenium complexes with ligands containing PN2 and PNO donor atom sets: syntheses and structural characterization","Journal of the Chemical Society, Dalton Transactions","2000","","14","2477","","10.1039/b002798g","","","0.71073","MoKα","","0.0944","0.05","","0.1128","0.083","","","","1.119","1.137","1.137","","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009701","9.496","0.001","13.118","0.002","15.706","0.002","83.86","0.01","83.55","0.01","69.17","0.01","1812.3","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C41 H36 N O6 P2 Re -","- C41 H32 N O6 P2 Re -","- C82 H64 N2 O12 P4 Re2 -","2","1","","Correia, João D. G.; Domingos, Ângela; Paulo, António; Santos, Isabel","Novel six-co-ordinate oxorhenium complexes with ligands containing PN2 and PNO donor atom sets: syntheses and structural characterization","Journal of the Chemical Society, Dalton Transactions","2000","","14","2477","","10.1039/b002798g","","","0.71073","MoKα","","0.0572","0.0399","","0.0869","0.0758","","","","1.116","1.078","1.078","","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009702","14.3","0.003","16.977","0.002","18.752","0.004","92.57","0.014","109.78","0.02","96.122","0.013","4243.5","1.5","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C42 H38 Cl N2 O5 P2 Re -","- C42 H38 Cl N2 O5.5 P2 Re -","- C168 H152 Cl4 N8 O22 P8 Re4 -","4","2","","Correia, João D. G.; Domingos, Ângela; Paulo, António; Santos, Isabel","Novel six-co-ordinate oxorhenium complexes with ligands containing PN2 and PNO donor atom sets: syntheses and structural characterization","Journal of the Chemical Society, Dalton Transactions","2000","","14","2477","","10.1039/b002798g","","","0.71073","MoKα","","0.1375","0.075","","0.2657","0.1853","","","","1.063","1.11","1.11","","","","","has coordinates,has disorder","179801","2020-10-21","18:00:00",""
"7009703","14.484","0.007","20.38","0.008","34.711","0.01","90","","90.97","0.01","90","","10245","7","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C68 H85 Ag6 F18 N31 O19 S6 -","- C68 H85 Ag6 F18 N31 O19 S6 -","- C272 H340 Ag24 F72 N124 O76 S24 -","4","1","","Yang, Shi-Ping; Chen, Xiao-Ming; Ji, Liang-Nian","Influence of the counter ions and ligands on structures of silver(I) helicates with di-Schiff bases containing imidazole groups","Journal of the Chemical Society, Dalton Transactions","2000","","14","2337","","10.1039/b002837l","","","0.71073","MoKα","","0.1707","0.0831","","","0.1987","0.2461","","","","","","1.011","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009704","14.587","0.004","25.035","0.006","30.719","0.004","90","","101.6","0.01","90","","10989","4","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C37 H49.5 Ag3.5 Cl3.5 N18.5 O14 -","- C37 H49.5 Ag3.5 Cl3.5 N18.5 O14 -","- C296 H396 Ag28 Cl28 N148 O112 -","8","1","","Yang, Shi-Ping; Chen, Xiao-Ming; Ji, Liang-Nian","Influence of the counter ions and ligands on structures of silver(I) helicates with di-Schiff bases containing imidazole groups","Journal of the Chemical Society, Dalton Transactions","2000","","14","2337","","10.1039/b002837l","","","0.71073","MoKα","","0.1422","0.068","","","0.153","0.1892","","","","","","1.016","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7009705","13.677","0.003","27.472","0.006","27.311","0.005","90","","92.82","0.004","90","","10249","4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H34 Ag2 N14 O7 -","- C24 H33 Ag2 N14 O6.5 -","- C288 H396 Ag24 N168 O78 -","12","3","","Yang, Shi-Ping; Chen, Xiao-Ming; Ji, Liang-Nian","Influence of the counter ions and ligands on structures of silver(I) helicates with di-Schiff bases containing imidazole groups","Journal of the Chemical Society, Dalton Transactions","2000","","14","2337","","10.1039/b002837l","","","0.71073","MoKα","","0.0906","0.0685","","","0.1996","0.2247","","","","","","1.052","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009706","24.535","0.006","14.76","0.004","13.575","0.002","90","","116.3","0.01","90","","4407.1","1.8","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C29 H36 Ag3 F9 N12 O9 S3 -","- C29 H36 Ag3 F9 N12 O9 S3 -","- C116 H144 Ag12 F36 N48 O36 S12 -","4","0.5","","Yang, Shi-Ping; Chen, Xiao-Ming; Ji, Liang-Nian","Influence of the counter ions and ligands on structures of silver(I) helicates with di-Schiff bases containing imidazole groups","Journal of the Chemical Society, Dalton Transactions","2000","","14","2337","","10.1039/b002837l","","","0.71073","MoKα","","0.0897","0.0525","","","0.1179","0.1358","","","","","","1.015","","","","has coordinates,has disorder","179801","2020-10-21","18:00:00",""
"7009707","10.308","0.004","22.628","0.01","15.081","0.003","90","","90.85","","90","","3517","2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H36 Ag3 N15 O9 -","- C26 H36 Ag3 N15 O9 -","- C104 H144 Ag12 N60 O36 -","4","1","","Yang, Shi-Ping; Chen, Xiao-Ming; Ji, Liang-Nian","Influence of the counter ions and ligands on structures of silver(I) helicates with di-Schiff bases containing imidazole groups","Journal of the Chemical Society, Dalton Transactions","2000","","14","2337","","10.1039/b002837l","","","0.71073","MoKα","","0.1352","0.061","","","0.1045","0.1244","","","","","","1.007","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009708","15.3832","0.0011","16.8991","0.0012","17.8228","0.0011","90","","100.154","0.001","90","","4560.7","0.5","238","2","238","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C29 H47 Cl8 Co N6 O8 P -","- C29 H47 Cl8 Co N6 O8 P -","- C116 H188 Cl32 Co4 N24 O32 P4 -","4","1","","Kimblin, Clare; Bridgewater, Brian M.; Churchill, David G.; Parkin, Gerard","Synthesis and molecular structures of a pair of tris(imidazolyl)phosphine cobalt‒perchlorate complexes, {[PimPri2]Co(OClO3)}[ClO4] and {[PimPri2]Co(OH2)(HOMe)(OClO3)}[ClO4]","Journal of the Chemical Society, Dalton Transactions","2000","","13","2191","","10.1039/b002894k","","","0.71073","MoKα","","0.1049","0.0624","","","0.1819","0.2086","","","","","","1.057","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009709","12.6185","0.0008","18.2452","0.0011","17.6528","0.001","90","","90.537","0.001","90","","4064","0.4","233","2","233","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C29 H55 Cl2 Co N6 O11 P -","- C29 H55 Cl2.004 Co N6 O11 P -","- C116 H220 Cl8.016 Co4 N24 O44 P4 -","4","1","","Kimblin, Clare; Bridgewater, Brian M.; Churchill, David G.; Parkin, Gerard","Synthesis and molecular structures of a pair of tris(imidazolyl)phosphine cobalt‒perchlorate complexes, {[PimPri2]Co(OClO3)}[ClO4] and {[PimPri2]Co(OH2)(HOMe)(OClO3)}[ClO4]","Journal of the Chemical Society, Dalton Transactions","2000","","13","2191","","10.1039/b002894k","","","0.71073","MoKα","","0.0583","0.046","","","0.1222","0.1294","","","","","","1.094","","","","has coordinates,has disorder","179801","2020-10-21","18:00:00",""
"7009710","37.4309","0.0001","9.2751","0.0002","33.8359","0.0011","90","","103.96","0.001","90","","11400","0.4","180","2","180","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C55 H33 N O18 P2 Ru6 -","- C55 H33 N O18 P2 Ru6 -","- C440 H264 N8 O144 P16 Ru48 -","8","1","","Dyson, Paul J.; Feeder, Neil; Johnson, Brian F. G.; McIndoe, J. Scott; Langridge-Smith, Patrick R. R.","Insights into the elimination of HCHO from the clusters [Mn(CO)m(COOMe)]− (Mn = Ru6C, m = 16; Mn = Rh6, m = 15) provided by electrospray mass spectrometry †","Journal of the Chemical Society, Dalton Transactions","2000","","12","1813","","10.1039/b002978p","","","0.7107","MoKα","","0.0745","0.0383","","","0.0801","0.0898","","","","","","0.981","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009711","12.575","0.004","20.875","0.005","21.202","0.005","90","","103.35","0.02","90","","5415","3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","[HIr4(CO)8(PPh2)(PPh3)(PPhCPhCPh)]","","","- C58 H41 Ir4 O8 P3 -","- C58 H40 Ir4 O8 P3 -","- C232 H160 Ir16 O32 P12 -","4","1","","Hitchcock, Peter B.; Nixon, John F.; Vargas, Maria D.; Ziglio, Cláudio M.","1,2,3-Triphenylphosphirene derivatives of the iridium carbonyl clusters [HIr4(CO)9L(μ-PPh2)] (L = CO, PPh3) resulting from substitution, insertion and hydrometallation processes †","Journal of the Chemical Society, Dalton Transactions","2000","","15","2527","","10.1039/b003002n","","","0.71073","MoKα","","0.0981","0.0585","","","0.1301","0.1502","","","","","","1.02","","","","has coordinates,has disorder","179801","2020-10-21","18:00:00",""
"7009712","15.174","0.006","20.952","0.005","17.733","0.006","90","","109.27","0.03","90","","5322","3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","[HIr4(CO)7(PPH2)(PPh3)(PPhCPhCPh)]","","","- C57 H41 Ir4 O7 P3 -","- C57 H40 Ir4 O7 P3 -","- C228 H160 Ir16 O28 P12 -","4","1","","Hitchcock, Peter B.; Nixon, John F.; Vargas, Maria D.; Ziglio, Cláudio M.","1,2,3-Triphenylphosphirene derivatives of the iridium carbonyl clusters [HIr4(CO)9L(μ-PPh2)] (L = CO, PPh3) resulting from substitution, insertion and hydrometallation processes †","Journal of the Chemical Society, Dalton Transactions","2000","","15","2527","","10.1039/b003002n","","","0.71073","MoKα","","0.1798","0.0788","","","0.127","0.1607","","","","","","0.982","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009713","22.206","0.004","17.563","0.002","35.748","0.005","90","","100.08","0.02","90","","13727","4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[Ir4(CO)8(PPh2)(PHPCPhCPh)(PhPCPhCHPh)]","","","- C60 H41 Ir4 O8 P3 -","- C60 H41 Ir4 O8 P3 -","- C480 H328 Ir32 O64 P24 -","8","2","","Hitchcock, Peter B.; Nixon, John F.; Vargas, Maria D.; Ziglio, Cláudio M.","1,2,3-Triphenylphosphirene derivatives of the iridium carbonyl clusters [HIr4(CO)9L(μ-PPh2)] (L = CO, PPh3) resulting from substitution, insertion and hydrometallation processes †","Journal of the Chemical Society, Dalton Transactions","2000","","15","2527","","10.1039/b003002n","","","0.71073","MoKα","","0.198","0.0861","","","0.1923","0.2466","","","","","","1.012","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009714","12.2575","0.0003","18.6562","0.0004","19.2753","0.0006","90","","107.346","0.002","90","","4207.38","0.19","293","2","293","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","IR10PP1","","","- C41 H26 Ir4 O9 P2 -","- C41 H26 Ir4 O9 P2 -","- C164 H104 Ir16 O36 P8 -","4","1","","Hitchcock, Peter B.; Nixon, John F.; Vargas, Maria D.; Ziglio, Cláudio M.","1,2,3-Triphenylphosphirene derivatives of the iridium carbonyl clusters [HIr4(CO)9L(μ-PPh2)] (L = CO, PPh3) resulting from substitution, insertion and hydrometallation processes †","Journal of the Chemical Society, Dalton Transactions","2000","","15","2527","","10.1039/b003002n","","x-ray","0.71073","MoKα","","0.051","0.034","","","0.0675","0.0737","","","","","","1.046","","","","has coordinates,has disorder","179801","2020-10-21","18:00:00",""
"7009715","14.374","0.001","16.115","0.001","16.641","0.001","98.12","0.01","98.35","0.01","101.83","0.01","3674.1","0.5","173","2","173","2","","","","","","","","6","P 1","P 1","1","","","","- C75.5 H77 Ag2 O11 P3 Re2 -","- C75.5 H77 Ag2 O11 P3 Re2 -","- C151 H154 Ag4 O22 P6 Re4 -","2","2","","Haupt, Hans-Jürgen; Seewald, Oliver; Flörke, Ulrich; Buß, Volker; Weyhermüller, Thomas","Diastereomeric metallatetrahedron complexes of the type Re2(AgPR3)2(μ-PCy2)(CO)7Z (R = Et and Ph; Z = (−)- and (+)-camphanate): synthesis, structure and CD data","Journal of the Chemical Society, Dalton Transactions","2000","","16","2837","","10.1039/b003013i","","","0.71073","MoKα","","0.0997","0.0478","","","0.0909","0.1001","","","","","","0.935","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009716","14.723","0.008","16.244","0.004","16.665","0.004","98.26","0.01","100.47","0.02","101.69","0.02","3770","2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C66 H66 Ag2 Cl3 O11 P3 Re2 -","- C65.78 H65 Ag2 Cl2.34 O11 P3 Re2 -","- C131.56 H130 Ag4 Cl4.68 O22 P6 Re4 -","2","1","","Haupt, Hans-Jürgen; Seewald, Oliver; Flörke, Ulrich; Buß, Volker; Weyhermüller, Thomas","Diastereomeric metallatetrahedron complexes of the type Re2(AgPR3)2(μ-PCy2)(CO)7Z (R = Et and Ph; Z = (−)- and (+)-camphanate): synthesis, structure and CD data","Journal of the Chemical Society, Dalton Transactions","2000","","16","2837","","10.1039/b003013i","","","0.71073","MoKα","","0.1678","0.0782","","","0.207","0.2909","","","","","","1.009","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009717","7.5219","0.0019","28.593","0.007","7.7246","0.0019","90","","106.345","0.004","90","","1594.2","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-bis(tris(2-Amineoethyl)amine-cadmium(ii)) hexacyano-iron(ii) trihydrate","","- C99 Cd11 Fe10.5 N77 O33 -","- C18 Cd2 Fe N14 O6 -","- C36 Cd4 Fe2 N28 O12 -","2","0.5","","Zhang, Hao; Cai, Jiwen; Feng, Xiao-Long; Ye, Bao-Hui; Li, Xiao-Yuan; Ji, Liang-Nian","A novel μ3-cyano-bridged heterotrimetallic 2-D coordination polymer constructed from rectangular grids","Journal of the Chemical Society, Dalton Transactions","2000","","11","1687","","10.1039/b003058i","","","0.71073","MoKα","","0.0441","0.0425","","","0.1085","0.1093","","","","","","1.18","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009718","16.97","0.001","29.369","0.002","16.552","0.001","90","","116.022","0.003","90","","7413.1","0.8","293","2","293","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C12 H16 Ag F6 N4 Sb -","- C12 H16 Ag F6 N4 Sb -","- C192 H256 Ag16 F96 N64 Sb16 -","16","4","","Carlucci, Lucia; Ciani, Gianfranco; Proserpio, Davide M.; Rizzato, Silvia","New examples of self-catenation in two three-dimensional polymeric co-ordination networks †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3821","","10.1039/b003092i","","","0.71073","MoKα","","0.0575","0.0466","","0.1312","0.1253","","","","0.963","","","","","","","has coordinates,has disorder","179801","2020-10-21","18:00:00",""
"7009719","13.057","0.001","23.092","0.003","19.966","0.002","90","","106.095","0.003","90","","5784","1.1","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C24 H34 Cu N4 O9 S -","- C24 H24 Cu N4 O9 S -","- C192 H192 Cu8 N32 O72 S8 -","8","1","","Carlucci, Lucia; Ciani, Gianfranco; Proserpio, Davide M.; Rizzato, Silvia","New examples of self-catenation in two three-dimensional polymeric co-ordination networks †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3821","","10.1039/b003092i","","","0.71073","MoKα","","0.1274","0.0782","","0.2527","0.2204","","","","1.04","","","","","","","has coordinates,has disorder","179801","2020-10-21","18:00:00",""
"7009720","11.62","0.008","24.487","0.013","10.296","0.006","90","","114.54","0.03","90","","2665","3","150","","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H22 Cl2 Co N5 O10 -","- C26 H22 Cl2 Co N5 O10 -","- C104 H88 Cl8 Co4 N20 O40 -","4","1","","Hartshorn, Richard M.; Telfer, Shane G.","The photodecarboxylation of [N,N-bis(2-pyridylmethyl)amino acidato]phenanthrolinecobalt(III) complexes: ‒ formation and decomposition of metallacyclic species †","Journal of the Chemical Society, Dalton Transactions","2000","","16","2801","","10.1039/b003095n","","","0.71073","MoKα","","0.056","0.0351","","","0.0888","0.0933","","","","","","0.94","","","","has coordinates","206958","2020-10-21","18:00:00",""
"7009721","18.158","0.005","8.978","0.002","34.173","0.009","90","","90","","90","","5571","2","159","2","159","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C25 H22 Cl2 Co N5 O9 -","- C25 H22 Cl2 Co N5 O9 -","- C200 H176 Cl16 Co8 N40 O72 -","8","2","","Hartshorn, Richard M.; Telfer, Shane G.","The photodecarboxylation of [N,N-bis(2-pyridylmethyl)amino acidato]phenanthrolinecobalt(III) complexes: ‒ formation and decomposition of metallacyclic species †","Journal of the Chemical Society, Dalton Transactions","2000","","16","2801","","10.1039/b003095n","","","0.71073","MoKα","","0.0763","0.0431","","","0.1006","0.1077","","","","","","0.882","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009722","21.652","0.01","11.32","0.005","12.352","0.006","90","","114.142","0.006","90","","2763","2","168","2","168","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C48 H42 Cl4 Co2 N10 O18 -","- C48 H42 Cl4 Co2 N10 O18 -","- C96 H84 Cl8 Co4 N20 O36 -","2","0.25","","Hartshorn, Richard M.; Telfer, Shane G.","The photodecarboxylation of [N,N-bis(2-pyridylmethyl)amino acidato]phenanthrolinecobalt(III) complexes: ‒ formation and decomposition of metallacyclic species †","Journal of the Chemical Society, Dalton Transactions","2000","","16","2801","","10.1039/b003095n","","","0.71073","MoKα","","0.1033","0.0497","","","0.1017","0.1109","","","","","","0.823","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009723","15.898","0.002","22.118","0.002","11.95","0.001","94.89","0.02","96.11","0.01","105.5","0.02","3997.7","0.8","294.2","","","","","","","","","","","7","P -1","-P 1","2","","","","- C65 H42 Ir7 N O23 P2 Ru3 -","- C65 Ir7 N O23 P2 Ru3 -","- C130 Ir14 N2 O46 P4 Ru6 -","2","1","","Chihara, Teiji; Sato, Mayumi; Konomoto, Hiromi; Kamiguchi, Satoshi; Ogawa, Haruo; Wakatsuki, Yasuo","Synthesis and characterization of high-nuclearity iridium‒ruthenium and ‒gold mixed-metal carbonyl clusters, [Ir7Ru3(CO)23]−, [Ir7Ru3(CO)23(AuPPh3)] and [Ir6Ru3(CO)21(AuPPh3)]−, possessing tetrahedrally capped octahedral iridium cores obtained by capping reactions with [Ru3(CO)12] and [AuCl(PPh3)]","Journal of the Chemical Society, Dalton Transactions","2000","","14","2295","","10.1039/b003100n","","","0.7107","MoKα","","","0.0419","","","","0.0482","","","","","","0.452","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009724","17.271","0.002","17.957","0.004","21.029","0.003","90","","111.52","0.01","90","","6067.2","1.8","294.2","","","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C43 H19 Au Cl4 Ir7 O23 P Ru3 -","- C42.45 Au Cl2.9 Ir7 O23 P Ru3 -","- C169.8 Au4 Cl11.6 Ir28 O92 P4 Ru12 -","4","1","","Chihara, Teiji; Sato, Mayumi; Konomoto, Hiromi; Kamiguchi, Satoshi; Ogawa, Haruo; Wakatsuki, Yasuo","Synthesis and characterization of high-nuclearity iridium‒ruthenium and ‒gold mixed-metal carbonyl clusters, [Ir7Ru3(CO)23]−, [Ir7Ru3(CO)23(AuPPh3)] and [Ir6Ru3(CO)21(AuPPh3)]−, possessing tetrahedrally capped octahedral iridium cores obtained by capping reactions with [Ru3(CO)12] and [AuCl(PPh3)]","Journal of the Chemical Society, Dalton Transactions","2000","","14","2295","","10.1039/b003100n","","","0.7107","MoKα","","","0.0507","","","","0.0543","","","","","","1.699","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009725","16.819","0.009","17.188","0.004","16.321","0.003","110.74","0.02","112.47","0.03","64.29","0.04","3827","3","294.2","","","","","","","","","","","7","P -1","-P 1","2","","","","- C63 H36 Au Ir6 O21 P2 Ru3 -","- C63 Au Ir6 O21 P2 Ru3 -","- C126 Au2 Ir12 O42 P4 Ru6 -","2","1","","Chihara, Teiji; Sato, Mayumi; Konomoto, Hiromi; Kamiguchi, Satoshi; Ogawa, Haruo; Wakatsuki, Yasuo","Synthesis and characterization of high-nuclearity iridium‒ruthenium and ‒gold mixed-metal carbonyl clusters, [Ir7Ru3(CO)23]−, [Ir7Ru3(CO)23(AuPPh3)] and [Ir6Ru3(CO)21(AuPPh3)]−, possessing tetrahedrally capped octahedral iridium cores obtained by capping reactions with [Ru3(CO)12] and [AuCl(PPh3)]","Journal of the Chemical Society, Dalton Transactions","2000","","14","2295","","10.1039/b003100n","","","0.7107","MoKα","","","0.0637","","","","0.0694","","","","","","0.615","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009726","10.8264","0.0011","8.1432","0.0008","13.7698","0.0013","90","","95.104","0.002","90","","1209.2","0.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C4 H16 Al N3 O8 P2 -","- C4 H16 Al N3 O8 P2 -","- C16 H64 Al4 N12 O32 P8 -","4","1","","Wei, Bo; Yu, Jihong; Shi, Zhan; Qiu, Shilun; Li, Jiyang","A new layered aluminophosphate [Al2P4O16][C6H22N4][C2H10N2] with 4.12-net porous sheets","Journal of the Chemical Society, Dalton Transactions","2000","","13","1979","","10.1039/b003153o","","","0.71073","MoKα","","0.0327","0.0285","","","0.0836","0.0863","","","","","","1.083","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009727","14.461","0.005","9.755","0.004","15.217","0.005","90","","109.74","0.03","90","","2020.5","1.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C23 H18 O5 Ru2 -","- C23 H18 O5 Ru2 -","- C92 H72 O20 Ru8 -","4","1","","King, Philip J.; Knox, Selby A. R.; McCormick, Gillian J.; Orpen, A. Guy","Synthesis and reactivity of dimetallacyclopentenone complexes [Ru2(CO)(μ-CO){μ-C(O)CR1CR2}(η-C5H5)2] (R1 = Me or Ph; R2 = CO2Me)","Journal of the Chemical Society, Dalton Transactions","2000","","17","2975","","10.1039/b003156i","","","0.71073","MoKα","","0.0274","0.0241","","","0.0598","0.0612","","","","","","1.148","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009728","9.2578","0.0019","10.657","0.002","15.409","0.003","71.22","0.03","81.21","0.03","82.32","0.03","1416.6","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C29 H24 Cl2 O5 Ru3 -","- C29 H24 Cl2 O5 Ru3 -","- C58 H48 Cl4 O10 Ru6 -","2","1","","King, Philip J.; Knox, Selby A. R.; McCormick, Gillian J.; Orpen, A. Guy","Synthesis and reactivity of dimetallacyclopentenone complexes [Ru2(CO)(μ-CO){μ-C(O)CR1CR2}(η-C5H5)2] (R1 = Me or Ph; R2 = CO2Me)","Journal of the Chemical Society, Dalton Transactions","2000","","17","2975","","10.1039/b003156i","","","0.71073","MoKα","","0.0458","0.0371","","","0.093","0.0974","","","","","","1.051","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009729","18.184","0.004","11.865","0.003","18.251","0.004","90","","117.118","0.005","90","","3504.8","1.4","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C13 H15 B2 F8 N O2 Ru -","- C13 H15 B2 F8 N O2 Ru -","- C104 H120 B16 F64 N8 O16 Ru8 -","8","2","","Braga, Dario; Cojazzi, Gianna; Abati, Alexander; Maini, Lucia; Polito, Marco; Scaccianoce, Laura; Grepioni, Fabrizia","Making and converting organometallic pseudo-polymorphs via non-solution methods †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3969","","10.1039/b003160g","","","0.71073","MoKα","","0.1039","0.054","","","0.1267","0.1546","","","","","","0.881","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009730","8.292","0.001","8.292","0.001","12.537","0.001","90","","90","","120","","746.52","0.14","223","2","223","2","","","","","","","","5","P 63/m m c","-P 6c 2c","194","","","","- C12 H12 B2 F8 Ru -","- C12 H12 B2 F8 Ru -","- C24 H24 B4 F16 Ru2 -","2","0.0833333","","Braga, Dario; Cojazzi, Gianna; Abati, Alexander; Maini, Lucia; Polito, Marco; Scaccianoce, Laura; Grepioni, Fabrizia","Making and converting organometallic pseudo-polymorphs via non-solution methods †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3969","","10.1039/b003160g","","","0.71073","MoKα","","0.0235","0.0227","","","0.0601","0.0618","","","","","","0.696","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009731","9.9845","0.0019","11.1965","0.0007","13.035","0.0013","66.944","0.008","86.003","0.013","65.861","0.012","1216.4","0.3","296","","296","","","","","","","","","4","P -1","-P 1","2","phenanthroline-molrac","","","?","- C30 H28 N2 O5 -","- C60 H56 N4 O10 -","2","1","","Kelso, Laurence S.; Smith, Trevor A.; Schultz, Austin C.; Junk, Peter C.; Warrener, Ronald N.; Ghiggino, Kenneth P.; Keene, F. Richard","Electron and energy transfer within dyads involving polypyridyl-ruthenium(II) and -osmium(II) centres separated by rigid alicyclic bridges","Journal of the Chemical Society, Dalton Transactions","2000","","15","2599","","10.1039/b003174g","","","0.71073","xray_tube","","0.103","0.055","","0.064","0.061","","","","2.161","2.637","2.637","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009732","14.831","0.001","6.901","0.001","11.379","0.001","90","","90","","90","","1164.6","0.2","293","2","293","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C6 H10 N4 O4 S2 Zn -","- C6 H10 N4 O4 S2 Zn -","- C24 H40 N16 O16 S8 Zn4 -","4","0.5","","Burrows, Andrew D.; Harrington, Ross W.; Mahon, Mary F.; Price, Caroline E.","The influence of hydrogen bonding on the structure of zinc co-ordination polymers †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3845","","10.1039/b003210g","","","0.71069","MoKα","","0.0248","0.0202","","0.0818","0.0719","","","","0.66","0.665","0.665","","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009733","7.5617","0.0009","8.164","0.001","18.34","0.002","90","","91.4","0.02","90","","1131.9","0.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C5 H10 N4 O4 S2 Zn -","- C5 H10 N4 O4 S2 Zn -","- C20 H40 N16 O16 S8 Zn4 -","4","1","","Burrows, Andrew D.; Harrington, Ross W.; Mahon, Mary F.; Price, Caroline E.","The influence of hydrogen bonding on the structure of zinc co-ordination polymers †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3845","","10.1039/b003210g","","","0.71069","MoKα","","0.0302","0.025","","","0.0641","0.0662","","","","","","1.041","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009734","20.257","0.003","9.795","0.001","16.303","0.003","90","","94.5","0.02","90","","3224.8","0.8","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C10 H14 N4 O5 S2 Zn -","- C10 H12 N4 O5 S2 Zn -","- C80 H96 N32 O40 S16 Zn8 -","8","1","","Burrows, Andrew D.; Harrington, Ross W.; Mahon, Mary F.; Price, Caroline E.","The influence of hydrogen bonding on the structure of zinc co-ordination polymers †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3845","","10.1039/b003210g","","","0.71069","MoKα","","0.0445","0.0309","","0.1049","0.0964","","","","0.805","0.847","0.847","","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009735","8.36","0.001","10.981","0.002","14.717","0.003","90","","90","","90","","1351","0.4","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C7 H12 N4 O4 S2 Zn -","- C7 H12 N4 O4 S2 Zn -","- C28 H48 N16 O16 S8 Zn4 -","4","1","","Burrows, Andrew D.; Harrington, Ross W.; Mahon, Mary F.; Price, Caroline E.","The influence of hydrogen bonding on the structure of zinc co-ordination polymers †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3845","","10.1039/b003210g","","","0.71069","MoKα","","0.0577","0.0338","","","0.0883","0.0963","","","","","","0.736","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009736","8.307","0.002","10.919","0.002","15.89","0.002","90","","90","","90","","1441.3","0.5","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C10 H12 N4 O4 S2 Zn -","- C10 H12 N4 O4 S2 Zn -","- C40 H48 N16 O16 S8 Zn4 -","4","1","","Burrows, Andrew D.; Harrington, Ross W.; Mahon, Mary F.; Price, Caroline E.","The influence of hydrogen bonding on the structure of zinc co-ordination polymers †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3845","","10.1039/b003210g","","","0.71069","MoKα","","0.0237","0.0214","","","0.0573","0.0591","","","","","","0.689","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009737","12.758","0.003","8.803","0.001","23.355","0.004","90","","98.07","0.15","90","","2597","1.3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C6 H12 N4 O5 S2 Zn -","- C6 H12 N4 O5 S2 Zn -","- C48 H96 N32 O40 S16 Zn8 -","8","1","","Burrows, Andrew D.; Harrington, Ross W.; Mahon, Mary F.; Price, Caroline E.","The influence of hydrogen bonding on the structure of zinc co-ordination polymers †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3845","","10.1039/b003210g","","","0.71069","MoKα","","0.0333","0.0237","","","0.061","0.064","","","","","","1.046","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009739","17.443","0.002","17.443","0.002","17.443","0.002","90","","90","","90","","5307.2","1.1","153","2","153","2","","","","","","","","5","P 21 3","P 2ac 2ab 3","198","","","","- C36 H66 Cl6 N8 O27 -","- C36 H66 Cl6 N8 O27 -","- C144 H264 Cl24 N32 O108 -","4","0.333333","","Hynes, Michael J.; Maubert, Beatrice; McKee, Vickie; Town, Raewyn M.; Nelson, Jane","Protonated azacryptate hosts for nitrate and perchlorate","Journal of the Chemical Society, Dalton Transactions","2000","","16","2853","","10.1039/b003249m","","","0.71073","MoKα","","0.0795","0.0554","","","0.1196","0.1307","","","","","","1.026","","","","has coordinates","288183","2023-12-08","14:43:00",""
"7009740","10.1676","0.0008","10.3453","0.0008","25.51","0.002","80.453","0.002","84.666","0.002","62.182","0.002","2340","0.3","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C36 H64 N14 O20 -","- C36 H62 N14 O20 -","- C72 H124 N28 O40 -","2","1","","Hynes, Michael J.; Maubert, Beatrice; McKee, Vickie; Town, Raewyn M.; Nelson, Jane","Protonated azacryptate hosts for nitrate and perchlorate","Journal of the Chemical Society, Dalton Transactions","2000","","16","2853","","10.1039/b003249m","","","0.6923","","","0.0582","0.0441","","","0.1238","0.1272","","","","","","1.024","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009741","14.993","0.003","14.993","0.003","18.45","0.003","90","","90","","120","","3591.7","1.2","293","2","293","2","","","","","","","","6","P -3 c 1","-P 3 2""c","165","","","","- C48 H106 Fe2 N30 Ni3 O14 -","- C48 H90 Fe2 N30 Ni3 O14 -","- C96 H180 Fe4 N60 Ni6 O28 -","2","0.166667","","Kou, Hui-Zhong; Bu, Wei-Ming; Gao, Song; Liao, Dai-Zheng; Jiang, Zong-Hui; Yan, Shi-Ping; Fan, Yu-Guo; Wang, Geng-Lin","Reactions between macrocyclic nickel(II) complexes and ferricyanide. Metamagnetic properties of a two-dimensional honeycomb assembly [NiL3]3[Fe(CN)6]2·8H2O (L3 = 3,10-dihydroxyethyl-1,3,6,8,10,12-hexaazacyclotetradecane) †","Journal of the Chemical Society, Dalton Transactions","2000","","17","2996","","10.1039/b003289l","","","0.71073","MoKα","","0.0509","0.0456","","0.0721","0.0652","","","","1.169","1.455","1.455","","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009742","31.75","0.005","31.75","0.005","11.158","0.002","90","","90","","120","","9741","3","293","2","293","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C48 H87 Fe2 N33 Ni3 O6 -","- C48 Fe2 N33 Ni3 O6 -","- C288 Fe12 N198 Ni18 O36 -","6","0.333333","","Kou, Hui-Zhong; Bu, Wei-Ming; Gao, Song; Liao, Dai-Zheng; Jiang, Zong-Hui; Yan, Shi-Ping; Fan, Yu-Guo; Wang, Geng-Lin","Reactions between macrocyclic nickel(II) complexes and ferricyanide. Metamagnetic properties of a two-dimensional honeycomb assembly [NiL3]3[Fe(CN)6]2·8H2O (L3 = 3,10-dihydroxyethyl-1,3,6,8,10,12-hexaazacyclotetradecane) †","Journal of the Chemical Society, Dalton Transactions","2000","","17","2996","","10.1039/b003289l","","","0.71073","MoKα","","0.0561","0.0448","","0.0691","0.0611","","","","0.911","0.974","0.974","","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009743","9.716","0.003","7.74","0.002","17.28","0.006","90","","101.67","0.03","90","","1272.6","0.7","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H20 Fe N14 O6 -","- C20 H20 Fe N14 O6 -","- C40 H40 Fe2 N28 O12 -","2","0.5","","Anderson, Peter A.; Astley, Timothy; Hitchman, Michael A.; Keene, F. Richard; Moubaraki, Boujemaa; Murray, Keith S.; Skelton, Brian W.; Tiekink, Edward R. T.; Toftlund, Hans; White, Allan H.","Structures and spectra of bis-tripodal iron(II) chelates, [FeL2]2+, where L = tris(pyrazol-1-yl)methane, tris(pyridin-2-yl)methane, bis(pyrazol-1-yl)(pyridin-2-yl)methane and tris(pyridin-2-yl)phosphine oxide. Magnetism and spin crossover in the (pz)3CH case","Journal of the Chemical Society, Dalton Transactions","2000","","20","3505","","10.1039/b003299i","","","0.71073","MoKα","","0.059","0.047","","0.058","","0.056","","","1.457","","","1.69","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009744","7.739","0.004","9.969","0.001","16.321","0.002","90","","104.21","0.03","90","","1220.6","0.7","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H20 Fe N14 O6 -","- C20 H20 Fe N14 O6 -","- C40 H40 Fe2 N28 O12 -","2","0.5","","Anderson, Peter A.; Astley, Timothy; Hitchman, Michael A.; Keene, F. Richard; Moubaraki, Boujemaa; Murray, Keith S.; Skelton, Brian W.; Tiekink, Edward R. T.; Toftlund, Hans; White, Allan H.","Structures and spectra of bis-tripodal iron(II) chelates, [FeL2]2+, where L = tris(pyrazol-1-yl)methane, tris(pyridin-2-yl)methane, bis(pyrazol-1-yl)(pyridin-2-yl)methane and tris(pyridin-2-yl)phosphine oxide. Magnetism and spin crossover in the (pz)3CH case","Journal of the Chemical Society, Dalton Transactions","2000","","20","3505","","10.1039/b003299i","","","0.71073","MoKα","","0.067","0.044","","0.05","","0.045","","","1.421","","","1.586","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009745","8.539","0.004","10.405","0.004","16.5","0.01","90","","102.99","0.04","90","","1428.5","1.2","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H26 Fe N8 O6 -","- C32 H26 Fe N8 O6 -","- C64 H52 Fe2 N16 O12 -","2","0.5","","Anderson, Peter A.; Astley, Timothy; Hitchman, Michael A.; Keene, F. Richard; Moubaraki, Boujemaa; Murray, Keith S.; Skelton, Brian W.; Tiekink, Edward R. T.; Toftlund, Hans; White, Allan H.","Structures and spectra of bis-tripodal iron(II) chelates, [FeL2]2+, where L = tris(pyrazol-1-yl)methane, tris(pyridin-2-yl)methane, bis(pyrazol-1-yl)(pyridin-2-yl)methane and tris(pyridin-2-yl)phosphine oxide. Magnetism and spin crossover in the (pz)3CH case","Journal of the Chemical Society, Dalton Transactions","2000","","20","3505","","10.1039/b003299i","","","0.7107","Mo_Kα","","","0.0371","","","0.0438","","","","","2.438","2.438","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009746","11.129","0.003","13.699","0.003","11.239","0.003","90","","92.04","0.02","90","","1712.4","0.8","293","","293","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C34 H30 Fe N10 O8 P2 -","- C34 H30 Fe N10 O8 P2 -","- C68 H60 Fe2 N20 O16 P4 -","2","0.5","","Anderson, Peter A.; Astley, Timothy; Hitchman, Michael A.; Keene, F. Richard; Moubaraki, Boujemaa; Murray, Keith S.; Skelton, Brian W.; Tiekink, Edward R. T.; Toftlund, Hans; White, Allan H.","Structures and spectra of bis-tripodal iron(II) chelates, [FeL2]2+, where L = tris(pyrazol-1-yl)methane, tris(pyridin-2-yl)methane, bis(pyrazol-1-yl)(pyridin-2-yl)methane and tris(pyridin-2-yl)phosphine oxide. Magnetism and spin crossover in the (pz)3CH case","Journal of the Chemical Society, Dalton Transactions","2000","","20","3505","","10.1039/b003299i","","","0.7107","MoKα","","","0.048","","","0.054","","","","","1.07","1.07","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009747","3.8105","0.0016","15.819","0.007","13.311","0.006","90","","96.045","0.007","90","","797.9","0.6","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C7 H7 Cl Cu N O2 -","- C7 H7 Cl Cu N O2 -","- C28 H28 Cl4 Cu4 N4 O8 -","4","1","","Aakeröy, Christer B.; Beatty, Alicia M.; Lorimer, Keith R.","Assembly of 2-D inorganic/organic lamellar structures through a combination of copper(I) coordination polymers and self-complementary hydrogen bonds †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3869","","10.1039/b003306p","","","0.71073","MoKα","","0.1101","0.0783","","","0.1873","0.1999","","","","","","0.994","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009748","4.0964","0.0011","13.656","0.005","16.114","0.005","90","","92.225","0.006","90","","900.7","0.5","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C7 H7 Cu I N O2 -","- C7 H7 Cu I N O2 -","- C28 H28 Cu4 I4 N4 O8 -","4","1","","Aakeröy, Christer B.; Beatty, Alicia M.; Lorimer, Keith R.","Assembly of 2-D inorganic/organic lamellar structures through a combination of copper(I) coordination polymers and self-complementary hydrogen bonds †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3869","","10.1039/b003306p","","","0.71073","MoKα","","0.0757","0.0612","","","0.1598","0.1676","","","","","","1.089","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009749","9.402","0.001","14.365","0.002","19.363","0.002","90","","96.504","0.002","90","","2598.3","0.5","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H38 Ba Cl2 N6 O10 -","- C16 H38 Ba Cl2 N6 O9.98 -","- C64 H152 Ba4 Cl8 N24 O39.92 -","4","1","","Tei, Lorenzo; Blake, Alexander J.; Bencini, Andrea; Valtancoli, Barbara; Wilson, Claire; Schröder, Martin","Synthesis, solution studies and structural characterisation of complexes of a mixed oxa‒aza macrocycle bearing pendant amino arms","Journal of the Chemical Society, Dalton Transactions","2000","","22","4122","","10.1039/b003352i","","","0.71073","MoKα","","0.0935","0.0387","","","0.0541","0.0625","","","","","","0.816","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"7009750","9.2446","0.0013","13.129","0.002","20.653","0.003","90","","101.116","0.011","90","","2459.7","0.6","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H38 Cl2 Cu N6 O10 -","- C16 H38 Cl2 Cu N6 O9.95 -","- C64 H152 Cl8 Cu4 N24 O39.8 -","4","1","","Tei, Lorenzo; Blake, Alexander J.; Bencini, Andrea; Valtancoli, Barbara; Wilson, Claire; Schröder, Martin","Synthesis, solution studies and structural characterisation of complexes of a mixed oxa‒aza macrocycle bearing pendant amino arms","Journal of the Chemical Society, Dalton Transactions","2000","","22","4122","","10.1039/b003352i","","","0.71073","MoKα","","0.0579","0.0449","","","0.1035","0.1135","","","","","","1.032","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"7009751","9.273","0.005","13.154","0.008","20.692","0.013","90","","101.24","0.05","90","","2476","3","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H38 Cl2 N6 O10 Zn -","- C16 H38 Cl2 N6 O10 Zn -","- C64 H152 Cl8 N24 O40 Zn4 -","4","1","","Tei, Lorenzo; Blake, Alexander J.; Bencini, Andrea; Valtancoli, Barbara; Wilson, Claire; Schröder, Martin","Synthesis, solution studies and structural characterisation of complexes of a mixed oxa‒aza macrocycle bearing pendant amino arms","Journal of the Chemical Society, Dalton Transactions","2000","","22","4122","","10.1039/b003352i","","","0.71073","MoKα","","0.1348","0.0755","","","0.1236","0.1552","","","","","","1.213","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"7009752","10.816","0.008","15.486","0.009","15.844","0.01","90","","98.59","0.06","90","","2624","3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H38 Cl2 N6 O10 Pb -","- C16 H38 Cl2 N6 O10 Pb -","- C64 H152 Cl8 N24 O40 Pb4 -","4","1","","Tei, Lorenzo; Blake, Alexander J.; Bencini, Andrea; Valtancoli, Barbara; Wilson, Claire; Schröder, Martin","Synthesis, solution studies and structural characterisation of complexes of a mixed oxa‒aza macrocycle bearing pendant amino arms","Journal of the Chemical Society, Dalton Transactions","2000","","22","4122","","10.1039/b003352i","","","0.71073","MoKα","","0.0926","0.0659","","","0.1635","0.1895","","","","","","1.038","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"7009753","10.097","0.001","10.143","0.001","11.55","0.001","114.325","0.002","98.612","0.002","98.146","0.002","1038.21","0.17","150","2","150","2","","","","","","","","6","P -1","-P 1","2","[CuL](MeOSO3)2","","","- C10 H24 Cu N8 O10 S2 -","- C10 H24 Cu N8 O10 S2 -","- C20 H48 Cu2 N16 O20 S4 -","2","1","","Blake, Alexander J.; Hubberstey, Peter; Suksangpanya, Unchulee; Wilson, Claire L.","Anion recognition by conservation of hydrogen-bonding patterns in salts of copper(II) co-ordinated by tetradentate bis(amidino-O-alkylurea) ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3873","","10.1039/b003427o","","","0.71073","MoKα","","0.0585","0.0411","","","0.1","0.1072","","","","","","0.974","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009754","14.246","0.002","8.2144","0.0011","21.292","0.003","90","","100.214","0.002","90","","2452.2","0.6","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","[CuL](EtOSO3)2","","","- C14 H32 Cu N8 O10 S2 -","- C14 H32 Cu N8 O10 S2 -","- C56 H128 Cu4 N32 O40 S8 -","4","1","","Blake, Alexander J.; Hubberstey, Peter; Suksangpanya, Unchulee; Wilson, Claire L.","Anion recognition by conservation of hydrogen-bonding patterns in salts of copper(II) co-ordinated by tetradentate bis(amidino-O-alkylurea) ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3873","","10.1039/b003427o","","","0.71073","MoKα","","0.0679","0.0387","","","0.0756","0.0837","","","","","","0.93","","","","has coordinates,has disorder","179801","2020-10-21","18:00:00",""
"7009755","8.3861","0.0007","11.791","0.001","12.552","0.001","93.835","0.002","108.332","0.002","104.004","0.002","1129.28","0.16","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C12 H31 Cl Cu N8 O8 S -","- C12 H31 Cl Cu N8 O8 S -","- C24 H62 Cl2 Cu2 N16 O16 S2 -","2","1","","Blake, Alexander J.; Hubberstey, Peter; Suksangpanya, Unchulee; Wilson, Claire L.","Anion recognition by conservation of hydrogen-bonding patterns in salts of copper(II) co-ordinated by tetradentate bis(amidino-O-alkylurea) ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3873","","10.1039/b003427o","","","0.71073","MoKα","","0.0345","0.0297","","","0.0822","0.0842","","","","","","1.063","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009756","12.646","0.001","23.715","0.003","17.944","0.002","90","","103.2","0.1","90","","5239","2","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C55 H53 N4 O7 Yb -","- C55 H53 N4 O7 Yb -","- C220 H212 N16 O28 Yb4 -","4","1","","Wong, Wai-Kwok; Zhang, Li-Lu; Xue, Feng; Mak, Thomas C. W.","Synthesis and X-ray crystal structure of an unexpected neutral oxalate-bridged ytterbium(III) porphyrinate dimer","Journal of the Chemical Society, Dalton Transactions","2000","","14","2245","","10.1039/b003434g","","","0.71073","MoKα","","0.0721","0.0634","","","0.1546","0.1617","","","","","","1.064","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009757","16.5599","0.0016","14.2742","0.0014","16.7199","0.0016","90","","91.773","0.007","90","","3950.3","0.7","220","2","220","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C35 H52 Cl2 N6 Ni O10 -","- C35 H52 Cl2 N6 Ni O10 -","- C140 H208 Cl8 N24 Ni4 O40 -","4","1","","Miller, Hamish A.; Laing, Norman; Parsons, Simon; Parkin, Andrew; Tasker, Peter A.; White, David J.","Supramolecular assemblies from ditopic ligands and transition metal salts †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3773","","10.1039/b003436n","","","0.71073","MoKα","","0.1061","0.0519","","","0.1004","0.1189","","","","","","1.003","","","","has coordinates,has disorder","179801","2020-10-21","18:00:00",""
"7009758","24.786","0.003","12.9082","0.0015","26.542","0.004","90","","91.715","0.018","90","","8488.1","1.9","220","2","220","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C41 H63 N4 O4 -","- C38 H56 N4 O4 -","- C304 H448 N32 O32 -","8","1","","Miller, Hamish A.; Laing, Norman; Parsons, Simon; Parkin, Andrew; Tasker, Peter A.; White, David J.","Supramolecular assemblies from ditopic ligands and transition metal salts †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3773","","10.1039/b003436n","","","1.54178","CuKα","","0.132","0.0719","","","0.1762","0.2058","","","","","","0.944","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"7009759","11.108","0.005","14.319","0.007","16.23","0.011","99.26","0.03","107.95","0.03","98.71","0.03","2368","2","220","2","220","2","","","","","","","","7","P -1","-P 1","2","","","","- C40 H58 Cl6 N4 Ni O8 S -","- C38 H56 N4 Ni O8 S -","- C76 H112 N8 Ni2 O16 S2 -","2","1","","Miller, Hamish A.; Laing, Norman; Parsons, Simon; Parkin, Andrew; Tasker, Peter A.; White, David J.","Supramolecular assemblies from ditopic ligands and transition metal salts †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3773","","10.1039/b003436n","","","1.54178","CuKα","","0.1724","0.1119","","","0.2884","0.3271","","","","","","1.023","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7009760","7.3052","0.0005","15.1256","0.0014","15.6704","0.0014","72.47","0.003","87.161","0.005","81.267","0.004","1631.9","0.2","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H48 N4 Ni O4 -","- C34 H48 N4 Ni O4 -","- C68 H96 N8 Ni2 O8 -","2","1","","Miller, Hamish A.; Laing, Norman; Parsons, Simon; Parkin, Andrew; Tasker, Peter A.; White, David J.","Supramolecular assemblies from ditopic ligands and transition metal salts †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3773","","10.1039/b003436n","","","0.71073","MoKα","","0.163","0.0623","","","0.1087","0.1362","","","","","","0.935","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"7009761","18.9754","0.0004","12.8666","0.0003","19.7197","0.0004","90","","118.571","0.001","90","","4228.25","0.16","150","2","150","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C37.75 H65 N4 Ni O11.75 S -","- C34 H50 N4 Ni O8 S -","- C136 H200 N16 Ni4 O32 S4 -","4","1","","Miller, Hamish A.; Laing, Norman; Parsons, Simon; Parkin, Andrew; Tasker, Peter A.; White, David J.","Supramolecular assemblies from ditopic ligands and transition metal salts †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3773","","10.1039/b003436n","","","0.71073","MoKα","","0.0736","0.0502","","","0.1358","0.1457","","","","","","1.084","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7009762","15.0989","0.0007","20.3404","0.001","15.1155","0.0007","90","","97.982","0.001","90","","4597.3","0.4","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H17 Cd N2 O4.5 S2 -","- C24 H17 Cd N2 O4.5 S2 -","- C192 H136 Cd8 N16 O36 S16 -","8","2","","Evans, Owen R.; Lin, Wenbin","Towards rational synthesis of polar solids. Synthesis and X-ray structures of cadmium(II) meta-pyridinecarboxylate coordination polymers †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3949","","10.1039/b003441j","","","0.71073","MoKα","","0.1245","0.0611","","","0.1415","0.1615","","","","","","1.023","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009763","11.4582","0.0017","16.087","0.002","25.536","0.004","90","","91.23","0.003","90","","4705.9","1.2","198","2","198","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H19 Cd N2 O4.5 -","- C28 H21 Cd N2 O4.5 -","- C224 H168 Cd8 N16 O36 -","8","1","","Evans, Owen R.; Lin, Wenbin","Towards rational synthesis of polar solids. Synthesis and X-ray structures of cadmium(II) meta-pyridinecarboxylate coordination polymers †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3949","","10.1039/b003441j","","","0.71073","MoKα","","0.1224","0.0661","","","0.1733","0.2034","","","","","","0.98","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009764","9.973","0.005","10.824","0.005","23.584","0.015","90","","100.23","0.06","90","","2505","2","293","2","200","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C52 H28 Br4 Cl4 Mn N8 -","- C52 H28 Br4 Cl4 Mn N8 -","- C104 H56 Br8 Cl8 Mn2 N16 -","2","0.5","","Rittenberg, Durrell K.; Arif, Atta M.; Miller, Joel S.","Effect of thermal annealing on the ferrimagnetic behavior and ordering of the [MnTXPP]+[TCNE]˙−·solv (X = F, Cl, Br, I; solv = PhMe, CH2Cl2) family of magnets","Journal of the Chemical Society, Dalton Transactions","2000","","21","3939","","10.1039/b003458o","","","0.71073","MoKα","","0.0569","0.0569","","","0.1484","0.1484","","","","","","1.121","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009765","17.149","0.005","17.903","0.005","10.066","0.004","90","","90","","90","","3090.4","1.8","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C33 H40 Cl2 N P Ru -","- C33 H40 Cl2 N P Ru -","- C132 H160 Cl8 N4 P4 Ru4 -","4","1","","Arena, Carmela G.; Calamia, Stefania; Faraone, Felice; Graiff, Claudia; Tiripicchio, Antonio","(η6-Arene)ruthenium(II) complexes containing enantiomerically pure (β-aminoalkyl)phosphines or a (β-aminoalkyl) phosphinite: synthesis, stereochemical and kinetic studies","Journal of the Chemical Society, Dalton Transactions","2000","","18","3149","","10.1039/b003514i","","","0.71073","MoKα","","0.0519","0.0306","","","0.0551","0.0603","","","","","","0.868","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009766","10.866","0.004","24.897","0.005","11.912","0.004","90","","90","","90","","3222.6","1.7","293","2","293","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C32 H38 B Cl F4 N P Ru -","- C32 H38 B Cl F4 N P Ru -","- C128 H152 B4 Cl4 F16 N4 P4 Ru4 -","4","1","","Arena, Carmela G.; Calamia, Stefania; Faraone, Felice; Graiff, Claudia; Tiripicchio, Antonio","(η6-Arene)ruthenium(II) complexes containing enantiomerically pure (β-aminoalkyl)phosphines or a (β-aminoalkyl) phosphinite: synthesis, stereochemical and kinetic studies","Journal of the Chemical Society, Dalton Transactions","2000","","18","3149","","10.1039/b003514i","","","0.71073","MoKα","","0.0338","0.0308","","","0.0806","0.0828","","","","","","1.074","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009767","21.561","0.002","8.188","0.0008","21.932","0.002","90","","116.668","0.002","90","","3460","0.6","294","2","294","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C32.5 H20 Cl Fe3 O6 S2 W2 -","- C32.5 H20 Cl Fe3 O6 S2 W2 -","- C130 H80 Cl4 Fe12 O24 S8 W8 -","4","1","","Mathur, Pradeep; Ahmed, Moawia O.; Dash, Aswini K.; Walawalkar, Mrinalini G.; Puranik, Vedavati G.","Coupling of co-ordinated acetylide ligands with and without CO on chalcogen-stabilised mixed-metal clusters. Synthesis and characterisation of [M2Fe3(L)2(CO)6(μ3-E)2{μ-CC(Ph)C(Ph)C}] and [M2Fe2(L)2(CO)4(μ3-E)2{μ-CC(Ph)(CO)C(Ph)C}] (L = η5-C5Me5 or η5-C5H5, M = Mo or W, E = S, Se or Te)","Journal of the Chemical Society, Dalton Transactions","2000","","17","2916","","10.1039/b003517n","","","0.71073","MoKα","","0.0608","0.0288","","","0.0631","0.0705","","","","","","0.887","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7009768","15.047","0.0003","9.507","0.0001","20.407","0.0004","90","","95.195","0.0009","90","","2907.27","0.09","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Mixed metal cluster","Metal acetylidine complex","","- C15.5 H10 Fe O2.5 S W -","- C15.5 H10 Fe O2.5 S W -","- C124 H80 Fe8 O20 S8 W8 -","8","1","","Mathur, Pradeep; Ahmed, Moawia O.; Dash, Aswini K.; Walawalkar, Mrinalini G.; Puranik, Vedavati G.","Coupling of co-ordinated acetylide ligands with and without CO on chalcogen-stabilised mixed-metal clusters. Synthesis and characterisation of [M2Fe3(L)2(CO)6(μ3-E)2{μ-CC(Ph)C(Ph)C}] and [M2Fe2(L)2(CO)4(μ3-E)2{μ-CC(Ph)(CO)C(Ph)C}] (L = η5-C5Me5 or η5-C5H5, M = Mo or W, E = S, Se or Te)","Journal of the Chemical Society, Dalton Transactions","2000","","17","2916","","10.1039/b003517n","","","0.7107","MoKα","","0.0205","0.0197","","","0.0506","0.0516","","","","","","1.258","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009769","13.38","0.05","19.69","0.05","20.15","0.05","90","","90","","90","","5309","3","293","2","221","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C31 H21 Mo2 O5.5 -","- C31 H20 Mo2 O5.5 -","- C248 H160 Mo16 O44 -","8","1","","Mathur, Pradeep; Ahmed, Moawia O.; Dash, Aswini K.; Walawalkar, Mrinalini G.; Puranik, Vedavati G.","Coupling of co-ordinated acetylide ligands with and without CO on chalcogen-stabilised mixed-metal clusters. Synthesis and characterisation of [M2Fe3(L)2(CO)6(μ3-E)2{μ-CC(Ph)C(Ph)C}] and [M2Fe2(L)2(CO)4(μ3-E)2{μ-CC(Ph)(CO)C(Ph)C}] (L = η5-C5Me5 or η5-C5H5, M = Mo or W, E = S, Se or Te)","Journal of the Chemical Society, Dalton Transactions","2000","","17","2916","","10.1039/b003517n","","","0.71073","","","0.0415","0.0329","","","0.086","0.0892","","","","","","1.085","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009770","9.052","0.001","10.436","0.002","13.422","0.001","78.12","0.01","75.62","0.01","74.97","0.01","1172.6","0.3","163","2","163","2","","","","","","","","6","P -1","-P 1","2","","","","- C3 H9 Au N O3 P -","- C3 H9 Au N O3 P -","- C18 H54 Au6 N6 O18 P6 -","6","3","","Mathieson, Trevor; Schier, Annette; Schmidbaur, Hubert","The solid state aggregation of two gold(I) nitrate complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3881","","10.1039/b003523h","","","0.71073","MoKα","","0.0393","0.0314","","","0.0782","0.0815","","","","","","1.052","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009771","26.7432","0.0009","7.774","0.0003","10.5128","0.0002","90","","110.945","0.002","90","","2041.21","0.11","163","2","163","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C5.5 H10 Au Cl N2 O3 -","- C5.5 H10 Au Cl N2 O3 -","- C44 H80 Au8 Cl8 N16 O24 -","8","1","","Mathieson, Trevor; Schier, Annette; Schmidbaur, Hubert","The solid state aggregation of two gold(I) nitrate complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3881","","10.1039/b003523h","","","0.71073","MoKα","","0.0589","0.0575","","","0.144","0.1457","","","","","","1.198","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009772","13.0351","0.0004","7.7296","0.0002","6.1895","0.0002","90","","90","","90","","623.63","0.03","123","2","123","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","Cuprous dicyanamide acetonitile","","- C4 H3 Cu N4 -","- C4 H3 Cu N4 -","- C16 H12 Cu4 N16 -","4","0.5","","Batten, Stuart R.; Harris, Alexander R.; Jensen, Paul; Murray, Keith S.; Ziebell, Angela","Copper(I) dicyanamide coordination polymers: ladders, sheets, layers, diamond-like networks and unusual interpenetration †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3829","","10.1039/b003527k","","","0.71073","MoKα","","0.0212","0.0186","","","0.0418","0.0425","","","","","","1.119","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009773","3.8969","0.0001","18.5279","0.0009","9.9978","0.0005","90","","92.039","0.003","90","","721.4","0.05","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Cu(dca)(tmp)0.5","Cuprous dicyanamide hemi(tetramethylpyrazine)","","- C6 H6 Cu N4 -","- C6 H6 Cu N4 -","- C24 H24 Cu4 N16 -","4","1","","Batten, Stuart R.; Harris, Alexander R.; Jensen, Paul; Murray, Keith S.; Ziebell, Angela","Copper(I) dicyanamide coordination polymers: ladders, sheets, layers, diamond-like networks and unusual interpenetration †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3829","","10.1039/b003527k","","","0.71073","MoKα","","0.0529","0.0335","","","0.0549","0.0594","","","","","","1.089","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009774","29.5142","0.0007","7.5761","0.0003","11.3905","0.0004","90","","106.141","0.002","90","","2446.55","0.14","123","2","123","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","Di(copper(i)) bis(dicyanamide) 4,4'-bipyridine bis(acetonitrile) hemi(4,4'-bipyridine)","","- C23 H18 Cu2 N11 -","- C23 H14 Cu2 N11 -","- C92 H56 Cu8 N44 -","4","0.5","","Batten, Stuart R.; Harris, Alexander R.; Jensen, Paul; Murray, Keith S.; Ziebell, Angela","Copper(I) dicyanamide coordination polymers: ladders, sheets, layers, diamond-like networks and unusual interpenetration †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3829","","10.1039/b003527k","","","0.71073","MoKα","","0.0753","0.0567","","","0.1618","0.1836","","","","","","1.074","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009775","8.2104","0.0003","10.0447","0.0003","13.9494","0.0004","98.995","0.002","93.178","0.002","101.633","0.002","1108.43","0.06","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","Tetra(copper(I)) tetrakis(dicyanamide) tris(4,4'-bipyridine) bis(acetonitrile)","","- C42 H30 Cu4 N20 -","- C42 H30 Cu4 N20 -","- C42 H30 Cu4 N20 -","1","0.5","","Batten, Stuart R.; Harris, Alexander R.; Jensen, Paul; Murray, Keith S.; Ziebell, Angela","Copper(I) dicyanamide coordination polymers: ladders, sheets, layers, diamond-like networks and unusual interpenetration †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3829","","10.1039/b003527k","","","0.71073","MoKα","","0.0611","0.0378","","","0.0897","0.0997","","","","","","1.042","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009776","7.3835","0.0001","15.214","0.0005","12.1963","0.0004","90","","90","","90","","1370.04","0.07","123","2","123","2","","","","","","","","4","P n a 21","P 2c -2n","33","","alpha - cuprous dicyanamide 1,2-bis(4-pyridyl)ethene","","- C14 H10 Cu N5 -","- C14 H10 Cu N5 -","- C56 H40 Cu4 N20 -","4","1","","Batten, Stuart R.; Harris, Alexander R.; Jensen, Paul; Murray, Keith S.; Ziebell, Angela","Copper(I) dicyanamide coordination polymers: ladders, sheets, layers, diamond-like networks and unusual interpenetration †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3829","","10.1039/b003527k","","","0.71073","MoKα","","0.0324","0.0256","","","0.0519","0.0542","","","","","","1.04","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009777","12.2904","0.0003","44.6752","0.0013","14.6413","0.0003","90","","93.004","0.002","90","","8028.1","0.3","123","2","123","2","","","","","","","","4","C 1 c 1","C -2yc","9","","beta - cuprous dicyanamide 1,2-bis(4-pyridyl)ethene","","- C14 H10 Cu N5 -","- C14 H10 Cu N5 -","- C336 H240 Cu24 N120 -","24","6","","Batten, Stuart R.; Harris, Alexander R.; Jensen, Paul; Murray, Keith S.; Ziebell, Angela","Copper(I) dicyanamide coordination polymers: ladders, sheets, layers, diamond-like networks and unusual interpenetration †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3829","","10.1039/b003527k","","","0.71073","MoKα","","0.0884","0.056","","","0.12","0.1363","","","","","","1.053","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009778","10.367","0.001","26.5","0.002","11.407","0.001","90","","108.77","","90","","2967.1","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H26 N9 O10 Sm -","- C24 H20 N9 O10 Sm -","- C96 H80 N36 O40 Sm4 -","4","1","","Yang, Xiao-Ping; Su, Cheng-Yong; Kang, Bei-Sheng; Feng, Xiao-Long; Xiao, Wang-Leng; Liu, Han-Qin","Studies on lanthanide complexes of the tripodal ligand bis(2-benzimidazolylmethyl)(2-pyridylmethyl)amine. Crystal structures and luminescence properties †","Journal of the Chemical Society, Dalton Transactions","2000","","19","3253","","10.1039/b003566l","","","0.71073","MoKα","","0.0523","0.0343","","","0.0834","0.0896","","","","","","0.996","","","","has coordinates,has disorder","179801","2020-10-21","18:00:00",""
"7009779","10.313","0.001","26.376","0.002","11.368","0.001","90","","109","0.01","90","","2923.8","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H26 Gd N9 O10 -","- C24 H26 Gd N9 O10 -","- C96 H104 Gd4 N36 O40 -","4","1","","Yang, Xiao-Ping; Su, Cheng-Yong; Kang, Bei-Sheng; Feng, Xiao-Long; Xiao, Wang-Leng; Liu, Han-Qin","Studies on lanthanide complexes of the tripodal ligand bis(2-benzimidazolylmethyl)(2-pyridylmethyl)amine. Crystal structures and luminescence properties †","Journal of the Chemical Society, Dalton Transactions","2000","","19","3253","","10.1039/b003566l","","","0.71073","MoKα","","0.077","0.0381","","","0.0617","0.0674","","","","","","0.966","","","","has coordinates,has disorder","179801","2020-10-21","18:00:00",""
"7009780","11.612","0.001","10.913","0.001","21.57","0.001","90","","100.19","","90","","2690.3","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H28 Cl3 N6 O2 Sm -","- C24 H28 Cl3 N6 O2 Sm -","- C96 H112 Cl12 N24 O8 Sm4 -","4","1","","Yang, Xiao-Ping; Su, Cheng-Yong; Kang, Bei-Sheng; Feng, Xiao-Long; Xiao, Wang-Leng; Liu, Han-Qin","Studies on lanthanide complexes of the tripodal ligand bis(2-benzimidazolylmethyl)(2-pyridylmethyl)amine. Crystal structures and luminescence properties †","Journal of the Chemical Society, Dalton Transactions","2000","","19","3253","","10.1039/b003566l","","","0.71073","MoKα","","0.0369","0.0241","","","0.0489","0.0513","","","","","","0.998","","","","has coordinates,has disorder","179801","2020-10-21","18:00:00",""
"7009781","10.509","0.014","16.364","0.017","20.06","0.02","90","","94.735","0.01","90","","3438","7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C40 H42 N0 O10 -","- C40 H42 O10 -","- C160 H168 O40 -","4","1","","Cooper, James B.; Drew, Michael G. B.; Beer, Paul D.","Alkali metal cation cooperative anion recognition by heteroditopic bis(calix[4]arene) rhenium(I) bipyridyl and ferrocene receptor molecules","Journal of the Chemical Society, Dalton Transactions","2000","","16","2721","","10.1039/b003569f","","","0.71073","MoKα","","0.1358","0.0828","","","0.2401","0.2841","","","","","","1.025","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7009782","13.193","0.015","21.08","0.02","14.73","0.015","90","","114.84","0.01","90","","3718","7","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C40 H41 N O12 -","- C40 H41 N O12 -","- C160 H164 N4 O48 -","4","1","","Cooper, James B.; Drew, Michael G. B.; Beer, Paul D.","Alkali metal cation cooperative anion recognition by heteroditopic bis(calix[4]arene) rhenium(I) bipyridyl and ferrocene receptor molecules","Journal of the Chemical Society, Dalton Transactions","2000","","16","2721","","10.1039/b003569f","","","0.71073","MoKα","","0.1296","0.0818","","","0.2473","0.2843","","","","","","1.106","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009783","14.868","0.017","14.587","0.018","20.29","0.02","90","","110.322","0.01","90","","4127","8","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C44 H47 N O14 -","- C44 H47 N O14 -","- C176 H188 N4 O56 -","4","1","","Cooper, James B.; Drew, Michael G. B.; Beer, Paul D.","Alkali metal cation cooperative anion recognition by heteroditopic bis(calix[4]arene) rhenium(I) bipyridyl and ferrocene receptor molecules","Journal of the Chemical Society, Dalton Transactions","2000","","16","2721","","10.1039/b003569f","","","0.71073","MoKα","","0.2285","0.0843","","","0.2219","0.2906","","","","","","0.925","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009784","14.479","0.002","18.019","0.003","21.808","0.004","90","","90","","90","","5689.6","1.6","153","","153","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C28 H35 B Cu N6 P -","- C28 H35 B Cu N6 P -","- C224 H280 B8 Cu8 N48 P8 -","8","1","","Pellei, Maura; Pettinari, Claudio; Santini, Carlo; Skelton, Brian W.; Somers, Neil; White, Allan H.","Synthesis, spectroscopic characterization, and structural systematics of new triorganophosphinecopper(I) poly(pyrazol-1-yl)borate complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","19","3416","","10.1039/b003613g","","","0.71073","MoKα","","0.051","0.036","","0.047","","0.046","","","1.45","","","1.584","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009785","11.2796","0.0008","15.91","0.0012","19.798","0.0015","90","","100.523","0.001","90","","3493.2","0.4","153","","153","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C37 H41 B Cu N8 P -","- C37 H41 B Cu N8 P -","- C148 H164 B4 Cu4 N32 P4 -","4","1","","Pellei, Maura; Pettinari, Claudio; Santini, Carlo; Skelton, Brian W.; Somers, Neil; White, Allan H.","Synthesis, spectroscopic characterization, and structural systematics of new triorganophosphinecopper(I) poly(pyrazol-1-yl)borate complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","19","3416","","10.1039/b003613g","","","0.71073","MoKα","","0.06","0.041","","0.054","","0.052","","","1.433","","","1.596","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009786","9.882","0.001","10.56","0.002","16.301","0.002","77.826","0.002","79.893","0.002","66.779","0.002","1520","0.4","153","","153","","","","","","","","","6","P -1","-P 1","2","","","","- C32 H34 B Cu N4 P2 -","- C32 H34 B Cu N4 P2 -","- C64 H68 B2 Cu2 N8 P4 -","2","1","","Pellei, Maura; Pettinari, Claudio; Santini, Carlo; Skelton, Brian W.; Somers, Neil; White, Allan H.","Synthesis, spectroscopic characterization, and structural systematics of new triorganophosphinecopper(I) poly(pyrazol-1-yl)borate complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","19","3416","","10.1039/b003613g","","","0.71073","MoKα","","0.033","0.027","","0.042","","0.041","","","1.511","","","1.567","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009787","12.736","0.002","15.229","0.002","18.834","0.002","90","","105.386","0.002","90","3","3522.1","0.8","153","","153","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C34 H53 B Cu N8 P -","- C34 H53 B Cu N8 P -","- C136 H212 B4 Cu4 N32 P4 -","4","1","","Pellei, Maura; Pettinari, Claudio; Santini, Carlo; Skelton, Brian W.; Somers, Neil; White, Allan H.","Synthesis, spectroscopic characterization, and structural systematics of new triorganophosphinecopper(I) poly(pyrazol-1-yl)borate complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","19","3416","","10.1039/b003613g","","","0.71073","MoKα","","0.061","0.04","","0.048","","0.046","","","1.369","","","1.51","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009788","12.72","0.0014","12.72","0.0014","22.033","0.002","90","","90","","120","","3087.3","0.6","153","","153","","","","","","","","","7","P -3 c 1","-P 3 2""c","165","","","","- C30.5 H31.5 B Cl1.5 Cu N6 P -","- C30.5 H31.5 B Cl1.50001 Cu N6 P -","- C122 H126 B4 Cl6.00002 Cu4 N24 P4 -","4","0.333333","","Pellei, Maura; Pettinari, Claudio; Santini, Carlo; Skelton, Brian W.; Somers, Neil; White, Allan H.","Synthesis, spectroscopic characterization, and structural systematics of new triorganophosphinecopper(I) poly(pyrazol-1-yl)borate complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","19","3416","","10.1039/b003613g","","","0.71073","MoKα","","0.085","0.062","","0.078","","0.074","","","1.534","","","1.683","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009789","11.384","0.001","19.052","0.002","20.467","0.002","90","","90","","90","","4439","0.7","153","","153","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C22 H23 B Cu N6 P -","- C22 H23 B Cu N6 P -","- C176 H184 B8 Cu8 N48 P8 -","8","1","","Pellei, Maura; Pettinari, Claudio; Santini, Carlo; Skelton, Brian W.; Somers, Neil; White, Allan H.","Synthesis, spectroscopic characterization, and structural systematics of new triorganophosphinecopper(I) poly(pyrazol-1-yl)borate complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","19","3416","","10.1039/b003613g","","","0.71073","MoKα","","0.037","0.028","","0.041","","0.04","","","1.44","","","1.534","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009790","12.405","0.002","12.621","0.002","12.948","0.003","66.897","0.003","66.169","0.003","67.181","0.003","1641.1","0.5","153","","293","","","","","","","","","6","P -1","-P 1","2","","","","- C34 H35 B Cu N8 P -","- C34 H35 B Cu N8 P -","- C68 H70 B2 Cu2 N16 P2 -","2","1","","Pellei, Maura; Pettinari, Claudio; Santini, Carlo; Skelton, Brian W.; Somers, Neil; White, Allan H.","Synthesis, spectroscopic characterization, and structural systematics of new triorganophosphinecopper(I) poly(pyrazol-1-yl)borate complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","19","3416","","10.1039/b003613g","","","0.71073","MoKα","","0.072","0.043","","0.052","","0.047","","","1.012","","","1.097","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009791","7.1166","0.0004","7.3711","0.0007","12.181","0.001","105.538","0.007","105.474","0.006","90.273","0.006","591.31","0.09","293","","293","","","","","","","","","6","P -1","-P 1","2","","pyridinium iron(III) hydrogen phosphate hydrate","","- C5 H12 Fe N O10 P2 -","- C5 H12 Fe N O10 P2 -","- C10 H24 Fe2 N2 O20 P4 -","2","1","","Cowley, Andrew R.; Chippindale, Ann M.","Ambient-temperature syntheses of layered iron(III) phosphates in silica gels","Journal of the Chemical Society, Dalton Transactions","2000","","19","3425","","10.1039/b003618h","","","1.5418","CuKα","","","0.0595","","","0.0715","","","","","1.0655","1.0655","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7009792","7.127","0.001","7.323","0.001","21.292","0.004","90","","90","","90","","1111.3","0.3","293","","293","","","","","","","","","6","P n a m","-P 2c 2n","62","","imidazolium iron(III) hydrogen phosphate hydrate","","- C1.5 H5.5 Fe0.5 N O5 P -","- C1.5 H5.5 Fe0.5 N O5 P -","- C12 H44 Fe4 N8 O40 P8 -","8","1","","Cowley, Andrew R.; Chippindale, Ann M.","Ambient-temperature syntheses of layered iron(III) phosphates in silica gels","Journal of the Chemical Society, Dalton Transactions","2000","","19","3425","","10.1039/b003618h","","","1.5418","CuKα","","","0.0575","","","0.0682","","","","","1.0808","1.0808","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7009793","18.7231","0.0001","17.3019","0.0001","17.6543","0.0001","90","","103.36","0.001","90","","5564.25","0.06","203","2","203","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","THIOSALICYLATO(TRIPHENYLPHOSPHINE)(PYRIDINE)PLATINUM(II) MONOHYDRATE","","","- C30 H26 N O3 P Pt S -","- C30 H19 N O3 P Pt S -","- C240 H152 N8 O24 P8 Pt8 S8 -","8","1","","Henderson, William; McCaffrey, Louise J.; Nicholson, Brian K.","Synthesis and biological activity of platinum(II) and palladium(II) thiosalicylate complexes with mixed ancillary donor ligands","Journal of the Chemical Society, Dalton Transactions","2000","","16","2753","","10.1039/b003619f","","","0.71073","MoKα","","0.0999","0.0703","","","0.1297","0.141","","","","","","1.095","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009794","10.5158","0.0001","15.1613","0.0002","21.4698","0.0002","73.346","0.001","85.576","0.001","87.63","0.001","3268.98","0.06","203","2","203","2","","","","","","","","7","P -1","-P 1","2","THIOSALICYLATO(TRIPHENYLPHOSPHINE)(xylylisocyanide)PLATINUM(II)","","","- C37 H34 N O3 P Pt S -","- C37 H34 N O3 P Pt S -","- C148 H136 N4 O12 P4 Pt4 S4 -","4","2","","Henderson, William; McCaffrey, Louise J.; Nicholson, Brian K.","Synthesis and biological activity of platinum(II) and palladium(II) thiosalicylate complexes with mixed ancillary donor ligands","Journal of the Chemical Society, Dalton Transactions","2000","","16","2753","","10.1039/b003619f","","","0.71073","MoKα","","0.0295","0.0244","","","0.056","0.0583","","","","","","1.06","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009795","31.5133","0.0019","11.2727","0.0006","26.8046","0.0014","90","","90.062","0.002","90","","9522.1","0.9","203","2","203","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","Bis(thioslicylato)bis(triphenylphosphine)ammine-di-platinum methanol solvate, Compound 5","","","- C51.5 H47 N O5.5 P2 Pt2 S2 -","- C51.33 H41 N O5.67 P2 Pt2 S2 -","- C410.64 H328 N8 O45.36 P16 Pt16 S16 -","8","1","","Henderson, William; McCaffrey, Louise J.; Nicholson, Brian K.","Synthesis and biological activity of platinum(II) and palladium(II) thiosalicylate complexes with mixed ancillary donor ligands","Journal of the Chemical Society, Dalton Transactions","2000","","16","2753","","10.1039/b003619f","","","0.71073","MoKα","","0.0561","0.0472","","","0.0929","0.0965","","","","","","1.23","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009796","18.186","0.002","18.186","0.002","18.186","0.002","69.784","0.017","69.784","0.017","69.784","0.017","5118.8","1.2","293","2","293","2","","","","","","","","6","R 3 c :R","P 3* -2n","161","","","","- C66 H96 Cu6 N6 O60 Pr2 -","- C66 H48 Cu6 N6 O60 Pr2 -","- C132 H96 Cu12 N12 O120 Pr4 -","2","0.333333","","Zhang, Yuan-Jing; Ma, Bao-Qing; Gao, Song; Li, Jun-Ran; Liu, Qin-De; Wen, Ge-Hui; Zhang, Xi-Xiang","The first lanthanide-templated molecular wheel containing six copper ions †","Journal of the Chemical Society, Dalton Transactions","2000","","14","2249","","10.1039/b003670f","","","0.71073","MoKα","","0.0687","0.0615","","","0.1575","0.1633","","","","","","1.07","","","","has coordinates","179801","2020-10-21","18:00:00",""
"7009797","16.308","0.002","16.303","0.004","10.132","0.002","90","","91","0.013","90","","2693.4","0.9","223","2","223","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C20 H31 As Cl Mo O3 P3 -","- C20 H31 As Cl Mo O3 P3 -","- C80 H124 As4 Cl4 Mo4 O12 P12 -","4","1","","Bashall, Alan; Hopkins, Alexander D.; Mays, Martin J.; McPartlin, Mary; Wood, Jody A.; Woods, Anthony D.; Wright, Dominic S.","Addition of the [(tBuP)3As]− anion to the cyclopentadienyl ring of [(C5H5)M(CO)3Cl] (M = Mo, W)","Journal of the Chemical Society, Dalton Transactions","2000","","12","1825","","10.1039/b003687k","","","0.71073","MoKα","","0.0555","0.0301","","","0.0635","0.0732","","","","","","1.031","","","","has coordinates,has disorder","179801","2020-10-21","18:00:00",""
"7009798","16.412","0.003","16.44","0.002","10.1301","0.0016","90","","91.351","0.013","90","","2732.5","0.7","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C20 H31 As Cl O3 P3 W -","- C20 H31 As Cl O3 P3 W -","- C80 H124 As4 Cl4 O12 P12 W4 -","4","1","","Bashall, Alan; Hopkins, Alexander D.; Mays, Martin J.; McPartlin, Mary; Wood, Jody A.; Woods, Anthony D.; Wright, Dominic S.","Addition of the [(tBuP)3As]− anion to the cyclopentadienyl ring of [(C5H5)M(CO)3Cl] (M = Mo, W)","Journal of the Chemical Society, Dalton Transactions","2000","","12","1825","","10.1039/b003687k","","","0.71073","MoKα","","0.0817","0.0687","","","0.1747","0.1839","","","","","","1.004","","","","has coordinates,has disorder","179801","2020-10-21","18:00:00",""
"7009799","21.678","0.003","11.4111","0.001","12.9139","0.0016","90","","103.401","0.011","90","","3107.5","0.7","293","","293","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","1-2PhCl","","","- C58 H26 Cl2 N6 Ni O6 -","- C32 H26 Cl2 N6 Ni O6 -","- C128 H104 Cl8 N24 Ni4 O24 -","4","0.5","","Biradha, Kumar; Mondal, Arunendu; Moulton, Brian; Zaworotko, Michael J.","Coexisting covalent and non-covalent planar networks in the crystal structures of {[M(bipy)2(NO3)2]·arene}n (M = Ni, 1; Co, 2; arene = chlorobenzene, o-dichlorobenzene, benzene, nitrobenzene, toluene or anisole) †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3837","","10.1039/b003733h","","","0.7093","MolybdenumKα","","0.054","0.054","","0.056","0.056","","","","","4.35","4.35","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009800","21.5155","0.0017","11.4059","0.0009","13.3137","0.001","90","","103.294","","90","","3179.7","0.4","293","","293","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","1-2PhCl2","","","- C32 H24 Cl4 N6 Ni O6 -","- C32 H24 Cl4 N6 Ni O6 -","- C128 H96 Cl16 N24 Ni4 O24 -","4","0.5","","Biradha, Kumar; Mondal, Arunendu; Moulton, Brian; Zaworotko, Michael J.","Coexisting covalent and non-covalent planar networks in the crystal structures of {[M(bipy)2(NO3)2]·arene}n (M = Ni, 1; Co, 2; arene = chlorobenzene, o-dichlorobenzene, benzene, nitrobenzene, toluene or anisole) †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3837","","10.1039/b003733h","","","0.7093","MolybdenumKα","","0.098","0.098","","0.128","0.128","","","","","6.61","6.61","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009801","21.164","0.002","11.4128","0.0009","12.6597","0.001","90","","101.206","0.001","90","","2999.5","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","1-2PhH","","","- C32 H28 N6 Ni O6 -","- C32 H28 N6 Ni O6 -","- C128 H112 N24 Ni4 O24 -","4","0.5","","Biradha, Kumar; Mondal, Arunendu; Moulton, Brian; Zaworotko, Michael J.","Coexisting covalent and non-covalent planar networks in the crystal structures of {[M(bipy)2(NO3)2]·arene}n (M = Ni, 1; Co, 2; arene = chlorobenzene, o-dichlorobenzene, benzene, nitrobenzene, toluene or anisole) †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3837","","10.1039/b003733h","","","0.71073","MoKα","","0.0684","0.0449","","0.1179","0.1085","","","","1.038","1.108","1.108","","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009802","21.5968","0.0013","11.4","0.0007","12.9303","0.0008","90","","103.104","0.001","90","","3100.6","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","2-2PhNO2","","","- C32 H26 N8 Ni O10 -","- C32 H26 N8 Ni O10 -","- C128 H104 N32 Ni4 O40 -","4","0.5","","Biradha, Kumar; Mondal, Arunendu; Moulton, Brian; Zaworotko, Michael J.","Coexisting covalent and non-covalent planar networks in the crystal structures of {[M(bipy)2(NO3)2]·arene}n (M = Ni, 1; Co, 2; arene = chlorobenzene, o-dichlorobenzene, benzene, nitrobenzene, toluene or anisole) †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3837","","10.1039/b003733h","","","0.71073","MoKα","","0.0439","0.0301","","0.0733","0.069","","","","1.013","1.071","1.071","","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009803","21.7636","0.0013","11.5176","0.0007","12.8555","0.0008","90","","102.741","0.001","90","","3143.1","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","2-2PhMe","","","- C68 H32 Co2 N12 O12 -","- C68 H32 Co2 N12 O12 -","- C136 H64 Co4 N24 O24 -","2","0.25","","Biradha, Kumar; Mondal, Arunendu; Moulton, Brian; Zaworotko, Michael J.","Coexisting covalent and non-covalent planar networks in the crystal structures of {[M(bipy)2(NO3)2]·arene}n (M = Ni, 1; Co, 2; arene = chlorobenzene, o-dichlorobenzene, benzene, nitrobenzene, toluene or anisole) †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3837","","10.1039/b003733h","","","0.71073","MoKα","","0.0516","0.0379","","0.1097","0.103","","","","1.064","1.128","1.128","","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009804","21.814","0.0012","11.5281","0.0002","12.8767","0.0007","90","","102.674","0.001","90","","3159.3","0.3","293","","293","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","2-2PhCl","","","- C38 H26 Cl2 Co N6 O6 -","- C32 H26 Cl2 Co N6 O6 -","- C128 H104 Cl8 Co4 N24 O24 -","4","0.5","","Biradha, Kumar; Mondal, Arunendu; Moulton, Brian; Zaworotko, Michael J.","Coexisting covalent and non-covalent planar networks in the crystal structures of {[M(bipy)2(NO3)2]·arene}n (M = Ni, 1; Co, 2; arene = chlorobenzene, o-dichlorobenzene, benzene, nitrobenzene, toluene or anisole) †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3837","","10.1039/b003733h","","","0.7093","MolybdenumKα","","0.057","0.057","","0.074","0.074","","","","","5.53","5.53","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009805","21.6458","0.0013","11.5193","0.0007","13.3717","0.0008","90","","102.668","","90","","3253","0.3","293","","293","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","2-2PhCl2","","","- C54 H24 Cl4 Co N6 O6 -","- C32 H24 Cl4 Co N6 O6 -","- C128 H96 Cl16 Co4 N24 O24 -","4","0.5","","Biradha, Kumar; Mondal, Arunendu; Moulton, Brian; Zaworotko, Michael J.","Coexisting covalent and non-covalent planar networks in the crystal structures of {[M(bipy)2(NO3)2]·arene}n (M = Ni, 1; Co, 2; arene = chlorobenzene, o-dichlorobenzene, benzene, nitrobenzene, toluene or anisole) †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3837","","10.1039/b003733h","","","0.7093","MolybdenumKα","","0.062","0.062","","0.089","0.089","","","","","3.94","3.94","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009806","21.3256","0.0003","11.5305","0.0001","12.6079","0.0002","90","","100.767","0.001","90","","3045.64","0.07","293","","293","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","2-2PhH","","","- C32 H28 Co N6 O6 -","- C32 H28 Co N6 O6 -","- C128 H112 Co4 N24 O24 -","4","0.5","","Biradha, Kumar; Mondal, Arunendu; Moulton, Brian; Zaworotko, Michael J.","Coexisting covalent and non-covalent planar networks in the crystal structures of {[M(bipy)2(NO3)2]·arene}n (M = Ni, 1; Co, 2; arene = chlorobenzene, o-dichlorobenzene, benzene, nitrobenzene, toluene or anisole) †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3837","","10.1039/b003733h","","","0.7093","MolybdenumKα","","0.039","0.039","","0.049","0.049","","","","","2.19","2.19","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009807","22.8114","0.0011","15.4407","0.0007","11.4207","0.0005","90","","90","","90","","4022.6","0.3","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","2-3PhOMe","","","- C41 H40 Co N6 O9 -","- C41 H40 Co N6 O9 -","- C164 H160 Co4 N24 O36 -","4","1","","Biradha, Kumar; Mondal, Arunendu; Moulton, Brian; Zaworotko, Michael J.","Coexisting covalent and non-covalent planar networks in the crystal structures of {[M(bipy)2(NO3)2]·arene}n (M = Ni, 1; Co, 2; arene = chlorobenzene, o-dichlorobenzene, benzene, nitrobenzene, toluene or anisole) †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3837","","10.1039/b003733h","","","0.71073","MoKα","","0.0689","0.0502","","0.1609","0.1501","","","","1.134","1.205","1.205","","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009808","21.7003","0.0011","11.4961","0.0006","12.8598","0.0006","90","","102.526","0.001","90","","3131.8","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","2-2PhNO2","","","- C32 H26 Co N8 O10 -","- C32 H26 Co N8 O10 -","- C128 H104 Co4 N32 O40 -","4","0.5","","Biradha, Kumar; Mondal, Arunendu; Moulton, Brian; Zaworotko, Michael J.","Coexisting covalent and non-covalent planar networks in the crystal structures of {[M(bipy)2(NO3)2]·arene}n (M = Ni, 1; Co, 2; arene = chlorobenzene, o-dichlorobenzene, benzene, nitrobenzene, toluene or anisole) †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3837","","10.1039/b003733h","","","0.71073","MoKα","","0.034","0.0296","","0.1094","0.1047","","","","0.923","0.939","0.939","","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009809","8.612","0.003","10.792","0.005","14.717","0.007","89.33","0.04","78.15","0.04","76.6","0.04","1301.3","1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H25 Mo O7 P -","- C27 H25 Mo O7 P -","- C54 H50 Mo2 O14 P2 -","2","1","","Adams, Harry; Bailey, Neil A.; Blenkiron, Peter; Morris, Michael J.","Deprotonation of [Mo(COMe)(CO)2(PPh2H)(η-C5H5)] and reaction with activated alkynes: controllable formation of vinylphosphine and η3-acryloyl ligands","Journal of the Chemical Society, Dalton Transactions","2000","","18","3074","","10.1039/b003739g","","","0.71069","MoKα","","0.0402","0.0324","","","0.0797","0.0833","","","","","","1.006","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009810","11.0689","0.0007","12.2999","0.0008","23.989","0.002","90","","102.825","0.001","90","","3184.5","0.4","293","2","293","2","","","","","","","-","7","P 1 21/n 1","-P 2yn","14","","","","- C28.5 H31.5 Cl3.5 N2 O P Ru -","- C28.5 H31.5 Cl3.5 N2 O P Ru -","- C114 H126 Cl14 N8 O4 P4 Ru4 -","4","1","","Durran, Sean E.; Smith, Martin B.; Slawin, Alexandra M. Z.; Steed, Jonathan W.","The synthesis and co-ordination chemistry of new functionalised pyridylphosphines derived from Ph2PCH2OH †","Journal of the Chemical Society, Dalton Transactions","2000","","16","2771","","10.1039/b003759l","","","0.71073","MoKα","","0.2119","0.071","","0.2502","0.1391","","","","0.852","1.118","1.118","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009811","10.98","0.002","12.228","0.003","24.194","0.003","90","","101.96","0.02","90","","3177.9","1.1","293.2","","293.2","","","","","","","","-","6","P 1 21/c 1","-P 2ybc","14","","","","- C29 H32 Cl5 N2 P Ru -","- C29 H32 Cl5 N2 P Ru -","- C116 H128 Cl20 N8 P4 Ru4 -","4","1","","Durran, Sean E.; Smith, Martin B.; Slawin, Alexandra M. Z.; Steed, Jonathan W.","The synthesis and co-ordination chemistry of new functionalised pyridylphosphines derived from Ph2PCH2OH †","Journal of the Chemical Society, Dalton Transactions","2000","","16","2771","","10.1039/b003759l","","","0.7107","MoKα","","0.0397","0.0397","","0.0382","","0.0382","","","1.635","","","1.635","","","","has coordinates","193981","2020-10-21","18:00:00",""
"7009812","8.7043","0.0006","10.8681","0.0008","17.2011","0.0011","90.024","0.004","91.491","0.004","100.777","0.004","1597.95","0.19","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H17 N2 O2 P -","- C18 H17 N2 O2 P -","- C72 H68 N8 O8 P4 -","4","2","","Durran, Sean E.; Smith, Martin B.; Slawin, Alexandra M. Z.; Steed, Jonathan W.","The synthesis and co-ordination chemistry of new functionalised pyridylphosphines derived from Ph2PCH2OH †","Journal of the Chemical Society, Dalton Transactions","2000","","16","2771","","10.1039/b003759l","","","0.71073","MoKα","","0.1032","0.0558","","","0.111","0.1275","","","","","","1.019","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009813","10.9899","0.0005","15.8626","0.0008","16.8562","0.0011","81.161","0.003","76.38","0.003","77.645","0.003","2773.2","0.3","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C60 H54 Cl2 N2 O5 P4 Pt -","- C60 H52 Cl2 N4 O5 P4 Pt -","- C120 H104 Cl4 N8 O10 P8 Pt2 -","2","1","","Durran, Sean E.; Smith, Martin B.; Slawin, Alexandra M. Z.; Steed, Jonathan W.","The synthesis and co-ordination chemistry of new functionalised pyridylphosphines derived from Ph2PCH2OH †","Journal of the Chemical Society, Dalton Transactions","2000","","16","2771","","10.1039/b003759l","","","0.71073","MoKα","","0.0893","0.0662","","","0.1292","0.1387","","","","","","1.064","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009814","7.3753","0.0003","12.8896","0.0003","20.6503","0.0005","106.031","0.002","99.091","0.002","93.886","0.002","1850.19","0.1","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C40 H40 Cl2 N2 O4 P2 Ru -","- C40 H40 Cl2 N2 O4 P2 Ru -","- C80 H80 Cl4 N4 O8 P4 Ru2 -","2","1","","Durran, Sean E.; Smith, Martin B.; Slawin, Alexandra M. Z.; Steed, Jonathan W.","The synthesis and co-ordination chemistry of new functionalised pyridylphosphines derived from Ph2PCH2OH †","Journal of the Chemical Society, Dalton Transactions","2000","","16","2771","","10.1039/b003759l","","","0.71073","MoKα","","0.048","0.0333","","","0.0657","0.0701","","","","","","1.03","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009815","11.2902","0.0003","13.6623","0.0004","21.4044","0.0007","93.695","0.002","104.682","0.002","101.304","0.002","3109.12","0.17","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C54.5 H66.5 Cl11.5 N2 O2 P2 Ru2 -","- C54.5 H56.5 Cl11.5 N2 O2 P2 Ru2 -","- C109 H113 Cl23 N4 O4 P4 Ru4 -","2","1","","Durran, Sean E.; Smith, Martin B.; Slawin, Alexandra M. Z.; Steed, Jonathan W.","The synthesis and co-ordination chemistry of new functionalised pyridylphosphines derived from Ph2PCH2OH †","Journal of the Chemical Society, Dalton Transactions","2000","","16","2771","","10.1039/b003759l","","","0.7107","MoKα","","0.0759","0.0594","","","0.1427","0.1515","","","","","","1.042","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7009816","9.6851","0.0003","16.4272","0.0007","16.6831","0.0008","99.178","0.003","91.764","0.003","92.281","0.003","2616.35","0.19","293","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C51 H57 Cl7 N2 O P2 Rh2 -","- C51 H57 Cl7 N2 O P2 Rh2 -","- C102 H114 Cl14 N4 O2 P4 Rh4 -","2","1","","Durran, Sean E.; Smith, Martin B.; Slawin, Alexandra M. Z.; Steed, Jonathan W.","The synthesis and co-ordination chemistry of new functionalised pyridylphosphines derived from Ph2PCH2OH †","Journal of the Chemical Society, Dalton Transactions","2000","","16","2771","","10.1039/b003759l","","","0.71073","MoKα","","0.0563","0.0404","","","0.0801","0.0858","","","","","","1.039","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009817","9.3371","0.0004","20.885","0.001","16.444","0.001","90","","94.534","0.007","90","","3196.6","0.3","293","2","193","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C22 H54 Ga P3 Si3 -","- C22 H54 Ga P3 Si3 -","- C88 H216 Ga4 P12 Si12 -","4","2","","Uhl, Werner; Benter, Maike","Formation of a gallium triphosphorus heterocycle by reaction of the alkylgallium(I) compound Ga4[C(SiMe3)3]4 with tri(tert-butyl)cyclotriphosphane","Journal of the Chemical Society, Dalton Transactions","2000","","18","3133","","10.1039/b003760p","","","0.71073","MoKα","","0.0278","0.0243","","","0.0666","0.07","","","","","","0.574","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009818","11.702","0.0012","12.1224","0.0008","16.203","0.002","92.074","0.009","104.602","0.01","106.685","0.007","2115.9","0.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C40 H41 B10 Cu Mo O3 P2 -","- C40 H41 B10 Cu Mo O3 P2 -","- C80 H82 B20 Cu2 Mo2 O6 P4 -","2","1","","Ellis, Dianne D.; Franken, Andreas; Jelliss, Paul A.; Kautz, Jason A.; Stone, F. Gordon A.; Yu, Pui-Yin","Contemporary bimetallic molecules: an unusual class of exo-closo metallacarbaboranes having no metal‒metal bonds","Journal of the Chemical Society, Dalton Transactions","2000","","15","2509","","10.1039/b003766o","","","0.71073","MoKα","","0.0978","0.0508","","","0.0854","0.0994","","","","","","1.024","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009819","11.146","0.002","14.6174","0.0012","16.121","0.004","70.67","0.011","84.02","0.018","69.706","0.01","2324.4","0.8","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C41 H43 Ag B10 Cl2 Mo O3 P2 -","- C41 H43 Ag B10 Cl2 Mo O3 P2 -","- C82 H86 Ag2 B20 Cl4 Mo2 O6 P4 -","2","1","","Ellis, Dianne D.; Franken, Andreas; Jelliss, Paul A.; Kautz, Jason A.; Stone, F. Gordon A.; Yu, Pui-Yin","Contemporary bimetallic molecules: an unusual class of exo-closo metallacarbaboranes having no metal‒metal bonds","Journal of the Chemical Society, Dalton Transactions","2000","","15","2509","","10.1039/b003766o","","","0.71073","MoKα","","0.0499","0.0379","","","0.0911","0.0976","","","","","","1.056","","","","has coordinates,has disorder","179802","2020-10-21","18:00:00",""
"7009820","11.152","0.0018","13.811","0.003","21.962","0.004","105.442","0.009","95.01","0.014","93.19","0.02","3237","1.1","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C64 H70 B10 Cl3 Mo O3 P3 Ru -","- C64 H58 B10 Cl3 Mo O3 P3 Ru -","- C128 H116 B20 Cl6 Mo2 O6 P6 Ru2 -","2","1","","Ellis, Dianne D.; Franken, Andreas; Jelliss, Paul A.; Kautz, Jason A.; Stone, F. Gordon A.; Yu, Pui-Yin","Contemporary bimetallic molecules: an unusual class of exo-closo metallacarbaboranes having no metal‒metal bonds","Journal of the Chemical Society, Dalton Transactions","2000","","15","2509","","10.1039/b003766o","","","0.71073","MoKα","","0.0328","0.0253","","","0.0695","0.071","","","","","","0.952","","","","has coordinates,has disorder","179802","2020-10-21","18:00:00",""
"7009821","20.0653","0.0015","16.9217","0.0017","11.7368","0.0015","90","","90","","90","","3985.1","0.7","293","2","293","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C34 H41 B10 Fe Mo O5 P -","- C34 H41 B10 Fe Mo O5 P -","- C136 H164 B40 Fe4 Mo4 O20 P4 -","4","1","","Ellis, Dianne D.; Franken, Andreas; Jelliss, Paul A.; Kautz, Jason A.; Stone, F. Gordon A.; Yu, Pui-Yin","Contemporary bimetallic molecules: an unusual class of exo-closo metallacarbaboranes having no metal‒metal bonds","Journal of the Chemical Society, Dalton Transactions","2000","","15","2509","","10.1039/b003766o","","","0.71073","MoKα","","0.082","0.0486","","","0.089","0.1023","","","","","","1.036","","","","has coordinates,has disorder","179802","2020-10-21","18:00:00",""
"7009822","12.5862","0.001","12.7603","0.001","17.5809","0.001","90","","98.795","0.01","90","","2790.4","0.4","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C22 H26 B10 Cu Fe O3 P -","- C22 H26 B10 Cu Fe O3 P -","- C88 H104 B40 Cu4 Fe4 O12 P4 -","4","1","","Ellis, Dianne D.; Franken, Andreas; Jelliss, Paul A.; Kautz, Jason A.; Stone, F. Gordon A.; Yu, Pui-Yin","Contemporary bimetallic molecules: an unusual class of exo-closo metallacarbaboranes having no metal‒metal bonds","Journal of the Chemical Society, Dalton Transactions","2000","","15","2509","","10.1039/b003766o","","","0.71073","MoKα","","0.2183","0.1016","","","0.2186","0.2616","","","","","","1.14","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009823","13.289","0.001","21.226","0.002","18.002","0.002","90","","101.5","0.02","90","","4975.9","0.9","298.2","","298.2","","","","","","","","","8","P 1 21/a 1","-P 2yab","14","","","","- C49 H42 Cl2 N2 O2 Os P4 S4 -","- C49 H42 Cl2 N2 O2 Os P4 S4 -","- C196 H168 Cl8 N8 O8 Os4 P16 S16 -","4","1","","Zhang, Qian-Feng; Lau, Kwok-Kin; Chim, Joyce L. C.; Wong, Terry K. T.; Wong, Wing-Tak; Williams, Ian D.; Leung, Wa-Hung","Dioxo- and nitrido-osmium complexes with imidodiphosphinochalcogenido ligands [N(QPR2)2]− (Q = S or Se; R = Ph or Pri)","Journal of the Chemical Society, Dalton Transactions","2000","","17","3027","","10.1039/b003798m","","","0.7107","MoKalpha","","","0.0291","","","0.0363","","","","","2.155","2.155","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009824","10.756","0.001","15.378","0.002","14.369","0.001","90","","99.64","0.02","90","","2343.2","0.4","298.2","","298.2","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C48 H40 N2 O2 Os P4 Se4 -","- C48 H40 N2 O2 Os P4 Se4 -","- C96 H80 N4 O4 Os2 P8 Se8 -","2","0.5","","Zhang, Qian-Feng; Lau, Kwok-Kin; Chim, Joyce L. C.; Wong, Terry K. T.; Wong, Wing-Tak; Williams, Ian D.; Leung, Wa-Hung","Dioxo- and nitrido-osmium complexes with imidodiphosphinochalcogenido ligands [N(QPR2)2]− (Q = S or Se; R = Ph or Pri)","Journal of the Chemical Society, Dalton Transactions","2000","","17","3027","","10.1039/b003798m","","","0.7107","MoKalpha","","","0.0303","","","0.0356","","","","","1.757","1.757","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009825","10.953","0.002","14.611","0.002","22.038","0.002","82.64","0.01","86.66","0.01","78.73","0.01","3428.3","0.9","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C72 H60 N3 Os P6 S6 -","- C72 H60 N3 Os P6 S6 -","- C144 H120 N6 Os2 P12 S12 -","2","1","","Zhang, Qian-Feng; Lau, Kwok-Kin; Chim, Joyce L. C.; Wong, Terry K. T.; Wong, Wing-Tak; Williams, Ian D.; Leung, Wa-Hung","Dioxo- and nitrido-osmium complexes with imidodiphosphinochalcogenido ligands [N(QPR2)2]− (Q = S or Se; R = Ph or Pri)","Journal of the Chemical Society, Dalton Transactions","2000","","17","3027","","10.1039/b003798m","","","0.71073","MoKα","","0.0539","0.0378","","","0.0838","0.0914","","","","","","0.99","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009826","16.4366","0.0001","17.6321","0.0003","18.2643","0.0003","114.73","0.001","102.828","0.001","98.01","0.001","4523.73","0.13","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C73 H62 Cl4 Hg P4 Pt2 S2 -","- C73 H62 Cl4 Hg P4 Pt2 S2 -","- C146 H124 Cl8 Hg2 P8 Pt4 S4 -","2","1","","Li, Zhaohui; Xu, Xingling; Khoo, Soo Beng; Mok, K. F.; Hor, T. S. Andy","Formation and structural relationship of electroactive PtII‒HgII polymetallic sulfide aggregates","Journal of the Chemical Society, Dalton Transactions","2000","","17","2901","","10.1039/b003799k","","","0.71073","MoKα","","0.0792","0.0546","","0.1894","0.1695","","","","1.045","1.09","1.09","","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009827","18.1038","0.0003","27.8444","0.0001","20.9295","0.0003","90","","92.466","0.001","90","","10540.6","0.2","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C90 H77 F12 Hg O P7 Pt2 S2 -","- C90 H76.5 F11 Hg O P7 Pt2 S2 -","- C360 H306 F44 Hg4 O4 P28 Pt8 S8 -","4","1","","Li, Zhaohui; Xu, Xingling; Khoo, Soo Beng; Mok, K. F.; Hor, T. S. Andy","Formation and structural relationship of electroactive PtII‒HgII polymetallic sulfide aggregates","Journal of the Chemical Society, Dalton Transactions","2000","","17","2901","","10.1039/b003799k","","","0.71073","MoKα","","0.0837","0.052","","","0.1534","0.1707","","","","","","1.121","","","","has coordinates,has disorder","179802","2020-10-21","18:00:00",""
"7009828","37.0244","0.0005","19.6785","0.0003","28.0765","0.0005","90","","127.432","0.001","90","","16243.7","0.5","293","2","293","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C148.5 H133 Cl9 Hg O10 P8 Pt4 S4 -","- C148.5 H133 Cl9 Hg O10 P8 Pt4 S4 -","- C594 H532 Cl36 Hg4 O40 P32 Pt16 S16 -","4","0.5","","Li, Zhaohui; Xu, Xingling; Khoo, Soo Beng; Mok, K. F.; Hor, T. S. Andy","Formation and structural relationship of electroactive PtII‒HgII polymetallic sulfide aggregates","Journal of the Chemical Society, Dalton Transactions","2000","","17","2901","","10.1039/b003799k","","","0.71073","MoKα","","0.098","0.0531","","","0.1387","0.1623","","","","","","1.08","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009829","14.5458","0.0002","17.4269","0.0002","24.8814","0.0004","79.242","0.001","88.898","0.001","72.579","0.001","5907.55","0.15","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C109 H92 Cl4 F12 Hg2 P8 Pt2 S2 -","- C109 H92 Cl4 F12 Hg2 P8 Pt2 S2 -","- C218 H184 Cl8 F24 Hg4 P16 Pt4 S4 -","2","1","","Li, Zhaohui; Xu, Xingling; Khoo, Soo Beng; Mok, K. F.; Hor, T. S. Andy","Formation and structural relationship of electroactive PtII‒HgII polymetallic sulfide aggregates","Journal of the Chemical Society, Dalton Transactions","2000","","17","2901","","10.1039/b003799k","","","0.71073","MoKα","","0.0817","0.0475","","","0.1373","0.1576","","","","","","1.043","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009830","14.769","0.004","25.453","0.009","23.201","0.009","90","","94.262","0.017","90","","8697","5","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C73 H62 Cl6 Hg2 P4 Pt2 S2 -","- C72.5 H61 Cl5 Hg2 P4 Pt2 S2 -","- C290 H244 Cl20 Hg8 P16 Pt8 S8 -","4","1","","Li, Zhaohui; Xu, Xingling; Khoo, Soo Beng; Mok, K. F.; Hor, T. S. Andy","Formation and structural relationship of electroactive PtII‒HgII polymetallic sulfide aggregates","Journal of the Chemical Society, Dalton Transactions","2000","","17","2901","","10.1039/b003799k","","","0.71073","MoKα","","0.3091","0.1045","","","0.2377","0.3266","","","","","","0.927","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009831","16.404","0.002","16.41","0.002","17.384","0.002","100.73","0.02","107.28","0.02","109.4","0.02","3998.3","1.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C90 H78 Cu4 N8 O9 -","- C87 H64 Cu4 N8 O8.5 -","- C174 H128 Cu8 N16 O17 -","2","1","","Pasini, Alessandro; Demartin, Francesco; Piovesana, Olivo; Chiari, Brunetto; Cinti, Antonio; Crispu, Ornella","Novel copper(II) complexes of “short” salen homologues. Structure and magnetic properties of the tetranuclear complex [Cu2(L2)2]2 [H2L2 = phenyl-N,N '-bis(salicylidene)methanediamine] †","Journal of the Chemical Society, Dalton Transactions","2000","","19","3467","","10.1039/b003825n","","","0.71073","MoKα","","0.0811","0.0434","","0.1376","0.1273","","","","0.69","0.862","0.862","","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009832","10.7674","0.0004","15.6032","0.0003","14.1064","0.0004","90","","94.866","0.001","90","","2361.42","0.12","123","","123","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H37 N4 Na -","- C24 H36 N4 Na -","- C96 H144 N16 Na4 -","4","1","","Andrews, Philip C.; Duggan, Peter J.; Fallon, Gary D.; McCarthy, Tom D.; Peatt, Anna C.","Amido→azaallyl transformation in sodium amide complexes of (S )-α-(methylbenzyl)benzylamine","Journal of the Chemical Society, Dalton Transactions","2000","","15","2505","","10.1039/b003826l","","","0.71073","MoKα","","0.1691","0.061","","0.0503","","0.0432","","","2.177","","","2.824","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009833","19.086","0.008","19.06","0.001","25.9042","0.0007","90","","90","","90","","9423","4","200.2","","","","","","","","","","","6","I 21 21 21","I 2b 2c","24","","","","- C42 H30 Ag2 F12 P2 S6 -","- C42 H30 Ag2 F12 P2 S6 -","- C336 H240 Ag16 F96 P16 S48 -","8","1","","Suenaga, Yusaku; Kuroda-Sowa, Takayoshi; Maekawa, Masahiko; Munakata, Megumu","Three-dimensional silver(I) co-ordination polymer with pocket structures","Journal of the Chemical Society, Dalton Transactions","2000","","20","3620","","10.1039/b003944f","","","0.7107","MoKα","","","0.0451","","","","0.119","","","","","","1.484","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009834","9.302","0.001","10.639","0.002","21.118","0.006","93.514","0.006","92.144","0.003","115.429","0.001","1879.2","0.7","296.2","","","","","","","","","","","6","P -1","-P 1","2","","","","- C42 H30 Ag N O3 S6 -","- C42 H30 Ag N O3 S6 -","- C84 H60 Ag2 N2 O6 S12 -","2","1","","Suenaga, Yusaku; Kuroda-Sowa, Takayoshi; Maekawa, Masahiko; Munakata, Megumu","Three-dimensional silver(I) co-ordination polymer with pocket structures","Journal of the Chemical Society, Dalton Transactions","2000","","20","3620","","10.1039/b003944f","","","0.7107","MoKα","","","0.0304","","","","0.1132","","","","","","1.457","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009835","21.231","0.002","21.231","0.002","18.627","0.003","90","","90","","120","","7271.3","1.5","293","","293","","","","","","","","","8","R 3 :H","R 3","146","","","","- C23.333 H36 As4 Cl2 Co F6 O0.666 P -","- C23.3323 H32 As4 Cl2 Co F6 O0.666333 P -","- C209.991 H288 As36 Cl18 Co9 F54 O5.997 P9 -","9","1","","Doyle, Roy J.; Habermehl, Nicole; Salem, Geoffrey; Willis, Anthony C.","Synthesis of chiral multidentate tertiary arsines with As4 or As6 donor atoms","Journal of the Chemical Society, Dalton Transactions","2000","","20","3603","","10.1039/b003981k","","","1.5418","CuKα","","0.043","0.035","","0.04","","0.036","","","1.332","","","1.288","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009836","9.284","0.003","13.369","0.005","13.437","0.004","90","","106.44","0.03","90","","1599.6","1","296.2","","296.2","","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C23 H35 As4 Cl3 Co F6 P -","- C23 H35 As4 Cl3 Co F6 P -","- C46 H70 As8 Cl6 Co2 F12 P2 -","2","1","","Doyle, Roy J.; Habermehl, Nicole; Salem, Geoffrey; Willis, Anthony C.","Synthesis of chiral multidentate tertiary arsines with As4 or As6 donor atoms","Journal of the Chemical Society, Dalton Transactions","2000","","20","3603","","10.1039/b003981k","","","0.7107","MoKα","","0.0673","0.0527","","0.0606","","0.0584","","","2.048","","","2.24","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009837","13.08","0.003","24.057","0.004","31.3","0.004","90","","90","","90","","9849","3","193.2","","193.2","","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C35 H54.62 As6 Co F18 O1.31 P3 -","- C35 H54 As6 Co F18 O1.31 P3 -","- C280 H432 As48 Co8 F144 O10.48 P24 -","8","1","","Doyle, Roy J.; Habermehl, Nicole; Salem, Geoffrey; Willis, Anthony C.","Synthesis of chiral multidentate tertiary arsines with As4 or As6 donor atoms","Journal of the Chemical Society, Dalton Transactions","2000","","20","3603","","10.1039/b003981k","","","1.5418","CuKα","","0.0768","0.0473","","0.0574","","0.0542","","","1.908","","","2.133","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009838","13.2063","0.0004","17.5907","0.0006","20.7908","0.0005","90","","91.6972","0.0018","90","","4827.8","0.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[MnL]2[Mo(CN)8]6H2O","","","- C38 H54 Mn2 Mo N18 O6 -","- C38 H42 Mn2 Mo N18 O6 -","- C152 H168 Mn8 Mo4 N72 O24 -","4","1","","Rombaut, Guillaume; Golhen, Stéphane; Ouahab, Lahcène; Mathonière, Corine; Kahn, Olivier","Structural and photomagnetic studies of a 1-D bimetallic chain [MnII2(L)2(H2O)][MoIV(CN)8]·5H2O (L = macrocycle): analogy with the photo-oxidation of K4[MoIV(CN)8]·2H2O","Journal of the Chemical Society, Dalton Transactions","2000","","20","3609","","10.1039/b003983g","","","0.71073","MoKα","","0.0819","0.0512","","","0.1293","0.1492","","","","","","1.086","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009839","8.1004","0.0002","17.0908","0.0004","11.002","0.0002","90","","108.825","0.001","90","","1441.67","0.06","123","","123","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C32 H36 S2 Zn2 -","- C32 H36 S2 Zn2 -","- C64 H72 S4 Zn4 -","2","0.5","","Dickson, Ron S.; Fallon, Gary D.; Zhang, Qian-Qian","Dimeric diphenylzinc adducts with cyclic thioethers","Journal of the Chemical Society, Dalton Transactions","2000","","13","1973","","10.1039/b003985n","","","0.71073","MoKα","","0.0582","0.0346","","0.0429","","0.0387","","","1.02","","","1.115","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009840","22.7551","0.0005","23.912","0.0005","9.641","0.0003","90","","112.708","0.003","90","","4839.2","0.2","183","2","183","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C44 H50 F12 N8 O4 P2 Ru -","- C44 H50 F12 N8 O4 P2 Ru -","- C176 H200 F48 N32 O16 P8 Ru4 -","4","0.5","","Sven Rau; Mario Ruben; Torsten Büttner; Christian Temme; Sylvana Dautz; Helmar Görls; Manfred Rudolph; Dirk Walther; Andre Brodkorb; Marco Duati; Christine O'Connor; Johannes G. Vos","Bis(R-bipyridyl)ruthenium bibenzimidazole complexes (R = H, Me or But): supramolecular arrangement via hydrogen bonds, photo- and electro-chemical properties and reactivity towards carbon dioxide","J. Chem. Soc., Dalton Trans.","2000","","20","3649","3657","10.1039/b003992f","","","0.71073","MoKα","","0.0467","0.0421","","0.1334","0.1233","","","","1.04","1.061","1.061","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7009841","11.7219","0.0005","17.5925","0.0008","24.522","0.001","90","","101.083","0.003","90","","4962.6","0.4","183","2","183","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C53 H66 N8 O3 Ru -","- C53 H62 N8 O3 Ru -","- C212 H248 N32 O12 Ru4 -","4","0.5","","Sven Rau; Mario Ruben; Torsten Büttner; Christian Temme; Sylvana Dautz; Helmar Görls; Manfred Rudolph; Dirk Walther; Andre Brodkorb; Marco Duati; Christine O'Connor; Johannes G. Vos","Bis(R-bipyridyl)ruthenium bibenzimidazole complexes (R = H, Me or But): supramolecular arrangement via hydrogen bonds, photo- and electro-chemical properties and reactivity towards carbon dioxide","J. Chem. Soc., Dalton Trans.","2000","","20","3649","3657","10.1039/b003992f","","","0.71073","MoKα","","0.0693","0.0526","","0.1741","0.1482","","","","1.231","1.26","1.26","","","","","has coordinates,has disorder","179802","2020-10-21","18:00:00",""
"7009842","12.3749","0.0003","14.4512","0.0004","16.6108","0.0005","80.763","0.002","88.971","0.002","75.717","0.002","2840.67","0.14","183","2","183","2","","","","","","","","7","P -1","-P 1","2","","","","- C104 H140 F12 N12 O6 P2 Ru2 -","- C104 H140 F12 N12 O6 P2 Ru2 -","- C104 H140 F12 N12 O6 P2 Ru2 -","1","0.5","","Sven Rau; Mario Ruben; Torsten Büttner; Christian Temme; Sylvana Dautz; Helmar Görls; Manfred Rudolph; Dirk Walther; Andre Brodkorb; Marco Duati; Christine O'Connor; Johannes G. Vos","Bis(R-bipyridyl)ruthenium bibenzimidazole complexes (R = H, Me or But): supramolecular arrangement via hydrogen bonds, photo- and electro-chemical properties and reactivity towards carbon dioxide","J. Chem. Soc., Dalton Trans.","2000","","20","3649","3657","10.1039/b003992f","","","0.71073","MoKα","","0.0855","0.0635","","","0.1552","0.1686","","","","","","1.081","","","","has coordinates,has disorder","179802","2020-10-21","18:00:00",""
"7009843","24.474","0.002","13.921","0.001","19.433","0.001","90","","106.843","0.003","90","","6336.9","0.8","183","2","183","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C60 H53 F12 N15 O2 P2 Ru2 -","- C60 H49 F12 N15 O1.5 P2 Ru2 -","- C240 H196 F48 N60 O6 P8 Ru8 -","4","0.5","","Sven Rau; Mario Ruben; Torsten Büttner; Christian Temme; Sylvana Dautz; Helmar Görls; Manfred Rudolph; Dirk Walther; Andre Brodkorb; Marco Duati; Christine O'Connor; Johannes G. Vos","Bis(R-bipyridyl)ruthenium bibenzimidazole complexes (R = H, Me or But): supramolecular arrangement via hydrogen bonds, photo- and electro-chemical properties and reactivity towards carbon dioxide","J. Chem. Soc., Dalton Trans.","2000","","20","3649","3657","10.1039/b003992f","","","0.71073","MoKα","","0.0635","0.0483","","0.1411","0.1246","","","","1.078","1.107","1.107","","","","","has coordinates,has disorder","179802","2020-10-21","18:00:00",""
"7009844","22.029","0.001","16.29","0.001","13.3542","0.0006","90","","122.214","0.002","90","","4054.5","0.4","183","2","183","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C36 H32 F6 N8 O9 Ru S2 -","- C36 H26 F6 N8 O9 Ru S2 -","- C144 H104 F24 N32 O36 Ru4 S8 -","4","0.5","","Sven Rau; Mario Ruben; Torsten Büttner; Christian Temme; Sylvana Dautz; Helmar Görls; Manfred Rudolph; Dirk Walther; Andre Brodkorb; Marco Duati; Christine O'Connor; Johannes G. Vos","Bis(R-bipyridyl)ruthenium bibenzimidazole complexes (R = H, Me or But): supramolecular arrangement via hydrogen bonds, photo- and electro-chemical properties and reactivity towards carbon dioxide","J. Chem. Soc., Dalton Trans.","2000","","20","3649","3657","10.1039/b003992f","","","0.71073","MoKα","","0.1283","0.0954","","","0.2229","0.2407","","","","","","1.107","","","","has coordinates,has disorder","179802","2020-10-21","18:00:00",""
"7009845","15.5279","0.0011","14.2292","0.001","21.811","0.0015","90","","90","","90","","4819.1","0.6","153","2","153","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C22 H32 Cl2 Mo N2 O2 -","- C22 H32 Cl2 Mo N2 O2 -","- C176 H256 Cl16 Mo8 N16 O16 -","8","2","","del Río, Diego; Montilla, Francisco; Pastor, Antonio; Galindo, Agustín; Monge, Angeles; Gutiérrez-Puebla, Enrique","Steric versus electronic effects in six-co-ordinate d0 cis-bis(imido) molybdenum complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","14","2433","","10.1039/b003998p","","","0.71073","MoKα","","0.0366","0.0292","","0.0639","0.0606","","","","1.032","1.037","1.037","","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009846","11.889","0.002","11.694","0.002","13.953","0.003","90","","90","","90","","1939.9","0.6","293","2","293","2","","","","","","","","6","C m c 21","C 2c -2","36","","","","- C16 H24 N4 O2 S Zn -","- C16 H24 N4 O2 S Zn -","- C64 H96 N16 O8 S4 Zn4 -","4","0.5","","Hammes, Brian S.; Carrano, Carl J.","Structure and physical properties of several pseudotetrahedral zinc complexes containing a new alkyl thiolate heteroscorpionate ligand","Journal of the Chemical Society, Dalton Transactions","2000","","19","3304","","10.1039/b004037l","","","0.71073","MoKα","","0.0315","0.0303","","0.0973","0.081","","","","0.914","0.91","0.91","","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009847","8.7338","0.0002","14.671","0.0005","24.6109","0.0006","90","","96.225","0.002","90","","3134.89","0.15","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H42 N8 S2 Zn -","- C28 H42 N8 S2 Zn -","- C112 H168 N32 S8 Zn4 -","4","1","","Hammes, Brian S.; Carrano, Carl J.","Structure and physical properties of several pseudotetrahedral zinc complexes containing a new alkyl thiolate heteroscorpionate ligand","Journal of the Chemical Society, Dalton Transactions","2000","","19","3304","","10.1039/b004037l","","","0.71073","MoKα","","0.0551","0.0418","","0.1173","0.1077","","","","1.047","1.088","1.088","","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009848","9.905","0.002","13.758","0.002","14.787","0.003","67.815","0.012","87.213","0.014","71.473","0.014","1763.3","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H21 Cl N4 S Zn -","- C14 H21 Cl N4 S Zn -","- C56 H84 Cl4 N16 S4 Zn4 -","4","2","","Hammes, Brian S.; Carrano, Carl J.","Structure and physical properties of several pseudotetrahedral zinc complexes containing a new alkyl thiolate heteroscorpionate ligand","Journal of the Chemical Society, Dalton Transactions","2000","","19","3304","","10.1039/b004037l","","","0.71073","MoKα","","0.0488","0.0371","","0.1035","0.094","","","","1.059","1.079","1.079","","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009849","8.563","0.002","33.701","0.005","9.454","0.003","90","","93.58","0.02","90","","2722.9","1.1","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C30 H50 F5 N4 O S2 Zn -","- C20 H21 F5 N4 O S2 Zn -","- C80 H84 F20 N16 O4 S8 Zn4 -","4","1","","Hammes, Brian S.; Carrano, Carl J.","Structure and physical properties of several pseudotetrahedral zinc complexes containing a new alkyl thiolate heteroscorpionate ligand","Journal of the Chemical Society, Dalton Transactions","2000","","19","3304","","10.1039/b004037l","","","0.71073","MoKα","","0.1039","0.0717","","0.336","0.2177","","","","1.069","1.07","1.07","","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009850","8.0583","0.0004","6.4558","0.0003","18.8222","0.001","90","","95.591","0.001","90","","974.52","0.08","173","2","173","2","","","","","","","satd 1M NaClO4","5","P 1 21/n 1","-P 2yn","14","PMDPA","N-piperidinomethane-1,1-methanediphosphonic acid","","- C6 H15 N O6 P2 -","- C6 H15 N O6 P2 -","- C24 H60 N4 O24 P8 -","4","1","","Jensen, Mark P.; Beitz, James V.; Rogers, Robin D.; Nash, Kenneth L.","Thermodynamics and hydration of the europium complexes of a nitrogen heterocycle methane-1,1-diphosphonic acid","Journal of the Chemical Society, Dalton Transactions","2000","","18","3058","","10.1039/b004038j","","","0.71073","MoKα","","0.0924","0.0753","","0.2297","0.1973","","","","1.166","1.178","1.178","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7009851","16.854","0.002","15.6263","0.0019","19.144","0.002","90","","114.785","0.002","90","","4577.5","0.9","193","2","193","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C43 H54 N6 Ni O13 -","- C43 H45 N6 Ni O13 -","- C172 H180 N24 Ni4 O52 -","4","1","","Biradha, Kumar; Fujita, Makoto","Co-ordination polymers containing square grids of dimension 15 × 15 Å †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3805","","10.1039/b004054l","","","0.71073","MoKα","","0.0776","0.0656","","","0.2037","0.2178","","","","","","1.046","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009852","13.6359","0.0018","24.875","0.003","15.217","0.002","90","","99.604","0.002","90","","5089.2","1.1","193","2","193","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C60 H42 N8 Ni O10 -","- C60 H42 N8 Ni O10 -","- C240 H168 N32 Ni4 O40 -","4","1","","Biradha, Kumar; Fujita, Makoto","Co-ordination polymers containing square grids of dimension 15 × 15 Å †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3805","","10.1039/b004054l","","","0.71073","MoKα","","0.1517","0.073","","","0.1813","0.2176","","","","","","0.986","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009853","13.645","0.003","24.777","0.005","15.457","0.003","90","","99.56","0.005","90","","5153.2","1.8","193","2","193","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C62 H37 N8 Ni O6 -","- C62 H36 N8 Ni O6 -","- C248 H144 N32 Ni4 O24 -","4","0.5","","Biradha, Kumar; Fujita, Makoto","Co-ordination polymers containing square grids of dimension 15 × 15 Å †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3805","","10.1039/b004054l","","","0.71073","MoKα","","0.2365","0.0772","","","0.1511","0.1859","","","","","","0.811","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009854","13.8097","0.0018","24.7","0.003","15.2856","0.0019","90","","101.982","0.003","90","","5100.3","1.1","193","2","193","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C60 H42 Cu N8 O10 -","- C60 H42 Cu N8 O10 -","- C240 H168 Cu4 N32 O40 -","4","1","","Biradha, Kumar; Fujita, Makoto","Co-ordination polymers containing square grids of dimension 15 × 15 Å †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3805","","10.1039/b004054l","","","0.71073","MoKα","","0.1894","0.0764","","","0.1819","0.2386","","","","","","0.934","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009855","13.7922","0.0015","24.529","0.003","15.5154","0.0017","90","","101.439","0.002","90","","5144.7","1","193","2","193","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C62 H37 Cu N8 O6 -","- C62 H36 Cu N8 O6 -","- C248 H144 Cu4 N32 O24 -","4","0.5","","Biradha, Kumar; Fujita, Makoto","Co-ordination polymers containing square grids of dimension 15 × 15 Å †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3805","","10.1039/b004054l","","","0.71073","MoKα","","0.1742","0.0703","","","0.1752","0.2104","","","","","","0.857","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009856","9.905","0.002","18.973","0.005","23.009","0.006","90","","90","","90","","4324","1.8","193","2","193","2","","","","","","","","5","I b a 2","I 2 -2c","45","","","","- C48 H36 N6 Ni O8 -","- C48 H36 N6 Ni O8 -","- C192 H144 N24 Ni4 O32 -","4","0.5","","Biradha, Kumar; Fujita, Makoto","Co-ordination polymers containing square grids of dimension 15 × 15 Å †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3805","","10.1039/b004054l","","","0.71073","MoKα","","0.1582","0.0863","","","0.2244","0.2487","","","","","","1.1","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009857","12.9406","0.0013","19.0638","0.0019","13.2244","0.0014","90","","107.734","0.002","90","","3107.4","0.6","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H30 Cu N4 O8 -","- C32 H30 Cu N4 O8 -","- C128 H120 Cu4 N16 O32 -","4","1","","Biradha, Kumar; Fujita, Makoto","Co-ordination polymers containing square grids of dimension 15 × 15 Å †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3805","","10.1039/b004054l","","","0.71073","MoKα","","0.058","0.0351","","","0.0873","0.0933","","","","","","0.922","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009858","25.142","0.003","7.3605","0.001","11.8715","0.0015","90","","109.488","0.002","90","","2071.1","0.5","193","2","193","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H16 Cu N4 O6 -","- C24 H16 Cu N4 O6 -","- C96 H64 Cu4 N16 O24 -","4","0.5","","Biradha, Kumar; Fujita, Makoto","Co-ordination polymers containing square grids of dimension 15 × 15 Å †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3805","","10.1039/b004054l","","","0.71073","MoKα","","0.0612","0.0385","","","0.0872","0.0929","","","","","","0.974","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009859","12.753","0.001","8.495","0.0005","13.35","0.001","90","","95.58","0.02","90","","1439.44","0.18","293","2","293","2","","","","","","","","6","P 1 2/n 1","-P 2yac","13","","Oxobis[trichlorobis(seleninylchloride)titanium(IV)] dichloromethane solvate","","- C H2 Cl16 O5 Se4 Ti2 -","- C H2 Cl16 O5 Se4 Ti2 -","- C2 H4 Cl32 O10 Se8 Ti4 -","2","0.5","","Fausto Calderazzo; Michele D'Attoma; Fabio Marchetti; Guido Pampaloni","Reactivity of SeOCl2 with titanium and zirconium tetrachlorides. The unexpected formation of a μ-oxo-bridged titanium(IV) derivative","J. Chem. Soc., Dalton Trans.","2000","","15","2497","2498","10.1039/b004057f","","","0.71073","MoKα","","0.0677","0.0404","","","0.0799","0.0889","","","","","","1.034","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009860","8.648","0.001","24.018","0.003","9.588","0.002","90","","112.71","0.02","90","","1837.1","0.6","0","","180","","","","","","","","?","7","P 1 21/n 1","-P 2yn","14","","[Nb(eta-C5H5)2(NtBu)(OSO2CF3)]","","- C15 H19 F3 N Nb O3 S -","- C15 H19 F3 N Nb O3 S -","- C60 H76 F12 N4 Nb4 O12 S4 -","4","1","","Humphries, Martin J.; Douthwaite, Richard E.; Green, Malcolm L. H.","Synthesis and reactions of (tert-butylimido)bis(η-cyclopentadienyl)niobium cations: NMR evidence for d0 olefin cations [Nb{(η-C5H5)2}(NtBu)(η-C2H4)][B(C6F5)4] and [Nb{(η-C5H4)CMe2(η-C5H4)}(NtBu)(η-C2H3Me)][B(C6F5)4]","Journal of the Chemical Society, Dalton Transactions","2000","","17","2952","","10.1039/b004062m","","","0.71073","MoKα","","","0.041","","","0.0488","","","","","1.0657","1.0657","","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009861","8.868","0.001","18.934","0.002","13.641","0.002","90","","92.12","0.02","90","","2288.8","0.5","0","","180","","","","","","","","?","8","P 1 21/n 1","-P 2yn","14","","[Nb(eta-C5H5)2(NtBu)(PMe3)][CF3SO3]","","- C18 H28 F3 N Nb O3 P S -","- C18 H28 F3 N Nb O3 P S -","- C72 H112 F12 N4 Nb4 O12 P4 S4 -","4","1","","Humphries, Martin J.; Douthwaite, Richard E.; Green, Malcolm L. H.","Synthesis and reactions of (tert-butylimido)bis(η-cyclopentadienyl)niobium cations: NMR evidence for d0 olefin cations [Nb{(η-C5H5)2}(NtBu)(η-C2H4)][B(C6F5)4] and [Nb{(η-C5H4)CMe2(η-C5H4)}(NtBu)(η-C2H3Me)][B(C6F5)4]","Journal of the Chemical Society, Dalton Transactions","2000","","17","2952","","10.1039/b004062m","","","0.71073","MoKα","","","0.0327","","","0.0396","","","","","0.9767","0.9767","","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009862","11.576","0.003","43.097","0.019","15.918","0.003","90","","99.816","0.017","90","","7825","4","293","","293","","","","","","","","see text","6","P 1 21/c 1","-P 2ybc","14","","","","- C64 H54 Cr2 N12 S8 Se12 -","- C64 H54 Cr2 N12 S8 Se12 -","- C256 H216 Cr8 N48 S32 Se48 -","4","1","","Turner, Scott S.; Le Pevelen, Delphine; Day, Peter; Prout, Keith","TTF based charge transfer salts of [Cr(NCS)4(phen)]−: bulk magnetic order and crystal structures of the TTF, TMTTF (tetramethyltetrathiafulvalene) and TMTSF (tetramethyltetraselenafulvalene) derivatives †","Journal of the Chemical Society, Dalton Transactions","2000","","16","2739","","10.1039/b004140h","","","1.5418","CuKα","","","0.0542","","","","0.0605","","","","","","1.026","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009863","8.858","0.0006","12.905","0.0005","16.341","0.0011","71.756","0.004","80.504","0.003","80.119","0.004","1735.36","0.18","250","","250","","","","","","","","see text","6","P -1","-P 1","2","","","","- C27 H22 Cl2 Cr N6 S8 -","- C27 H22 Cl2 Cr N6 S8 -","- C54 H44 Cl4 Cr2 N12 S16 -","2","1","","Turner, Scott S.; Le Pevelen, Delphine; Day, Peter; Prout, Keith","TTF based charge transfer salts of [Cr(NCS)4(phen)]−: bulk magnetic order and crystal structures of the TTF, TMTTF (tetramethyltetrathiafulvalene) and TMTSF (tetramethyltetraselenafulvalene) derivatives †","Journal of the Chemical Society, Dalton Transactions","2000","","16","2739","","10.1039/b004140h","","","0.71073","MoKα","","","0.0441","","","","0.0399","","","","","","1.084","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009864","11.505","0.002","43","0.02","15.632","0.003","90","","100.033","0.015","90","","7615","4","120","","120","","","","","","","","see text","7","P 1 21/c 1","-P 2ybc","14","","","","- C62.5 H53 Cl Cr2 N12 S8 Se12 -","- C62.5 H53 Cl Cr2 N12 S8 Se12 -","- C250 H212 Cl4 Cr8 N48 S32 Se48 -","4","1","","Turner, Scott S.; Le Pevelen, Delphine; Day, Peter; Prout, Keith","TTF based charge transfer salts of [Cr(NCS)4(phen)]−: bulk magnetic order and crystal structures of the TTF, TMTTF (tetramethyltetrathiafulvalene) and TMTSF (tetramethyltetraselenafulvalene) derivatives †","Journal of the Chemical Society, Dalton Transactions","2000","","16","2739","","10.1039/b004140h","","","1.5418","CuKα","","","0.0509","","","","0.0573","","","","","","1.022","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009865","15.289","0.002","8.466","0.003","21.015","0.004","90","","95.713","0.011","90","","2706.6","1.1","293","","293","","","","","","","","see text","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H12 Cr N6 S8 -","- C22 H12 Cr N6 S8 -","- C88 H48 Cr4 N24 S32 -","4","1","","Turner, Scott S.; Le Pevelen, Delphine; Day, Peter; Prout, Keith","TTF based charge transfer salts of [Cr(NCS)4(phen)]−: bulk magnetic order and crystal structures of the TTF, TMTTF (tetramethyltetrathiafulvalene) and TMTSF (tetramethyltetraselenafulvalene) derivatives †","Journal of the Chemical Society, Dalton Transactions","2000","","16","2739","","10.1039/b004140h","","","1.5418","CuKα","","","0.0394","","","","0.0448","","","","","","1.088","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009866","13.0798","0.0003","11.432","0.0003","13.2985","0.0004","90","","106.394","0.001","90","","1907.66","0.09","293","2","293","2","","","","","","","","8","P 1 21 1","P 2yb","4","","","","- C35 H43 Cl2 F3 O3 P2 Pd S -","- C35 H43 Cl2 F3 O3 P2 Pd S -","- C70 H86 Cl4 F6 O6 P4 Pd2 S2 -","2","1","","Drago, Daniela; Pregosin, Paul S.","Allyl, olefin, aryl and alkyl organometallic palladium complexes of 1,2-bis[(2R,5R)-2,5-dimethylphospholanyl]benzene","Journal of the Chemical Society, Dalton Transactions","2000","","18","3191","","10.1039/b004148n","","","0.71073","MoKα","","0.1441","0.0546","","","0.1055","0.1284","","","","","","0.822","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009867","10.6352","0.0016","14.242","0.002","17.12","0.003","90","","90","","90","","2593.1","0.7","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C25 H31 F5 P2 Pd -","- C25 H31 F5 P2 Pd -","- C100 H124 F20 P8 Pd4 -","4","1","","Drago, Daniela; Pregosin, Paul S.","Allyl, olefin, aryl and alkyl organometallic palladium complexes of 1,2-bis[(2R,5R)-2,5-dimethylphospholanyl]benzene","Journal of the Chemical Society, Dalton Transactions","2000","","18","3191","","10.1039/b004148n","","","0.71073","MoKα","","0.09","0.0554","","","0.0967","0.1103","","","","","","1.146","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009868","21.598","0.004","22.296","0.005","27.992","0.006","90","","90","","90","","13480","5","143","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C69 H69 I3 N17 U -","- C69 H69 I3 N17 U -","- C552 H552 I24 N136 U8 -","8","1","","Wietzke, Raphaël; Mazzanti, Marinella; Latour, Jean-Marc; Pécaut, Jacques","Solution and solid state structures of uranium(III) and lanthanum(III) iodide complexes of tetradentate tripodal neutral N-donor ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","22","4167","","10.1039/b004179n","","","0.71073","MoKα","","0.1121","0.0422","","","0.0942","0.1235","","","","","","0.916","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009869","9.6979","0.0006","15.3561","0.0009","9.9489","0.0006","90","","115.894","0.001","90","","1332.86","0.14","143","2","193","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C23 H23 I3 N5 U -","- C23 H23 I3 N5 U -","- C46 H46 I6 N10 U2 -","2","1","","Wietzke, Raphaël; Mazzanti, Marinella; Latour, Jean-Marc; Pécaut, Jacques","Solution and solid state structures of uranium(III) and lanthanum(III) iodide complexes of tetradentate tripodal neutral N-donor ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","22","4167","","10.1039/b004179n","","","0.71073","MoKα","","0.0438","0.0425","","","0.1091","0.11","","","","","","1.034","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009870","9.718","0.0005","15.3889","0.0008","9.9741","0.0005","90","","115.826","0.001","90","","1342.64","0.12","143","2","193","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C23 H23 I3 La N5 -","- C23 H23 I3 La N5 -","- C46 H46 I6 La2 N10 -","2","1","","Wietzke, Raphaël; Mazzanti, Marinella; Latour, Jean-Marc; Pécaut, Jacques","Solution and solid state structures of uranium(III) and lanthanum(III) iodide complexes of tetradentate tripodal neutral N-donor ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","22","4167","","10.1039/b004179n","","","0.71073","MoKα","","0.0396","0.0388","","","0.1037","0.1043","","","","","","1.041","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009871","8.84","0.001","11.215","0.002","15.454","0.002","70.95","0.01","85.29","0.01","74.08","0.02","1392.6","0.4","203","2","203","2","","","","","","","","5","P -1","-P 1","2","","","","- C3 H12 I10 N6 S3 -","- C3 H12 I10 N6 S3 -","- C6 H24 I20 N12 S6 -","2","1","","Boyle, Philip D.; Christie, Jill; Dyer, Thomas; Godfrey, Stephen M.; Howson, Ian R.; McArthur, Christina; Omar, Bashie; Pritchard, Robin G.; Williams, Gareth Rh.","Further structural motifs from the reactions of thioamides with diiodine and the interhalogens iodine monobromide and iodine monochloride: an FT-Raman and crystallographic study †","Journal of the Chemical Society, Dalton Transactions","2000","","18","3106","","10.1039/b004182n","","","0.71073","MoKα","","0.0473","0.0349","","","0.0776","0.0821","","","","","","1.034","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009872","14.019","0.002","9.329","0.002","13.596","0.001","90","","104.87","0.01","90","","1718.6","0.5","203","2","203","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C0.5 H2 I1.5 N S0.5 -","- C0.5 H2 I1.5 N S0.5 -","- C8 H32 I24 N16 S8 -","16","2","","Boyle, Philip D.; Christie, Jill; Dyer, Thomas; Godfrey, Stephen M.; Howson, Ian R.; McArthur, Christina; Omar, Bashie; Pritchard, Robin G.; Williams, Gareth Rh.","Further structural motifs from the reactions of thioamides with diiodine and the interhalogens iodine monobromide and iodine monochloride: an FT-Raman and crystallographic study †","Journal of the Chemical Society, Dalton Transactions","2000","","18","3106","","10.1039/b004182n","","","0.71069","MoKα","","0.0276","0.023","","","0.0554","0.0571","","","","","","1.093","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009873","14.743","0.003","16.368","0.002","15.231","0.002","90","","90.29","0.02","90","","3675.4","1","203","2","203","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C6 H16 I4 N4 S2 -","- C6 H16 I4 N4 S2 -","- C48 H128 I32 N32 S16 -","8","2","","Boyle, Philip D.; Christie, Jill; Dyer, Thomas; Godfrey, Stephen M.; Howson, Ian R.; McArthur, Christina; Omar, Bashie; Pritchard, Robin G.; Williams, Gareth Rh.","Further structural motifs from the reactions of thioamides with diiodine and the interhalogens iodine monobromide and iodine monochloride: an FT-Raman and crystallographic study †","Journal of the Chemical Society, Dalton Transactions","2000","","18","3106","","10.1039/b004182n","","","0.71073","MoKα","","0.0714","0.0529","","","0.1246","0.1354","","","","","","1.038","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009874","10.185","0.006","18.738","0.006","13.507","0.004","90","","107.8","0.04","90","","2454.4","1.9","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C56 H56 N2 O2 P4 Re -","- C56 H56 N2 O2 P4 Re -","- C112 H112 N4 O4 P8 Re2 -","2","0.5","","Carvalho, M. Fernanda N. N.; Galvão, Adelino M.; Pombeiro, Armando J. L.","Proton addition and hydrogen-bond formation in reactions of the dicyano-complex [NBu4][trans-Re(CN)2(dppe)2] with protic reagents","Journal of the Chemical Society, Dalton Transactions","2000","","19","3393","","10.1039/b004189k","","","0.71069","MoKα","","0.271","0.1391","","0.4059","0.2992","","","","1.085","1.271","1.271","","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009875","11.713","","13.432","","17.179","","90","","96.48","","90","","2685.49","","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C60 H60 N2 O2 P4 Re -","- C60 H60 N2 O2 P4 Re -","- C120 H120 N4 O4 P8 Re2 -","2","0.5","","Carvalho, M. Fernanda N. N.; Galvão, Adelino M.; Pombeiro, Armando J. L.","Proton addition and hydrogen-bond formation in reactions of the dicyano-complex [NBu4][trans-Re(CN)2(dppe)2] with protic reagents","Journal of the Chemical Society, Dalton Transactions","2000","","19","3393","","10.1039/b004189k","","","1.54247","CuKα","","0.1315","0.081","","0.2645","0.1999","","","","1.09","1.042","1.042","","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009876","9.529","0.001","11.251","0.004","12.966","0.001","87.14","0.02","81.02","0.01","74.65","0.02","1324","0.5","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C54 H100 F6 N2 O4 P4 Re -","- C58 H50 F6 N2 O4 P4 Re -","- C58 H50 F6 N2 O4 P4 Re -","1","0.5","","Carvalho, M. Fernanda N. N.; Galvão, Adelino M.; Pombeiro, Armando J. L.","Proton addition and hydrogen-bond formation in reactions of the dicyano-complex [NBu4][trans-Re(CN)2(dppe)2] with protic reagents","Journal of the Chemical Society, Dalton Transactions","2000","","19","3393","","10.1039/b004189k","","","0.71069","MoKα","","0.0469","0.0408","","0.1109","0.0918","","","","1.138","0.971","0.971","","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009877","13.474","0.003","18.692","0.002","10.155","0.003","90","","107.78","0.01","90","","2435.4","0.9","293","2","293","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C56 H56 N2 O2 P4 Re -","- C56 H56 N2 O2 P4 Re -","- C112 H112 N4 O4 P8 Re2 -","2","0.5","","Carvalho, M. Fernanda N. N.; Galvão, Adelino M.; Pombeiro, Armando J. L.","Proton addition and hydrogen-bond formation in reactions of the dicyano-complex [NBu4][trans-Re(CN)2(dppe)2] with protic reagents","Journal of the Chemical Society, Dalton Transactions","2000","","19","3393","","10.1039/b004189k","","","0.71069","MoKα","","0.1796","0.0803","","0.169","0.1172","","","","1.173","1.144","1.144","","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009878","9.3859","0.0007","17.755","0.0014","16.2444","0.0013","90","","93.291","0.002","90","","2702.6","0.4","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H27 Mo2 O6 P -","- C30 H27 Mo2 O6 P -","- C120 H108 Mo8 O24 P4 -","4","1","","Adams, Harry; Biebricher, Andreas; Gay, Sally R.; Hamilton, Trevor; McHugh, Paul E.; Morris, Michael J.; Mays, Martin J.","Reactions of [Mo2(μ-RC2R)(CO)4Cp2] (R = CO2Me, Cp = η-C5H5) with P2Ph4, PPh2H and R1SH (R1 = Et, Pri, C6H4Me-p or But): stabilisation of μ-vinyl complexes by chelating substituents","Journal of the Chemical Society, Dalton Transactions","2000","","17","2983","","10.1039/b004210m","","","0.71073","MoKα","","0.065","0.046","","","0.1013","0.1081","","","","","","0.937","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009879","9.971","0.0006","15.3616","0.0009","14.0659","0.0009","90","","92.476","0.001","90","","2152.5","0.2","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C21 H24 Mo2 O6 S -","- C21 H24 Mo2 O6 S -","- C84 H96 Mo8 O24 S4 -","4","1","","Adams, Harry; Biebricher, Andreas; Gay, Sally R.; Hamilton, Trevor; McHugh, Paul E.; Morris, Michael J.; Mays, Martin J.","Reactions of [Mo2(μ-RC2R)(CO)4Cp2] (R = CO2Me, Cp = η-C5H5) with P2Ph4, PPh2H and R1SH (R1 = Et, Pri, C6H4Me-p or But): stabilisation of μ-vinyl complexes by chelating substituents","Journal of the Chemical Society, Dalton Transactions","2000","","17","2983","","10.1039/b004210m","","","0.71073","MoKα","","0.0589","0.0487","","","0.1181","0.1266","","","","","","0.658","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009880","11.065","0.009","13.425","0.005","28.068","0.011","96.6","0.03","92.23","0.05","102.99","0.05","4027","4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C97 H74 N8 Zn1.5 -","- C76 H50 N8 Zn1.5 -","- C152 H100 N16 Zn3 -","2","1","","Shukla, Atindra D.; Dave, Paresh C.; Suresh, Eringathodi; Das, Amitava; Dastidar, Parthasarathi","Multicomponent Zn-tetraphenylporphyrins: syntheses, characterization and their self assembly in the solid state","Journal of the Chemical Society, Dalton Transactions","2000","","23","4459","","10.1039/b004211k","","","0.7093","MoK/a","","0.1734","0.1052","","","0.2785","0.3166","","","","","","1.005","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009881","18.458","0.008","13.614","0.004","40.599","0.01","90","","98.98","0.03","90","","10077","6","293","2","293","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C119 H88 N10 Zn2 -","- C98 H64 N10 Zn2 -","- C392 H256 N40 Zn8 -","4","1","","Shukla, Atindra D.; Dave, Paresh C.; Suresh, Eringathodi; Das, Amitava; Dastidar, Parthasarathi","Multicomponent Zn-tetraphenylporphyrins: syntheses, characterization and their self assembly in the solid state","Journal of the Chemical Society, Dalton Transactions","2000","","23","4459","","10.1039/b004211k","","","0.7093","MoK/a","","0.147","0.0749","","","0.2133","0.2364","","","","","","1.179","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009882","18.52","0.03","13.474","0.011","40.29","0.011","90","","99.76","0.06","90","","9908","18","293","2","293","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C116 H79 N13 O6 Zn2 -","- C98 H64 N10 Zn2 -","- C392 H256 N40 Zn8 -","4","1","","Shukla, Atindra D.; Dave, Paresh C.; Suresh, Eringathodi; Das, Amitava; Dastidar, Parthasarathi","Multicomponent Zn-tetraphenylporphyrins: syntheses, characterization and their self assembly in the solid state","Journal of the Chemical Society, Dalton Transactions","2000","","23","4459","","10.1039/b004211k","","","0.7093","MoK/a","","0.1143","0.0799","","","0.2256","0.24","","","","","","1.577","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009883","11.583","0.001","28.557","0.003","16.783","0.002","90","","97.817","0.001","90","","5499.8","1","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C59 H59 O5 P4 Ru2 -","- C59 H56 O5 P4 Ru2 -","- C236 H224 O20 P16 Ru8 -","4","1","","Gao, Yuan; Kuncheria, Joshi K.; Jenkins, Hilary A.; Puddephatt, Richard J.; Yap, Glenn P. A.","The interconversion of formic acid and hydrogen/carbon dioxide using a binuclear ruthenium complex catalyst","Journal of the Chemical Society, Dalton Transactions","2000","","18","3212","","10.1039/b004234j","","","0.71073","MoKα","","0.056","0.0414","","0.0955","0.089","","","","1.114","1.168","1.168","","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009884","12.4371","0.0011","17.804","0.003","27.39","0.004","90","","92.511","0.008","90","","6059.1","1.5","295","2","295","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C55 H44 B F4 O5 P4 Ru2 -","- C55 H44 B F2 O5 P4 Ru2 -","- C220 H176 B4 F8 O20 P16 Ru8 -","4","1","","Gao, Yuan; Kuncheria, Joshi K.; Jenkins, Hilary A.; Puddephatt, Richard J.; Yap, Glenn P. A.","The interconversion of formic acid and hydrogen/carbon dioxide using a binuclear ruthenium complex catalyst","Journal of the Chemical Society, Dalton Transactions","2000","","18","3212","","10.1039/b004234j","","","0.71073","MoKα","","0.2108","0.1154","","0.4324","0.3287","","","","1.064","1.272","1.272","","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009885","11.295","0.003","11.294","0.002","20.57","0.006","90.08","0.02","89.93","0.02","120.03","0.01","2271.8","1","293","2","293","2","","","","","","","","6","P 31","P 31","144","","","","- C24 H21 Co F12 N2 O7 -","- C24 H21 Co F12 N2 O7 -","- C72 H63 Co3 F36 N6 O21 -","3","1","","Caneschi, Andrea; Gatteschi, Dante; Lalioti, Nikolia; Sangregorio, Claudio; Sessoli, Roberta","Supramolecular interactions and magnetism of metal‒radical chains †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3907","","10.1039/b004244g","","","0.71069","MoKa","","0.0682","0.0433","","0.1345","0.1179","","","","1.043","1.066","1.066","","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009886","11.249","0.001","11.254","0.004","20.307","0.006","90.03","0.03","90.03","0.02","119.95","0.02","2227.5","1.1","293","2","293","2","","","","","","","","6","P 32","P 32","145","","","","- C24 H21 Co F12 N2 O6 -","- C24 H21 Co F12 N2 O6 -","- C72 H63 Co3 F36 N6 O18 -","3","1","","Caneschi, Andrea; Gatteschi, Dante; Lalioti, Nikolia; Sangregorio, Claudio; Sessoli, Roberta","Supramolecular interactions and magnetism of metal‒radical chains †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3907","","10.1039/b004244g","","","0.71069","MoKa","","0.0675","0.0515","","0.1556","0.1349","","","","1.067","1.047","1.047","","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009887","27.342","0.004","13.973","0.004","22.922","0.003","89.94","0.02","125.794","0.012","90.03","0.02","7103","3","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C48.5 H42 Cl1.5 F24 Mn2 N4 O12 -","- C48.5 H42 Cl1.5 F24 Mn2 N4 O12 -","- C194 H168 Cl6 F96 Mn8 N16 O48 -","4","0.5","","Caneschi, Andrea; Gatteschi, Dante; Lalioti, Nikolia; Sangregorio, Claudio; Sessoli, Roberta","Supramolecular interactions and magnetism of metal‒radical chains †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3907","","10.1039/b004244g","","","0.71069","MoKa","","0.2324","0.107","","0.3975","0.2968","","","","1.044","1.184","1.184","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009888","15.9346","0.0005","7.4039","0.0003","16.2092","0.0006","90","","111.885","0.001","90","","1774.52","0.11","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C4 H16 N3 O16 P4 Zn5 -","- C4 N3 O16 P4 Zn5 -","- C16 N12 O64 P16 Zn20 -","4","1","","Neeraj, S.; Natarajan, Srinivasan; Rao, C. N. R.","Zn4O4 tetrameric clusters in a zinc phosphate with channels","Journal of the Chemical Society, Dalton Transactions","2000","","15","2499","","10.1039/b004245p","","","0.71073","MoKα","","0.0764","0.045","","0.1064","0.0937","","","","1.061","1.11","1.11","","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009889","8.948","0.002","16.647","0.003","9.4732","0.0018","90","","97.854","0.019","90","","1397.9","0.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Tetracarbonyl(4-methylthiazole-2-carbodithiomethylester)Cr(0)","","- C10 H7 Cr N O4 S3 -","- C10 H7 Cr N O4 S3 -","- C40 H28 Cr4 N4 O16 S12 -","4","1","","Helgard G. Raubenheimer; Eugene K. Marais; Stephanie Cronje; Catharine Esterhuysen (neé Thompson); Gert J. Kruger","Synthesis and crystallographic characterization of thiazole-2-dithiocarboxylate methyl ester complexes of chromium, tungsten and iron carbonyls","J. Chem. Soc., Dalton Trans.","2000","","17","3016","3021","10.1039/b004251j","","","0.71069","MoKα","","0.05","0.037","","0.036","0.036","","","","1.104","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009890","9.312","0.002","7.317","0.003","10.741","0.004","90","","94.38","0.02","90","","729.7","0.4","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","Tricarbonyl(benzothiazole-2-carbodithiomethylester)Fe(0)","","- C12 H7 Fe N O3 S3 -","- C12 H7 Fe N O3 S3 -","- C24 H14 Fe2 N2 O6 S6 -","2","1","","Helgard G. Raubenheimer; Eugene K. Marais; Stephanie Cronje; Catharine Esterhuysen (neé Thompson); Gert J. Kruger","Synthesis and crystallographic characterization of thiazole-2-dithiocarboxylate methyl ester complexes of chromium, tungsten and iron carbonyls","J. Chem. Soc., Dalton Trans.","2000","","17","3016","3021","10.1039/b004251j","","","0.71069","MoKα","","","0.034","","","0.031","","","","1.073","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009891","21.205","0.004","9.0533","0.0018","24.43","0.005","90","","95.67","0.03","90","","4667","1.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C40 H70 P4 Pt2 S -","- C40 H70 P4 Pt2 S -","- C160 H280 P16 Pt8 S4 -","4","1","","Zhang, Hongkui; Lee, Albert W. M.; Wong, Wai-Yeung; Yuen, Mabel S. M.","Synthesis, structures and properties of platinum(II) complexes of oligoacetylenic sulfides","Journal of the Chemical Society, Dalton Transactions","2000","","20","3675","","10.1039/b004253f","","","0.71073","MoKα","","0.0531","0.0291","","","0.0845","0.1085","","","","","","0.704","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009892","7.906","0.001","14.018","0.001","19.069","0.001","98.66","0.01","92.38","0.01","97.83","0.01","2065.6","0.3","298.2","","298.2","","","","","","","","","6","P -1","-P 1","2","","","","- C38 H54 N2 Pt S2 Si2 -","- C38 H54 N2 Pt S2 Si2 -","- C76 H108 N4 Pt2 S4 Si4 -","2","1","","Zhang, Hongkui; Lee, Albert W. M.; Wong, Wai-Yeung; Yuen, Mabel S. M.","Synthesis, structures and properties of platinum(II) complexes of oligoacetylenic sulfides","Journal of the Chemical Society, Dalton Transactions","2000","","20","3675","","10.1039/b004253f","","","0.7107","MoKalpha","","","0.0564","","","0.0601","","","","","0.881","0.881","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009893","14.425","0.007","10.168","0.006","16.623","0.008","90","","92.35","0.04","90","","2436","2","203","2","203","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H32 B2 N6 O2 W -","- C21 H32 B2 N6 O2 W -","- C84 H128 B8 N24 O8 W4 -","4","1","","Wadepohl, Hubert; Arnold, Ulrich; Kohl, Ute; Pritzkow, Hans; Wolf, Andreas","Hydroboration of metal‒carbon triple bonds †","Journal of the Chemical Society, Dalton Transactions","2000","","20","3554","","10.1039/b004256k","","","0.7107","MoKα","","0.1083","0.0491","","","0.0962","0.1116","","","","","","0.981","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009894","8.829","0.014","12.33","0.02","14.24","0.02","103","0.13","97.29","0.13","97.15","0.13","1479","4","218","2","218","2","","","","","","","","5","P -1","-P 1","2","","","","- C31 H47 B O4 W -","- C31 H47 B O4 W -","- C62 H94 B2 O8 W2 -","2","1","","Wadepohl, Hubert; Arnold, Ulrich; Kohl, Ute; Pritzkow, Hans; Wolf, Andreas","Hydroboration of metal‒carbon triple bonds †","Journal of the Chemical Society, Dalton Transactions","2000","","20","3554","","10.1039/b004256k","","","0.7107","MoKα","","0.0297","0.0262","","","0.0729","0.0746","","","","","","1.071","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009895","19.664","0.011","8.005","0.005","26.158","0.016","90","","95.63","0.05","90","","4098","4","203","2","203","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C41 H46 B2 N6 O2 W -","- C41 H43 B2 N6 O2 W -","- C164 H172 B8 N24 O8 W4 -","4","1","","Wadepohl, Hubert; Arnold, Ulrich; Kohl, Ute; Pritzkow, Hans; Wolf, Andreas","Hydroboration of metal‒carbon triple bonds †","Journal of the Chemical Society, Dalton Transactions","2000","","20","3554","","10.1039/b004256k","","","0.7107","MoKα","","0.1228","0.0584","","","0.1202","0.1411","","","","","","1.009","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009896","10.308","0.008","12.342","0.009","13.508","0.01","84.29","0.06","81","0.06","81.62","0.06","1674","2","203","2","203","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H41 B2 N6 O2 W -","- C34 H41 B2 N6 O2 W -","- C68 H82 B4 N12 O4 W2 -","2","1","","Wadepohl, Hubert; Arnold, Ulrich; Kohl, Ute; Pritzkow, Hans; Wolf, Andreas","Hydroboration of metal‒carbon triple bonds †","Journal of the Chemical Society, Dalton Transactions","2000","","20","3554","","10.1039/b004256k","","","0.7107","MoKα","","0.0373","0.0305","","","0.0746","0.0771","","","","","","1.072","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009897","27.961","0.006","11.809","0.008","10.087","0.006","90","","90","","90","","3331","3","173","","173","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C32 H52 Cl N O Sn -","- C32 H52 Cl N O Sn -","- C128 H208 Cl4 N4 O4 Sn4 -","4","1","","Dakternieks, Dainis; Dunn, Kerri; Schiesser, Carl H.; Tiekink, Edward R. T.","Synthesis of chiral organotin hydrides containing menthyl and oxazoline substituents†","Journal of the Chemical Society, Dalton Transactions","2000","","20","3693","","10.1039/b004259p","","","0.7107","MoKα","","","0.044","","","","0.049","","","","","","2.7","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009898","8.052","0.002","17.781","0.006","10.304","0.003","90","","112.36","0.02","90","","1364.3","0.7","173","","173","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C28 H38 Cl N O Sn -","- C28 H38 Cl N O Sn -","- C56 H76 Cl2 N2 O2 Sn2 -","2","1","","Dakternieks, Dainis; Dunn, Kerri; Schiesser, Carl H.; Tiekink, Edward R. T.","Synthesis of chiral organotin hydrides containing menthyl and oxazoline substituents†","Journal of the Chemical Society, Dalton Transactions","2000","","20","3693","","10.1039/b004259p","","","0.7107","MoKα","","","0.035","","","","0.043","","","","","","2.16","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009899","11.896","0.003","11.297","0.003","18.236","0.008","90","","90","","90","","2450.7","1.4","293","2","293","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C21 H18 Br3 O3 Re Ru -","- C21 H18 Br3 O3 Re Ru -","- C84 H72 Br12 O12 Re4 Ru4 -","4","0.5","","da Silva, Ana C.; Piotrowski, Holger; Mayer, Peter; Polborn, Kurt; Severin, Kay","Heterometallic bromo-bridged complexes with a Re(CO)3 fragment","Journal of the Chemical Society, Dalton Transactions","2000","","17","2960","","10.1039/b004262p","","","0.71073","MoKα","","0.0713","0.0405","","0.084","0.0683","","","","1.203","1.18","1.18","","","","","has coordinates","179802","2020-10-21","18:00:00",""
"7009900","9.6067","0.0013","12.8694","0.0014","16.152","0.004","77.44","0.02","78.986","0.015","71.207","0.011","1829.3","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H28 Br6 O6 Re2 Ru2 -","- C26 H28 Br6 O6 Re2 Ru2 -","- C52 H56 Br12 O12 Re4 Ru4 -","2","1","","da Silva, Ana C.; Piotrowski, Holger; Mayer, Peter; Polborn, Kurt; Severin, Kay","Heterometallic bromo-bridged complexes with a Re(CO)3 fragment","Journal of the Chemical Society, Dalton Transactions","2000","","17","2960","","10.1039/b004262p","","","0.71073","MoKα","","0.054","0.0409","","0.1133","0.1037","","","","1.131","1.143","1.143","","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009901","8.9917","0.0009","10.5637","0.0011","10.9076","0.0011","111.142","0.011","91.8","0.012","96.043","0.012","958.26","0.19","200","3","200","3","","","","","","","","6","P -1","-P 1","2","(CO)3Re(BR3)Ru(C12H18)","","","- C15 H18 Br3 O3 Re Ru -","- C15 H18 Br3 O3 Re Ru -","- C30 H36 Br6 O6 Re2 Ru2 -","2","1","","da Silva, Ana C.; Piotrowski, Holger; Mayer, Peter; Polborn, Kurt; Severin, Kay","Heterometallic bromo-bridged complexes with a Re(CO)3 fragment","Journal of the Chemical Society, Dalton Transactions","2000","","17","2960","","10.1039/b004262p","","","0.71073","MoKα","","0.0415","0.0339","","","0.0803","0.0829","","","","","","0.994","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009902","15.334","0.0011","15.1881","0.0009","17.0439","0.001","90","","91.68","0.008","90","","3967.7","0.4","200","3","200","3","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Re2Br3(CO)6+Ru2Br3(C12H18)2","","","- C30 H36 Br6 O6 Re2 Ru2 -","- C30 H36 Br6 O6 Re2 Ru2 -","- C120 H144 Br24 O24 Re8 Ru8 -","4","1","","da Silva, Ana C.; Piotrowski, Holger; Mayer, Peter; Polborn, Kurt; Severin, Kay","Heterometallic bromo-bridged complexes with a Re(CO)3 fragment","Journal of the Chemical Society, Dalton Transactions","2000","","17","2960","","10.1039/b004262p","","","0.71073","MoKα","","0.0468","0.0266","","","0.0557","0.0594","","","","","","0.883","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009903","9.6576","0.0008","14.8986","0.0017","12.307","0.001","90","","90.434","0.01","90","","1770.7","0.3","200","3","200","3","","","","","","","","6","P 1 21/n 1","-P 2yn","14","cp(Me)5-Rh-Br3-Re-(CO)3","","","- C13 H15 Br3 O3 Re Rh -","- C13 H15 Br3 O3 Re Rh -","- C52 H60 Br12 O12 Re4 Rh4 -","4","1","","da Silva, Ana C.; Piotrowski, Holger; Mayer, Peter; Polborn, Kurt; Severin, Kay","Heterometallic bromo-bridged complexes with a Re(CO)3 fragment","Journal of the Chemical Society, Dalton Transactions","2000","","17","2960","","10.1039/b004262p","","","0.71073","MoKα","","0.0374","0.0257","","","0.0547","0.0566","","","","","","0.981","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009904","9.7123","0.0007","14.9342","0.001","12.2606","0.001","90","","90.574","0.01","90","","1778.3","0.2","200","3","200","3","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C13 H15 Br3 Ir O3 Re -","- C13 H15 Br3 Ir O3 Re -","- C52 H60 Br12 Ir4 O12 Re4 -","4","1","","da Silva, Ana C.; Piotrowski, Holger; Mayer, Peter; Polborn, Kurt; Severin, Kay","Heterometallic bromo-bridged complexes with a Re(CO)3 fragment","Journal of the Chemical Society, Dalton Transactions","2000","","17","2960","","10.1039/b004262p","","","0.71073","MoKα","","0.0341","0.0286","","","0.0715","0.073","","","","","","0.999","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009905","10.086","0.003","13.077","0.003","33.601","0.007","90","","95","0.02","90","","4414.9","1.9","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H22 Mo2 O4 S3 -","- C19 H22 Mo2 O4 S3 -","- C152 H176 Mo16 O32 S24 -","8","2","","Adams, Harry; Allott, Christopher; Bancroft, Matthew N.; Morris, Michael J.","Deconstruction of cyclic and acyclic trithiocarbonates by C‒S and CS bond cleavage during oxidative decarbonylation of dimolybdenum alkyne complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","22","4145","","10.1039/b004293p","","","0.71073","MoKα","","0.0671","0.0406","","0.0913","0.0797","","","","1.061","1.094","1.094","","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009906","8.728","0.004","17.574","0.004","18.489","0.004","90","","90","","90","","2836","1.6","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C28 H26 Mo2 O6 S3 -","- C28 H26 Mo2 O6 S3 -","- C112 H104 Mo8 O24 S12 -","4","1","","Adams, Harry; Allott, Christopher; Bancroft, Matthew N.; Morris, Michael J.","Deconstruction of cyclic and acyclic trithiocarbonates by C‒S and CS bond cleavage during oxidative decarbonylation of dimolybdenum alkyne complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","22","4145","","10.1039/b004293p","","","0.71073","MoKα","","0.03","0.029","","0.0768","0.0758","","","","1.08","1.083","1.083","","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009907","10.051","0.002","12.137","0.004","12.26","0.003","78.15","0.02","77.21","0.01","87.97","0.02","1427.3","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H26 Mo2 O6 S3 -","- C28 H26 Mo2 O6 S3 -","- C56 H52 Mo4 O12 S6 -","2","1","","Adams, Harry; Allott, Christopher; Bancroft, Matthew N.; Morris, Michael J.","Deconstruction of cyclic and acyclic trithiocarbonates by C‒S and CS bond cleavage during oxidative decarbonylation of dimolybdenum alkyne complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","22","4145","","10.1039/b004293p","","","0.71073","MoKα","","0.0983","0.0773","","0.2891","0.1964","","","","1.051","0.909","0.909","","","","","has coordinates,has disorder","179803","2020-10-21","18:00:00",""
"7009908","17.994","0.004","8.482","0.001","16.713","0.004","90","","98.97","0.03","90","","2519.6","0.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H22 Mo2 O8 S3 -","- C23 H22 Mo2 O8 S3 -","- C92 H88 Mo8 O32 S12 -","4","1","","Adams, Harry; Allott, Christopher; Bancroft, Matthew N.; Morris, Michael J.","Deconstruction of cyclic and acyclic trithiocarbonates by C‒S and CS bond cleavage during oxidative decarbonylation of dimolybdenum alkyne complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","22","4145","","10.1039/b004293p","","","0.71073","MoKα","","0.058","0.0393","","0.1625","0.1014","","","","1.139","1.006","1.006","","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009909","8.1474","0.0004","9.5438","0.001","10.7708","0.0007","116.293","0.006","93.363","0.005","102.472","0.006","721.66","0.11","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H16 Fe N2 O2 -","- C18 H16 Fe N2 O2 -","- C36 H32 Fe2 N4 O4 -","2","1","","Georgopoulou, Alexandra S.; Mingos, D. Michael P.; White, Andrew J. P.; Williams, David J.; Horrocks, Benjamin R.; Houlton, Andrew","Bifunctional ferrocene derivatives for molecular recognition of DNA duplexes","Journal of the Chemical Society, Dalton Transactions","2000","","17","2969","","10.1039/b004295l","","","1.54178","CuKα","","0.0538","0.044","","0.1108","0.1048","","","","1.065","1.095","1.095","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009910","7.0023","0.001","17.849","0.002","17.56","0.002","90","","91.526","0.011","90","","2193.9","0.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H24 Br2 Fe N2 O -","- C22 H22 Br2 Fe N2 O -","- C88 H88 Br8 Fe4 N8 O4 -","4","1","","Georgopoulou, Alexandra S.; Mingos, D. Michael P.; White, Andrew J. P.; Williams, David J.; Horrocks, Benjamin R.; Houlton, Andrew","Bifunctional ferrocene derivatives for molecular recognition of DNA duplexes","Journal of the Chemical Society, Dalton Transactions","2000","","17","2969","","10.1039/b004295l","","","1.54178","CuKα","","0.1091","0.0581","","0.1321","0.1097","","","","1.004","1.097","1.097","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009911","13.6173","0.0013","9.8859","0.0012","13.1947","0.0013","90","","92.883","0.013","90","","1774","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C16 H22 Fe N4 O6 -","- C16 H22 Fe N4 O6 -","- C64 H88 Fe4 N16 O24 -","4","0.5","","Georgopoulou, Alexandra S.; Mingos, D. Michael P.; White, Andrew J. P.; Williams, David J.; Horrocks, Benjamin R.; Houlton, Andrew","Bifunctional ferrocene derivatives for molecular recognition of DNA duplexes","Journal of the Chemical Society, Dalton Transactions","2000","","17","2969","","10.1039/b004295l","","","1.54178","CuKα","","0.06","0.0452","","0.1089","0.1004","","","","1.058","1.106","1.106","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009912","10.9177","0.0014","11.4313","0.0008","11.7098","0.0015","71.001","0.008","71.22","0.009","73.495","0.008","1281.7","0.3","293","","293","","","","","","","","","5","P -1","-P 1","2","","","","?","- C44 H62 Li8 N12 O3 -","- C44 H62 Li8 N12 O3 -","1","0.5","","Jones, Cameron; Junk, Peter C.; Leary, Stuart G.; Smithies, Neil A.","Syntheses and structural studies of lithium complexes of 2-amino-6-methylpyridine †","Journal of the Chemical Society, Dalton Transactions","2000","","18","3186","","10.1039/b004322m","","","0.71073","xray_tube","","0.333","0.088","","0.114","0.11","","","","2.684","4.839","4.839","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009913","11.4923","0.0017","13.4905","0.0019","19.326","0.003","90","","103.137","0.003","90","","2917.8","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H37 Li4 N8 O0.5 -","- C24 H37 Li4 N8 O0.5 -","- C96 H148 Li16 N32 O2 -","4","1","","Jones, Cameron; Junk, Peter C.; Leary, Stuart G.; Smithies, Neil A.","Syntheses and structural studies of lithium complexes of 2-amino-6-methylpyridine †","Journal of the Chemical Society, Dalton Transactions","2000","","18","3186","","10.1039/b004322m","","","0.71073","MoKα","","0.0921","0.0549","","","0.1499","0.1752","","","","","","0.962","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009914","10.766","0.002","11.486","0.002","18.049","0.004","93.88","0.004","97.69","0.005","102.459","0.004","2149","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H52 Li4 N8 O4 Si4 -","- C32 H52 Li4 N8 O4 Si4 -","- C64 H104 Li8 N16 O8 Si8 -","2","1","","Jones, Cameron; Junk, Peter C.; Leary, Stuart G.; Smithies, Neil A.","Syntheses and structural studies of lithium complexes of 2-amino-6-methylpyridine †","Journal of the Chemical Society, Dalton Transactions","2000","","18","3186","","10.1039/b004322m","","","0.71073","MoKα","","0.1361","0.0701","","","0.1657","0.2068","","","","","","0.933","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009915","8.15","0.0001","8.7935","0.0001","10.0075","0.0001","85.985","0.001","89.699","0.001","70.68","0.001","675.035","0.014","213","5","213","2","","","","","","","synthesis","6","P -1","-P 1","2","","","","- C24 H24 Cl2 N8 O4 Pt -","- C24 H24 Cl2 N8 O4 Pt -","- C24 H24 Cl2 N8 O4 Pt -","1","0.5","","Brammer, Lee; Rivas, Juan C. Mareque; Atencio, Reinaldo; Fang, Shiyue; Pigge, F. Christopher","Combining hydrogen bonds with coordination chemistry or organometallic π-arene chemistry: strategies for inorganic crystal engineering †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3855","","10.1039/b004395h","","","0.71073","MoKα","","0.0455","0.039","","0.0833","0.0796","","","","0.979","0.965","0.965","","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009916","9.678","0.003","10.099","0.002","10.321","0.002","69.03","0.02","65.396","0.015","70.32","0.02","835.2","0.4","213","5","213","5","","","","","","","synthesis","7","P -1","-P 1","2","","","","- C24 H28 F12 N8 O6 P2 Pt -","- C24 H28 F12 N8 O6 P2 Pt -","- C24 H28 F12 N8 O6 P2 Pt -","1","0.5","","Brammer, Lee; Rivas, Juan C. Mareque; Atencio, Reinaldo; Fang, Shiyue; Pigge, F. Christopher","Combining hydrogen bonds with coordination chemistry or organometallic π-arene chemistry: strategies for inorganic crystal engineering †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3855","","10.1039/b004395h","","","0.71073","MoKα","","0.101","0.0634","","0.1237","0.1039","","","","1.016","0.992","0.992","","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009917","12.6582","0.0001","17.2961","0.0002","7.8045","0.0001","90","","94.43","0.001","90","","1703.59","0.03","203","5","203","5","","","","","","","synthesis","6","C 1 2/m 1","-C 2y","12","","","","- C24 H24 Cl2 N8 O11 Pt -","- C24 H24 Cl2 N8 O11 Pt -","- C48 H48 Cl4 N16 O22 Pt2 -","2","0.25","","Brammer, Lee; Rivas, Juan C. Mareque; Atencio, Reinaldo; Fang, Shiyue; Pigge, F. Christopher","Combining hydrogen bonds with coordination chemistry or organometallic π-arene chemistry: strategies for inorganic crystal engineering †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3855","","10.1039/b004395h","","","0.71073","MoKα","","0.0394","0.0343","","0.0808","0.0777","","","","1.078","1.056","1.056","","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009918","8.888","0.003","32.843","0.011","16.711","0.004","90","","98.43","0.02","90","","4825","3","203","5","203","5","","","","","","","synthesis","7","P 1 21/c 1","-P 2ybc","14","","","","- C24 H24 F12 N8 O4 P2 Pt -","- C24 H24 F11.7053 N8 O4 P2 Pt -","- C144 H144 F70.232 N48 O24 P12 Pt6 -","6","1.5","","Brammer, Lee; Rivas, Juan C. Mareque; Atencio, Reinaldo; Fang, Shiyue; Pigge, F. Christopher","Combining hydrogen bonds with coordination chemistry or organometallic π-arene chemistry: strategies for inorganic crystal engineering †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3855","","10.1039/b004395h","","","0.71073","MoKα","","0.1345","0.0829","","0.2071","0.1815","","","","1.164","1.288","1.288","","","","","has coordinates,has disorder","179803","2020-10-21","18:00:00",""
"7009919","7.0349","0.0003","7.2332","0.0003","11.1518","0.0005","88.71","0.001","81.733","0.001","63.012","0.001","499.82","0.04","208","5","208","5","","","","","","","synthesis","4","P -1","-P 1","2","","","","- C10 H6 Cr O5 -","- C10 H6 Cr O5 -","- C20 H12 Cr2 O10 -","2","1","","Brammer, Lee; Rivas, Juan C. Mareque; Atencio, Reinaldo; Fang, Shiyue; Pigge, F. Christopher","Combining hydrogen bonds with coordination chemistry or organometallic π-arene chemistry: strategies for inorganic crystal engineering †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3855","","10.1039/b004395h","","","0.71073","MoKα","","0.0732","0.0449","","0.1158","0.0981","","","","1.058","1.032","1.032","","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009920","8.0183","0.0002","21.3486","0.0003","11.8935","0.0001","90","","93.521","0.001","90","","2032.08","0.06","208","5","208","5","","","","","","","synthesis","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H18 Cr O9 S2 -","- C15 H18 Cr O9 S2 -","- C60 H72 Cr4 O36 S8 -","4","1","","Brammer, Lee; Rivas, Juan C. Mareque; Atencio, Reinaldo; Fang, Shiyue; Pigge, F. Christopher","Combining hydrogen bonds with coordination chemistry or organometallic π-arene chemistry: strategies for inorganic crystal engineering †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3855","","10.1039/b004395h","","","0.71073","MoKα","","0.183","0.0689","","","0.1384","0.1909","","","","","","1.042","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009921","6.5676","0.0001","10.6471","0.0001","15.3866","0.0002","79.54","0.001","77.794","0.001","82.222","0.001","1028.85","0.02","208","5","208","5","","","","","","","synthesis","5","P -1","-P 1","2","","","","- C17 H20 Cr N2 O9 -","- C17 H19 Cr N2 O9 -","- C34 H38 Cr2 N4 O18 -","2","1","","Brammer, Lee; Rivas, Juan C. Mareque; Atencio, Reinaldo; Fang, Shiyue; Pigge, F. Christopher","Combining hydrogen bonds with coordination chemistry or organometallic π-arene chemistry: strategies for inorganic crystal engineering †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3855","","10.1039/b004395h","","","0.71073","MoKα","","0.112","0.0617","","","0.1527","0.1818","","","","","","1.033","","","","has coordinates,has disorder","179803","2020-10-21","18:00:00",""
"7009922","11.6029","0.0003","13.0537","0.0002","15.2638","0.0002","87.472","0.001","75.734","0.001","86.752","0.001","2235.89","0.07","173","2","173","5","","","","","","","synthesis","4","P -1","-P 1","2","","","","- C20 H24 Cr O10 -","- C20 H24 Cr O10 -","- C80 H96 Cr4 O40 -","4","2","","Brammer, Lee; Rivas, Juan C. Mareque; Atencio, Reinaldo; Fang, Shiyue; Pigge, F. Christopher","Combining hydrogen bonds with coordination chemistry or organometallic π-arene chemistry: strategies for inorganic crystal engineering †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3855","","10.1039/b004395h","","","0.71073","MoKα","","0.1643","0.1101","","0.3001","0.2674","","","","1.145","1.328","1.328","","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009923","16.0449","0.0018","16.769","0.003","18.527","0.002","101.115","0.012","111.009","0.01","104.356","0.013","4283.9","1.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C78 H100 N10 O36 Sr -","- C78 H100 N10 O36 Sr -","- C156 H200 N20 O72 Sr2 -","2","1","","Casnati, Alessandro; Baldini, Laura; Pelizzi, Nicola; Rissanen, Kari; Ugozzoli, Franco; Ungaro, Rocco","Strontium complexes of calixarene amides in the solid state: structural dependence on the ligand size and on the counter ions","Journal of the Chemical Society, Dalton Transactions","2000","","19","3411","","10.1039/b004402o","","","0.71073","MoKα","","0.1175","0.0526","","","0.0958","0.1088","","","","","","0.938","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009924","16.553","0.002","16.602","0.008","19.139","0.005","72.19","0.03","69.874","0.015","60.09","0.03","4222","3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C140.7 H208.1 Cl4 N8 O34.7 Sr2 -","- C140.7 H208.1 Cl4 N8 O34.7 Sr2 -","- C140.7 H208.1 Cl4 N8 O34.7 Sr2 -","1","0.5","","Casnati, Alessandro; Baldini, Laura; Pelizzi, Nicola; Rissanen, Kari; Ugozzoli, Franco; Ungaro, Rocco","Strontium complexes of calixarene amides in the solid state: structural dependence on the ligand size and on the counter ions","Journal of the Chemical Society, Dalton Transactions","2000","","19","3411","","10.1039/b004402o","","","0.71073","MoKα","","0.1998","0.0913","","","0.2308","0.2931","","","","","","0.989","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009925","20.766","0.005","28.012","0.005","23.306","0.005","90","0.005","91.61","0.005","90","0.005","13552","5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C121 H162 N12 O26 Sr -","- C121 H145 N12 O26 Sr -","- C484 H580 N48 O104 Sr4 -","4","1","","Casnati, Alessandro; Baldini, Laura; Pelizzi, Nicola; Rissanen, Kari; Ugozzoli, Franco; Ungaro, Rocco","Strontium complexes of calixarene amides in the solid state: structural dependence on the ligand size and on the counter ions","Journal of the Chemical Society, Dalton Transactions","2000","","19","3411","","10.1039/b004402o","","","1.54178","CuKα","","0.0974","0.0823","","0.2155","0.2049","","","","1.237","1.266","1.266","","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009926","8.519","0.004","14.081","0.003","14.262","0.006","95.6","0.02","94.51","0.05","91.88","0.03","1696","1.1","296.2","","296.2","","","","","","","","","4","P -1","-P 1","2","","","","- C27 H38 Ir2 Se8 -","- C27 H38 Ir2 Se8 -","- C54 H76 Ir4 Se16 -","2","1","","Nagao, Shoken; Seino, Hidetake; Okada, Tomohiko; Mizobe, Yasushi; Hidai, Masanobu","Syntheses of diiridium complexes with two bridging tetrachalcogenide ligands [{Ir(η5-C5Me5)}2(μ-E4)2] (E = Se or S) and their reactions with alkynes forming mono- or di-nuclear dichalcogenolene complexes","Journal of the Chemical Society, Dalton Transactions","2000","","20","3546","","10.1039/b004404k","","","0.7107","MoKα","","0.0567","0.0567","","","0.059","0.059","","","","","","1.543","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009927","9.523","0.001","11.119","0.001","17.255","0.003","100.92","0.01","94.12","0.01","113.82","0.01","1618.6","0.4","296.2","","296.2","","","","","","","","","5","P -1","-P 1","2","","","","- C26 H36 Ir2 O4 Se6 -","- C26 H36 Ir2 O4 Se6 -","- C52 H72 Ir4 O8 Se12 -","2","1","","Nagao, Shoken; Seino, Hidetake; Okada, Tomohiko; Mizobe, Yasushi; Hidai, Masanobu","Syntheses of diiridium complexes with two bridging tetrachalcogenide ligands [{Ir(η5-C5Me5)}2(μ-E4)2] (E = Se or S) and their reactions with alkynes forming mono- or di-nuclear dichalcogenolene complexes","Journal of the Chemical Society, Dalton Transactions","2000","","20","3546","","10.1039/b004404k","","","0.7107","MoKα","","0.052","0.052","","","0.0555","0.0555","","","","","","2.024","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009928","11.977","0.001","11.6244","0.0008","15.223","0.001","90","","112.21","0.006","90","","1962.2","0.3","296.2","","296.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H21 Ir O4 Se2 -","- C16 H21 Ir O4 Se2 -","- C64 H84 Ir4 O16 Se8 -","4","1","","Nagao, Shoken; Seino, Hidetake; Okada, Tomohiko; Mizobe, Yasushi; Hidai, Masanobu","Syntheses of diiridium complexes with two bridging tetrachalcogenide ligands [{Ir(η5-C5Me5)}2(μ-E4)2] (E = Se or S) and their reactions with alkynes forming mono- or di-nuclear dichalcogenolene complexes","Journal of the Chemical Society, Dalton Transactions","2000","","20","3546","","10.1039/b004404k","","","0.7107","MoKα","","0.0294","0.0294","","","0.0262","0.0262","","","","","","1.747","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009929","9.951","0.001","10.3826","0.0008","12.707","0.001","87.707","0.008","87.033","0.009","77.443","0.007","1279.17","0.19","296.2","","296.2","","","","","","","","","5","P -1","-P 1","2","","","","- C22 H27 Ir O8 Se2 -","- C22 H27 Ir O8 Se2 -","- C44 H54 Ir2 O16 Se4 -","2","1","","Nagao, Shoken; Seino, Hidetake; Okada, Tomohiko; Mizobe, Yasushi; Hidai, Masanobu","Syntheses of diiridium complexes with two bridging tetrachalcogenide ligands [{Ir(η5-C5Me5)}2(μ-E4)2] (E = Se or S) and their reactions with alkynes forming mono- or di-nuclear dichalcogenolene complexes","Journal of the Chemical Society, Dalton Transactions","2000","","20","3546","","10.1039/b004404k","","","0.7107","MoKα","","0.0233","0.0233","","","0.0232","0.0232","","","","","","1.52","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009930","19.843","0.005","9.233","0.002","17.291","0.002","90","","90","","90","","3167.9","1.1","296.2","","296.2","","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C14 H19 Ir O2 Se2 -","- C14 H19 Ir O2 Se2 -","- C112 H152 Ir8 O16 Se16 -","8","1","","Nagao, Shoken; Seino, Hidetake; Okada, Tomohiko; Mizobe, Yasushi; Hidai, Masanobu","Syntheses of diiridium complexes with two bridging tetrachalcogenide ligands [{Ir(η5-C5Me5)}2(μ-E4)2] (E = Se or S) and their reactions with alkynes forming mono- or di-nuclear dichalcogenolene complexes","Journal of the Chemical Society, Dalton Transactions","2000","","20","3546","","10.1039/b004404k","","","0.7107","MoKα","","0.0532","0.0532","","","0.061","0.061","","","","","","1.927","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009931","16.064","0.002","16.083","0.002","16.387","0.001","115.234","0.007","92.887","0.009","91.3","0.01","3820.3","0.7","296.2","","296.2","","","","","","","","","5","P -1","-P 1","2","","","","- C16 H21 Ir O4 S2 -","- C16 H21 Ir O4 S2 -","- C128 H168 Ir8 O32 S16 -","8","4","","Nagao, Shoken; Seino, Hidetake; Okada, Tomohiko; Mizobe, Yasushi; Hidai, Masanobu","Syntheses of diiridium complexes with two bridging tetrachalcogenide ligands [{Ir(η5-C5Me5)}2(μ-E4)2] (E = Se or S) and their reactions with alkynes forming mono- or di-nuclear dichalcogenolene complexes","Journal of the Chemical Society, Dalton Transactions","2000","","20","3546","","10.1039/b004404k","","","0.7107","MoKα","","0.0635","0.0635","","","0.0812","0.0812","","","","","","1.995","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009932","9.237","0.002","12.154","0.003","15.017","0.003","76.46","0.02","79.22","0.01","87.65","0.02","1610.1","0.6","296.2","","296.2","","","","","","","","","5","P -1","-P 1","2","","","","- C14 H19 Ir O2 S2 -","- C14 H19 Ir O2 S2 -","- C56 H76 Ir4 O8 S8 -","4","2","","Nagao, Shoken; Seino, Hidetake; Okada, Tomohiko; Mizobe, Yasushi; Hidai, Masanobu","Syntheses of diiridium complexes with two bridging tetrachalcogenide ligands [{Ir(η5-C5Me5)}2(μ-E4)2] (E = Se or S) and their reactions with alkynes forming mono- or di-nuclear dichalcogenolene complexes","Journal of the Chemical Society, Dalton Transactions","2000","","20","3546","","10.1039/b004404k","","","0.7107","MoKα","","0.0336","0.0336","","","0.0323","0.0323","","","","","","1.647","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009933","14.203","0.01","10.444","0.007","15.109","0.012","90","","90","","90","","2241","3","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C6 H12 Cd N4 S2 -","- C6 H12 Cd N4 S2 -","- C48 H96 Cd8 N32 S16 -","8","1","","Mondal, Nijhuma; Saha, Manas Kumar; Mitra, Samiran; Gramlich, Volker","Synthesis and crystal structure of thiocyanato or azido bridged one- or two-dimensional polymeric complexes of cadmium(II)","Journal of the Chemical Society, Dalton Transactions","2000","","18","3218","","10.1039/b004428h","","","0.71073","MoKα","","0.0198","0.0162","","0.0453","0.0447","","","","1.109","1.195","1.195","","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009934","8.926","0.004","10.836","0.006","20.827","0.011","90","","90","","90","","2014.4","1.8","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C4 H12 Cd N8 -","- C4 H12 Cd N8 -","- C32 H96 Cd8 N64 -","8","2","","Mondal, Nijhuma; Saha, Manas Kumar; Mitra, Samiran; Gramlich, Volker","Synthesis and crystal structure of thiocyanato or azido bridged one- or two-dimensional polymeric complexes of cadmium(II)","Journal of the Chemical Society, Dalton Transactions","2000","","18","3218","","10.1039/b004428h","","","0.71073","MoKα","","0.0297","0.0261","","0.0684","0.0674","","","","1.016","1.116","1.116","","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009935","10.596","0.007","8.339","0.004","13.831","0.009","90","","98.59","0.05","90","","1208.4","1.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H20 Cd2 N6 -","- C12 H32 Cd2 N16 -","- C24 H64 Cd4 N32 -","2","0.5","","Mondal, Nijhuma; Saha, Manas Kumar; Mitra, Samiran; Gramlich, Volker","Synthesis and crystal structure of thiocyanato or azido bridged one- or two-dimensional polymeric complexes of cadmium(II)","Journal of the Chemical Society, Dalton Transactions","2000","","18","3218","","10.1039/b004428h","","","0.71073","MoKα","","0.0237","0.0173","","0.0432","0.0422","","","","0.933","1.066","1.066","","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009936","6.3795","0.0002","17.5638","0.0005","20.9551","0.0007","76.178","0.001","88.264","0.001","81.768","0.005","2256.48","0.13","183","2","183","2","","","","","","","","5","P -1","-P 1","2","2[H3O]+[(C6F13)2PO2]-","","","- C12 H3 F26 O3 P -","- C12 H3 F26 O3 P -","- C48 H12 F104 O12 P4 -","4","2","","Rajendra P. Singh; Brendan Twamley; Jean'ne M. Shreeve","The first crystal and molecular structures of hydrated bis(n-perfluoroalkyl)phosphinic acids [H3O]+[(Rf)2PO2]− (Rf = C6F13, C7F15 or C8F17)","J. Chem. Soc., Dalton Trans.","2000","","22","4089","4092","10.1039/b004482m","","","0.71073","MoKα","","0.1212","0.0708","","","0.104","0.1196","","","","","","1.091","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7009937","6.1951","0.0002","11.1604","0.0003","18.7348","0.0005","78.074","0.001","89.266","0.001","82.532","0.001","1256.48","0.06","203","2","203","2","","","","","","","","5","P -1","-P 1","2","[C14F30PO2]-[H3O]+","","","- C14 H3 F30 O3 P -","- C14 H3 F30 O3 P -","- C28 H6 F60 O6 P2 -","2","1","","Rajendra P. Singh; Brendan Twamley; Jean'ne M. Shreeve","The first crystal and molecular structures of hydrated bis(n-perfluoroalkyl)phosphinic acids [H3O]+[(Rf)2PO2]− (Rf = C6F13, C7F15 or C8F17)","J. Chem. Soc., Dalton Trans.","2000","","22","4089","4092","10.1039/b004482m","","","0.71073","MoKα","","0.0951","0.0641","","","0.1405","0.1567","","","","","","1.072","","","","has coordinates,has disorder","179803","2020-10-21","18:00:00",""
"7009938","10.7873","0.0006","30.106","0.0016","9.7817","0.0005","90","","90","","90","","3176.7","0.3","183","2","183","2","","","","","","","","5","P c a 21","P 2c -2ac","29","[H3O][(F17C8)2PO2] + acetone","","","- C19 H9 F34 O4 P -","- C19 H9 F34 O4 P -","- C76 H36 F136 O16 P4 -","4","1","","Rajendra P. Singh; Brendan Twamley; Jean'ne M. Shreeve","The first crystal and molecular structures of hydrated bis(n-perfluoroalkyl)phosphinic acids [H3O]+[(Rf)2PO2]− (Rf = C6F13, C7F15 or C8F17)","J. Chem. Soc., Dalton Trans.","2000","","22","4089","4092","10.1039/b004482m","","","0.71073","MoKα","","0.1114","0.08","","","0.1669","0.1861","","","","","","1.102","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009939","11.4684","0.0005","17.563","0.0007","20.4767","0.0005","97.489","0.002","101.974","0.002","97.733","0.002","3944.3","0.3","173","","173","","","","","","","","","5","P -1","-P 1","2","","","","- C87 H94 Cl6 O8 Si2 -","- C87 H87 Cl6 O8 Si2 -","- C174 H174 Cl12 O16 Si4 -","2","1","","Martz, J.; Graf, E.; Hosseini, M. W.; De Cian, A.; Fischer, J.","Directional 1-D inclusion networks: self-assembly of unsymmetrical koilands into directional koilates in the crystalline phase †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3791","","10.1039/b004538l","","","0.71073","Mo-Kα","","0.137","0.063","","0.108","","0.092","","","1.92","","","1.618","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009940","12.753","0.0006","14.533","0.0006","25.01","0.001","100.191","0.005","98.867","0.005","106.834","0.005","4261.7","0.4","173","","173","","","","","","","","","4","P -1","-P 1","2","","","","- C100 H108 O8 Si2 -","- C100 H83 O8 Si2 -","- C200 H166 O16 Si4 -","2","1","","Martz, J.; Graf, E.; Hosseini, M. W.; De Cian, A.; Fischer, J.","Directional 1-D inclusion networks: self-assembly of unsymmetrical koilands into directional koilates in the crystalline phase †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3791","","10.1039/b004538l","","","0.71073","Mo-Kα","","0.163","0.088","","0.24","","0.11","","","2.4","","","1.085","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009941","15.3269","0.0005","17.4756","0.0006","19.0824","0.0006","65.355","0.005","72.286","0.005","64.786","0.005","4152.8","0.3","173","","173","","","","","","","","","4","P -1","-P 1","2","","","","- C102 H104 O8 Si2 -","- C102 H104 O8 Si2 -","- C204 H208 O16 Si4 -","2","1","","Martz, J.; Graf, E.; Hosseini, M. W.; De Cian, A.; Fischer, J.","Directional 1-D inclusion networks: self-assembly of unsymmetrical koilands into directional koilates in the crystalline phase †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3791","","10.1039/b004538l","","","0.71073","Mo-Kα","","0.117","0.056","","0.342","","0.065","","","5.93","","","1.036","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009942","15.502","0.002","21.848","0.003","10.29","0.001","91.85","0.01","108.33","0.01","71.29","0.01","3124.3","0.7","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H26 Co Mo O7 P -","- C34 H26 Co Mo O7 P -","- C136 H104 Co4 Mo4 O28 P4 -","4","2","","Davies, John E.; Mays, Martin J.; Raithby, Paul R.; Sarveswaran, Koshala; Solan, Gregory A.","Synthesis of three-membered metallaphosphaheterocycles and their ring opening with Ph2PH on mixed-metal molybdenum‒cobalt centres †","Journal of the Chemical Society, Dalton Transactions","2000","","19","3331","","10.1039/b004594m","","","0.71069","MoKα","","0.1353","0.0531","","0.1596","0.1095","","","","1.043","1.047","1.047","","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009943","10.771","0.019","28.163","0.012","11.014","0.012","90","","119.27","0.05","90","","2914","6","180","2","180","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C34 H30 Co Mo O3 P -","- C34 H30 Co Mo O3 P -","- C136 H120 Co4 Mo4 O12 P4 -","4","1","","Davies, John E.; Mays, Martin J.; Raithby, Paul R.; Sarveswaran, Koshala; Solan, Gregory A.","Synthesis of three-membered metallaphosphaheterocycles and their ring opening with Ph2PH on mixed-metal molybdenum‒cobalt centres †","Journal of the Chemical Society, Dalton Transactions","2000","","19","3331","","10.1039/b004594m","","","0.71069","MoKα","","0.1059","0.0701","","0.2035","0.1743","","","","1.063","1.107","1.107","","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009944","10.989","0.004","12.81","0.007","21.045","0.003","90","","102.8","0.02","90","","2889","2","180","2","180","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H34 Co Mo O4 P -","- C32 H34 Co Mo O4 P -","- C128 H136 Co4 Mo4 O16 P4 -","4","1","","Davies, John E.; Mays, Martin J.; Raithby, Paul R.; Sarveswaran, Koshala; Solan, Gregory A.","Synthesis of three-membered metallaphosphaheterocycles and their ring opening with Ph2PH on mixed-metal molybdenum‒cobalt centres †","Journal of the Chemical Society, Dalton Transactions","2000","","19","3331","","10.1039/b004594m","","","0.71069","MoKα","","0.0543","0.0387","","0.1019","0.0932","","","","1.049","1.077","1.077","","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009945","20.676","0.007","18.323","0.004","12.021","0.006","90","","102.79","0.03","90","","4441","3","180","2","180","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C47 H43 Cl2 Co Mo O7 P2 -","- C47 H39 Cl2 Co Mo O7 P2 -","- C188 H156 Cl8 Co4 Mo4 O28 P8 -","4","1","","Davies, John E.; Mays, Martin J.; Raithby, Paul R.; Sarveswaran, Koshala; Solan, Gregory A.","Synthesis of three-membered metallaphosphaheterocycles and their ring opening with Ph2PH on mixed-metal molybdenum‒cobalt centres †","Journal of the Chemical Society, Dalton Transactions","2000","","19","3331","","10.1039/b004594m","","","0.71069","MoKα","","0.1412","0.0569","","0.1449","0.1085","","","","1.014","1.097","1.097","","","","","has coordinates,has disorder","179803","2020-10-21","18:00:00",""
"7009946","15.46","0.005","18.534","0.005","11.506","0.005","103.78","0.03","91.12","0.03","76.21","0.03","3107","2","180","2","180","2","","","","","","","","7","P -1","-P 1","2","","","","- C33.5 H37.5 Cl Co0.5 Mo0.5 O P1.5 -","- C33.5 H37.5 Cl Co0.5 Mo0.5 O P1.5 -","- C134 H150 Cl4 Co2 Mo2 O4 P6 -","4","2","","Davies, John E.; Mays, Martin J.; Raithby, Paul R.; Sarveswaran, Koshala; Solan, Gregory A.","Synthesis of three-membered metallaphosphaheterocycles and their ring opening with Ph2PH on mixed-metal molybdenum‒cobalt centres †","Journal of the Chemical Society, Dalton Transactions","2000","","19","3331","","10.1039/b004594m","","","0.71073","MoKα","","0.1962","0.1044","","0.3402","0.2871","","","","1.032","1.338","1.338","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7009947","17.205","0.003","18.061","0.003","22.922","0.004","82.306","0.003","87.368","0.003","70.283","0.003","6645","2","133","2","133","2","","","","","","","","7","P -1","-P 1","2","","","","- C131 H81.5 N0.5 Ni13 O34 P4 Pd13 -","- C131 H81.5 N0.5 Ni13 O34 P4 Pd13 -","- C262 H163 N Ni26 O68 P8 Pd26 -","2","1","","Tran, Nguyet T.; Kawano, Masaki; Powell, Douglas R.; Dahl, Lawrence F.","High-nuclearity [Pd13Ni13(CO)34]4− containing a 26-atom Pd13Ni13 core with an unprecedented five-layer close-packed triangular stacking geometry: possible substitutional Pd/Ni crystal disorder at specific intralayer nickel sites †","Journal of the Chemical Society, Dalton Transactions","2000","","22","4138","","10.1039/b004595k","","","0.71073","MoKα","","0.0681","0.0503","","","0.1346","0.1494","","","","","","1.04","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009948","17.226","","17.937","","22.828","0.0001","82.43","","87.58","","70.6","","6594.99","0.03","133","2","133","2","","","","","","","","7","P -1","-P 1","2","","","","- C131 H81.5 N0.5 Ni12.55 O34 P4 Pd13.45 -","- C131 H81.5 N0.5 Ni12.542 O34 P4 Pd13.458 -","- C262 H163 N Ni25.084 O68 P8 Pd26.916 -","2","1","","Tran, Nguyet T.; Kawano, Masaki; Powell, Douglas R.; Dahl, Lawrence F.","High-nuclearity [Pd13Ni13(CO)34]4− containing a 26-atom Pd13Ni13 core with an unprecedented five-layer close-packed triangular stacking geometry: possible substitutional Pd/Ni crystal disorder at specific intralayer nickel sites †","Journal of the Chemical Society, Dalton Transactions","2000","","22","4138","","10.1039/b004595k","","","0.71073","MoKα","","0.0594","0.043","","","0.0979","0.1097","","","","","","1.173","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7009949","17.206","0.002","18.04","0.002","22.93","0.003","82.32","0.002","87.301","0.002","70.26","0.002","6639","1.4","133","2","133","2","","","","","","","","7","P -1","-P 1","2","","","","- C131 H81.5 N0.5 Ni13 O34 P4 Pd13 -","- C131 H81.5 N0.5 Ni13 O34 P4 Pd13 -","- C262 H163 N Ni26 O68 P8 Pd26 -","2","1","","Tran, Nguyet T.; Kawano, Masaki; Powell, Douglas R.; Dahl, Lawrence F.","High-nuclearity [Pd13Ni13(CO)34]4− containing a 26-atom Pd13Ni13 core with an unprecedented five-layer close-packed triangular stacking geometry: possible substitutional Pd/Ni crystal disorder at specific intralayer nickel sites †","Journal of the Chemical Society, Dalton Transactions","2000","","22","4138","","10.1039/b004595k","","","0.71073","MoKα","","0.0915","0.0663","","","0.2031","0.2738","","","","","","1.108","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009950","9.1145","0.0008","15.798","0.002","15.006","0.001","90","","92.23","0.005","90","","2159.1","0.4","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22.5 H28 Na O1.5 Pb -","- C22.5 H28 Na O1.5 Pb -","- C90 H112 Na4 O6 Pb4 -","4","1","","Feeder, Neil; Hopkins, Alexander D.; Layfield, Richard A.; Wright, Dominic S.","Synthesis and structure of [Cp2PbCpthf Na]·0.5thf; implications to the control of dimensionality in p block metallocene anion systems (Cp = C5H5, Cpthf = {C5H4}CH2C4H7O)","Journal of the Chemical Society, Dalton Transactions","2000","","14","2247","","10.1039/b004608f","","","0.71069","MoKα","","0.0838","0.0676","","0.195","0.1786","","","","1.068","1.092","1.092","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7009951","5.9809","0.0006","11.495","0.002","13.719","0.002","68.94","0.02","77.44","0.02","75.59","0.01","843.9","0.2","173","1","173","1","","","","","","","see text","6","P -1","-P 1","2","","(4-Ferrocenylethynylpyridine)methyltrioxorhenium","","- C18 H16 Fe N O3 Re -","- C18 H16 Fe N O3 Re -","- C36 H32 Fe2 N2 O6 Re2 -","2","1","","Santos, Ana M.; Kühn, Fritz E.; Xue, Wen-Mei; Herdtweck, Eberhardt","Syntheses and characterisation of methyltrioxorhenium adducts of low-valence organometallic Lewis bases","Journal of the Chemical Society, Dalton Transactions","2000","","20","3570","","10.1039/b004640j","","","0.71073","MoKα","","0.0329","0.0276","","","0.0653","0.0663","","","","","","1.247","","","","has coordinates","194578","2020-10-21","18:00:00",""
"7009952","9.6042","0.0009","11.5323","0.001","20.241","0.002","90","","98.652","0.001","90","","2216.4","0.4","150","","150","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C20 H22 F3 N2 O3 P Pd S -","- C20 H22 F3 N2 O3 P Pd S -","- C80 H88 F12 N8 O12 P4 Pd4 S4 -","4","1","","Bayler, Angela; Canty, Allan J.; Edwards, Peter G.; Skelton, Brian W.; White, Allan H.","Trimethyl-palladium(IV) and -platinum(IV) complexes containing phosphine donor ligands, including studies of 1,5,9-triethyl-1,5,9-triphosphacyclodecane and X-ray structural studies of palladium(II) and palladium(IV) complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","19","3325","","10.1039/b004741o","","","0.71073","MoKα","","0.041","0.03","","0.037","","0.035","","","1.099","","","1.155","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009953","8.364","0.001","11.493","0.002","13.86","0.002","90","","105.812","0.002","90","","1281.9","0.3","150","","150","","","","","","","","","8","P 1 21/m 1","-P 2yb","11","","","","- C24 H28 F3 N2 O3 P Pd S -","- C24 H28 F3 N2 O3 P Pd S -","- C48 H56 F6 N4 O6 P2 Pd2 S2 -","2","0.5","","Bayler, Angela; Canty, Allan J.; Edwards, Peter G.; Skelton, Brian W.; White, Allan H.","Trimethyl-palladium(IV) and -platinum(IV) complexes containing phosphine donor ligands, including studies of 1,5,9-triethyl-1,5,9-triphosphacyclodecane and X-ray structural studies of palladium(II) and palladium(IV) complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","19","3325","","10.1039/b004741o","","","0.71073","MoKα","","0.043","0.034","","0.043","","0.042","","","1.22","","","1.279","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7009954","7.698","0.011","15.134","0.017","19.061","0.023","90","","90","","90","","2221","5","293","2","293","2","","","","","","","","8","P b c m","-P 2c 2b","57","","","","- C16 H21 Cl F6 N3 P Ru S3 -","- C16 H21 Cl F6 N3 P Ru S3 -","- C64 H84 Cl4 F24 N12 P4 Ru4 S12 -","4","0.5","","Madureira, João; Santos, Teresa M.; Goodfellow, Brian J.; Lucena, Mónica; Pedrosa de Jesus, Júlio; Santana-Marques, Maria G.; Drew, Michael G. B.; Félix, Vítor","Structural characterisation of new RuII[9]aneS3 polypyridylic complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","23","4422","","10.1039/b004752j","","","0.71073","MoKα","","0.0634","0.0446","","","0.1197","0.1296","","","","","","1.11","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009955","8.914","0.011","11.821","0.014","10.167","0.013","90","","101.37","0.01","90","","1050","2","293","2","293","2","","","","","","","","8","P 1 21/m 1","-P 2yb","11","","","","- C14 H18 Cl F6 N4 P Ru S3 -","- C14 H18 Cl F6 N4 P Ru S3 -","- C28 H36 Cl2 F12 N8 P2 Ru2 S6 -","2","0.5","","Madureira, João; Santos, Teresa M.; Goodfellow, Brian J.; Lucena, Mónica; Pedrosa de Jesus, Júlio; Santana-Marques, Maria G.; Drew, Michael G. B.; Félix, Vítor","Structural characterisation of new RuII[9]aneS3 polypyridylic complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","23","4422","","10.1039/b004752j","","","0.71073","MoKα","","0.0733","0.0478","","","0.1041","0.1131","","","","","","1.091","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009956","14.866","0.017","17.311","0.02","20.639","0.024","90","","90","","90","","5311","11","293","2","293","2","","","","","","","","8","P b c a","-P 2ac 2ab","61","","","","- C21 H23 Cl F6 N3 P Ru S3 -","- C21 H23 Cl F6 N3 P Ru S3 -","- C168 H184 Cl8 F48 N24 P8 Ru8 S24 -","8","1","","Madureira, João; Santos, Teresa M.; Goodfellow, Brian J.; Lucena, Mónica; Pedrosa de Jesus, Júlio; Santana-Marques, Maria G.; Drew, Michael G. B.; Félix, Vítor","Structural characterisation of new RuII[9]aneS3 polypyridylic complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","23","4422","","10.1039/b004752j","","","0.71073","MoKα","","0.0742","0.0462","","","0.1132","0.1249","","","","","","1.102","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009957","7.93","0.011","30.024","0.037","12.918","0.014","90","","105.75","0.01","90","","2960","6","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C26 H27 Cl F6 N3 P Ru S3 -","- C26 H27 Cl F6 N3 P Ru S3 -","- C104 H108 Cl4 F24 N12 P4 Ru4 S12 -","4","1","","Madureira, João; Santos, Teresa M.; Goodfellow, Brian J.; Lucena, Mónica; Pedrosa de Jesus, Júlio; Santana-Marques, Maria G.; Drew, Michael G. B.; Félix, Vítor","Structural characterisation of new RuII[9]aneS3 polypyridylic complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","23","4422","","10.1039/b004752j","","","0.71073","MoKα","","0.2181","0.0936","","","0.2305","0.2801","","","","","","1.003","","","","has coordinates,has disorder","179803","2020-10-21","18:00:00",""
"7009958","8.158","0.01","15.575","0.017","24.244","0.026","90","","90","","90","","3080","6","293","2","293","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C30 H28 B Cl F4 N2 Ru S3 -","- C30 H28 B Cl F4 N2 Ru S3 -","- C120 H112 B4 Cl4 F16 N8 Ru4 S12 -","4","1","","Madureira, João; Santos, Teresa M.; Goodfellow, Brian J.; Lucena, Mónica; Pedrosa de Jesus, Júlio; Santana-Marques, Maria G.; Drew, Michael G. B.; Félix, Vítor","Structural characterisation of new RuII[9]aneS3 polypyridylic complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","23","4422","","10.1039/b004752j","","","0.71073","MoKα","","0.0615","0.0448","","","0.115","0.1286","","","","","","1.062","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009959","7.619","0.011","30.542","0.034","25.273","0.028","90","","96.7","0.01","90","","5841","12","293","2","293","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C24 H22.12 Cl F6 N4 O0.12 P Ru S3 -","- C24 H22 Cl F6 N4 O0.125 P Ru S3 -","- C192 H176 Cl8 F48 N32 O P8 Ru8 S24 -","8","2","","Madureira, João; Santos, Teresa M.; Goodfellow, Brian J.; Lucena, Mónica; Pedrosa de Jesus, Júlio; Santana-Marques, Maria G.; Drew, Michael G. B.; Félix, Vítor","Structural characterisation of new RuII[9]aneS3 polypyridylic complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","23","4422","","10.1039/b004752j","","","0.71073","MoKα","","0.2446","0.1243","","","0.284","0.3389","","","","","","1.058","","","","has coordinates,has disorder","179803","2020-10-21","18:00:00",""
"7009960","36.058","0.004","10.4819","0.0012","19.602","0.002","90","","119.33","0.006","90","","6459","1.3","143","2","143","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C27.5 H40 N O6 P Si2 W -","- C27.5 H40 N O6 P Si2 W -","- C220 H320 N8 O48 P8 Si16 W8 -","8","1","","Streubel, Rainer; Neumann, Christoph; Jones, Peter G.","Ferrocenium salt induced ring expansion of a 2H-azaphosphirene complex: Synthesis of the first Δ3-1,4,2-oxazaphospholene complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","15","2495","","10.1039/b004795n","","","0.71073","MoKα","","0.0413","0.0247","","","0.0523","0.0589","","","","","","1.033","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7009961","5.012","0.001","6.738","0.001","13.748","0.004","90","","97.31","0.01","90","","460.51","0.18","173","2","173","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C8 H14 O6 -","- C8 H14 O6 -","- C16 H28 O12 -","2","1","","Sah, Ajay K.; Rao, Chebrolu P.; Saarenketo, Pauli K.; Wegelius, Elina K.; Rissanen, Kari; Kolehmainen, Erkki","N-Glycosylamines of 4,6-O-ethylidene-α-D-glucopyranose: synthesis, characterisation and structure of CO2H, Cl and F ortho-substituted phenyl derivatives and metal ion complexes of the CO2H derivative†","Journal of the Chemical Society, Dalton Transactions","2000","","20","3681","","10.1039/b004854m","","","0.71073","MoKα","","0.1052","0.0559","","0.1323","0.1142","","","","1.032","1.181","1.181","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7009962","7.0572","0.0002","12.3474","0.0003","16.5133","0.0004","90","","90","","90","","1438.94","0.06","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C14 H18 Cl N O5 -","- C14 H18 Cl N O5 -","- C56 H72 Cl4 N4 O20 -","4","1","","Sah, Ajay K.; Rao, Chebrolu P.; Saarenketo, Pauli K.; Wegelius, Elina K.; Rissanen, Kari; Kolehmainen, Erkki","N-Glycosylamines of 4,6-O-ethylidene-α-D-glucopyranose: synthesis, characterisation and structure of CO2H, Cl and F ortho-substituted phenyl derivatives and metal ion complexes of the CO2H derivative†","Journal of the Chemical Society, Dalton Transactions","2000","","20","3681","","10.1039/b004854m","","","0.71073","MoKα","","0.0322","0.0297","","0.0796","0.078","","","","1.05","1.054","1.054","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7009963","21.562","0.001","13.501","0.001","15.041","0.001","90","","122.07","0.01","90","","3710.4","0.6","173","2","173","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C32.5 H47 K2 N2 O17 -","- C32.5 H47 K2 N2 O17 -","- C130 H188 K8 N8 O68 -","4","1","","Sah, Ajay K.; Rao, Chebrolu P.; Saarenketo, Pauli K.; Wegelius, Elina K.; Rissanen, Kari; Kolehmainen, Erkki","N-Glycosylamines of 4,6-O-ethylidene-α-D-glucopyranose: synthesis, characterisation and structure of CO2H, Cl and F ortho-substituted phenyl derivatives and metal ion complexes of the CO2H derivative†","Journal of the Chemical Society, Dalton Transactions","2000","","20","3681","","10.1039/b004854m","","","0.71073","MoKα","","0.0439","0.0374","","0.0983","0.0943","","","","1.106","1.114","1.114","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009964","11.8056","0.0014","14.869","0.003","14.909","0.003","90","0.011","104.011","0.01","90","0.014","2539.2","0.8","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C26 H20 F6 N4 O2 Os P -","- C26 H20 F6 N4 O2 Os P -","- C104 H80 F24 N16 O8 Os4 P4 -","4","0.5","","Barthram, Anita M.; Reeves, Zöe R.; Jeffery, John C.; Ward, Michael D.","Polynuclear osmium‒dioxolene complexes: comparison of electrochemical and spectroelectrochemical properties with those of their ruthenium analogues","Journal of the Chemical Society, Dalton Transactions","2000","","18","3162","","10.1039/b004858p","","","0.71073","MoKα","","0.0252","0.0224","","","0.0545","0.0549","","","","","","1.018","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009965","9.3136","0.0005","10.4888","0.0006","13.2061","0.0007","78.322","0.001","83.674","0.001","75.013","0.001","1218.12","0.12","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H38 B9 N6 Ta -","- C14 H38 B9 N6 Ta -","- C28 H76 B18 N12 Ta2 -","2","1","","Broder, Charlotte K.; Goeta, Andrés E.; Howard, Judith A. K.; Hughes, Andrew K.; Johnson, Andrew L.; Malget, John M.; Wade, Ken","Insertion and cleavage reactions of [closo-3,1,2-Ta(NMe2)3(C2B9H11)] with nitriles, phenols and thiols; structural characterisation of N,N-dimethylamidinate ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","20","3526","","10.1039/b004862n","","","0.71073","MoKα","","0.0364","0.0306","","","0.0745","0.0776","","","","","","1.039","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009966","13.104","0.003","18.42","0.004","15.495","0.004","90","","90.976","0.004","90","","3739.6","1.5","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H44 B9 F3 N6 Ta -","- C32 H44 B9 F3 N6 Ta -","- C128 H176 B36 F12 N24 Ta4 -","4","1","","Broder, Charlotte K.; Goeta, Andrés E.; Howard, Judith A. K.; Hughes, Andrew K.; Johnson, Andrew L.; Malget, John M.; Wade, Ken","Insertion and cleavage reactions of [closo-3,1,2-Ta(NMe2)3(C2B9H11)] with nitriles, phenols and thiols; structural characterisation of N,N-dimethylamidinate ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","20","3526","","10.1039/b004862n","","","0.71073","MoKα","","0.0225","0.0184","","","0.0445","0.0466","","","","","","1.05","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009967","10.122","0.002","12.074","0.002","15.206","0.003","90.21","0.01","105.49","0.01","104.14","0.01","1731.9","0.6","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C22 H35 B9 Cl5 F2 N4 Ta -","- C22 H35 B9 Cl5 F2 N4 Ta -","- C44 H70 B18 Cl10 F4 N8 Ta2 -","2","1","","Broder, Charlotte K.; Goeta, Andrés E.; Howard, Judith A. K.; Hughes, Andrew K.; Johnson, Andrew L.; Malget, John M.; Wade, Ken","Insertion and cleavage reactions of [closo-3,1,2-Ta(NMe2)3(C2B9H11)] with nitriles, phenols and thiols; structural characterisation of N,N-dimethylamidinate ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","20","3526","","10.1039/b004862n","","","0.71073","MoKα","","0.0364","0.033","","","0.0871","0.09","","","","","","1.118","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009968","18.732","0.003","19.92","0.003","15.986","0.003","90","","95.108","0.004","90","","5941.3","1.7","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H38 B9 O3 Ta -","- C26 H38 B9 O3 Ta -","- C208 H304 B72 O24 Ta8 -","8","2","","Broder, Charlotte K.; Goeta, Andrés E.; Howard, Judith A. K.; Hughes, Andrew K.; Johnson, Andrew L.; Malget, John M.; Wade, Ken","Insertion and cleavage reactions of [closo-3,1,2-Ta(NMe2)3(C2B9H11)] with nitriles, phenols and thiols; structural characterisation of N,N-dimethylamidinate ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","20","3526","","10.1039/b004862n","","","0.71073","MoKα","","0.0423","0.024","","","0.051","0.0575","","","","","","1.059","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009969","11.236","0.001","11.95","0.001","15.081","0.002","110.016","0.003","96.548","0.002","102.996","0.002","1813.1","0.3","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C31.5 H37 B9 N S4 Ta -","- C31.5 H37 B9 N S4 Ta -","- C63 H74 B18 N2 S8 Ta2 -","2","1","","Broder, Charlotte K.; Goeta, Andrés E.; Howard, Judith A. K.; Hughes, Andrew K.; Johnson, Andrew L.; Malget, John M.; Wade, Ken","Insertion and cleavage reactions of [closo-3,1,2-Ta(NMe2)3(C2B9H11)] with nitriles, phenols and thiols; structural characterisation of N,N-dimethylamidinate ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","20","3526","","10.1039/b004862n","","","0.71073","MoKα","","0.1092","0.0497","","","0.0783","0.0896","","","","","","0.913","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009970","19.7558","0.001","10.2159","0.0005","26.3957","0.0013","90","","99.685","0.001","90","","5251.3","0.5","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C58 H68 N2 O2 Ti -","- C58 H68 N2 O2 Ti -","- C232 H272 N8 O8 Ti4 -","4","1","","Woodman, Paul R.; Alcock, Nathaniel W.; Munslow, Ian J.; Sanders, Christopher J.; Scott, Peter","Chiral N2O2 Schiff-base complexes of titanium with a biaryl backbone: highly diastereoselective migratory insertion of alkyl at imine","Journal of the Chemical Society, Dalton Transactions","2000","","19","3340","","10.1039/b004865h","","","0.71073","mokα","","0.1729","0.1005","","","0.2521","0.296","","","","","","1.04","","","","has coordinates","189853","2020-10-21","18:00:00",""
"7009971","14.27","0.003","16.917","0.003","22.645","0.004","89.215","0.001","86.814","0.001","79.791","0.001","5371.7","1.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C107 H134 N4 O6 Ti2 -","- C107 H134 N4 O6 Ti2 -","- C214 H268 N8 O12 Ti4 -","2","1","","Woodman, Paul R.; Alcock, Nathaniel W.; Munslow, Ian J.; Sanders, Christopher J.; Scott, Peter","Chiral N2O2 Schiff-base complexes of titanium with a biaryl backbone: highly diastereoselective migratory insertion of alkyl at imine","Journal of the Chemical Society, Dalton Transactions","2000","","19","3340","","10.1039/b004865h","","","0.71073","MoKα","","0.2064","0.1109","","","0.2739","0.3584","","","","","","1.112","","","","has coordinates","205752","2020-10-21","18:00:00",""
"7009972","7.167","0.001","12.9","0.003","18.697","0.004","90","","98.3","0.03","90","","1710.5","0.6","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C5 H16 Cs I2 N3 O6 Pt -","- C5 H8 Cs I2 N3 O6 Pt -","- C20 H32 Cs4 I8 N12 O24 Pt4 -","4","1","","Freisinger, Eva; Schneider, Alexandra; Drumm, Markus; Hegmans, Alexander; Meier, Susanne; Lippert, Bernhard","Exocyclic oxygen atoms of platinated nucleobases as binding sites for alkali metal ions","Journal of the Chemical Society, Dalton Transactions","2000","","19","3281","","10.1039/b004906i","","","0.71069","MoKα","","0.0556","0.0422","","0.1003","0.0943","","","","0.963","1.046","1.046","","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009973","8.229","0.002","22.036","0.004","15.358","0.003","90","","90.48","0.03","90","","2784.8","1","163","2","163","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C5 H11 F9 K0.5 N4 O1.5 P1.5 Pt0.5 -","- C5 H11 F9 K0.5 N4 O1.5 P1.5 Pt0.5 -","- C40 H88 F72 K4 N32 O12 P12 Pt4 -","8","1","","Freisinger, Eva; Schneider, Alexandra; Drumm, Markus; Hegmans, Alexander; Meier, Susanne; Lippert, Bernhard","Exocyclic oxygen atoms of platinated nucleobases as binding sites for alkali metal ions","Journal of the Chemical Society, Dalton Transactions","2000","","19","3281","","10.1039/b004906i","","","0.71069","MoKα","","0.0409","0.0292","","0.1002","0.0642","","","","1.009","1.064","1.064","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7009974","10.99","0.002","12.273","0.002","13.743","0.003","89.84","0.03","70.51","0.03","88.28","0.03","1746.6","0.7","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C17 H29 Cl3 N14 Na O17.5 Pt -","- C17 H24 Cl3 N14 Na O17.5 Pt -","- C34 H48 Cl6 N28 Na2 O35 Pt2 -","2","1","","Freisinger, Eva; Schneider, Alexandra; Drumm, Markus; Hegmans, Alexander; Meier, Susanne; Lippert, Bernhard","Exocyclic oxygen atoms of platinated nucleobases as binding sites for alkali metal ions","Journal of the Chemical Society, Dalton Transactions","2000","","19","3281","","10.1039/b004906i","","","0.71069","MoKα","","0.108","0.0499","","0.1229","0.0928","","","","0.862","1.104","1.104","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009975","10.6026","0.0002","10.6126","0.0002","15.9334","0.0001","80.351","0.001","72.854","0.001","81.98","","1681.18","0.05","200","2","200","2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H47 Cl N3 Re -","- C34 H47 Cl N3 Re -","- C68 H94 Cl2 N6 Re2 -","2","1","","Burrell, Anthony K.; Steedman, Andrew J.","A systematic route to mixed imido complexes of rhenium","Journal of the Chemical Society, Dalton Transactions","2000","","15","2501","","10.1039/b004938g","","","0.71073","MoKα","","0.0253","0.0214","","","0.0707","0.0813","","","","","","0.704","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7009976","9.3838","0.0003","39.3038","0.0011","9.1197","0.0002","90","","107.789","0.001","90","","3202.7","0.15","203","2","203","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C33 H46 N3 Re -","- C33 H46 N3 Re -","- C132 H184 N12 Re4 -","4","1","","Burrell, Anthony K.; Steedman, Andrew J.","A systematic route to mixed imido complexes of rhenium","Journal of the Chemical Society, Dalton Transactions","2000","","15","2501","","10.1039/b004938g","","","0.71073","MoKα","","0.0393","0.0361","","","0.0812","0.0834","","","","","","1.242","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7009977","16.077","0.003","10.499","0.002","16.773","0.003","90","","114.44","0.03","90","","2577.5","1","200","1","200","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H21 O8 P W2 -","- C24 H21 O8 P W2 -","- C96 H84 O32 P4 W8 -","4","1","","Schiffer, Michael; Scheer, Manfred","On the pathway of the η1‒η5 migration of a Cp* ligand","Journal of the Chemical Society, Dalton Transactions","2000","","15","2493","","10.1039/b004941g","","","0.71073","MoKα","","0.0511","0.0401","","","0.0924","0.0966","","","","","","0.957","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009978","15.299","0.007","14.826","0.007","19.505","0.009","90","","106.78","0.03","90","","4236","3","299.2","","","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C39 H46 F6 N O9 P2 Rh -","- C39 H46 F6 N O9 P2 Rh -","- C156 H184 F24 N4 O36 P8 Rh4 -","4","1","","Yamamoto, Yasuhiro; Sugawara, Kenichiro","Novel insertion of ethynylbenzene derivatives bearing an electron-withdrawing substituent at the 4-position into a P‒C bond and their transannular insertion between a metal atom and an ipso-carbon atom of the phosphine ligand †","Journal of the Chemical Society, Dalton Transactions","2000","","17","2896","","10.1039/b004984k","","","0.7107","MoKα","","","0.0653","","","","0.1797","","","","","","1.62","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009979","15.534","0.003","19.986","0.003","15.757","0.003","90","","103.7","0.01","90","","4752.8","1.5","299.2","","","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C49 H47 F6 O6 P2 Rh -","- C49 H47 F6 O6 P2 Rh -","- C196 H188 F24 O24 P8 Rh4 -","4","1","","Yamamoto, Yasuhiro; Sugawara, Kenichiro","Novel insertion of ethynylbenzene derivatives bearing an electron-withdrawing substituent at the 4-position into a P‒C bond and their transannular insertion between a metal atom and an ipso-carbon atom of the phosphine ligand †","Journal of the Chemical Society, Dalton Transactions","2000","","17","2896","","10.1039/b004984k","","","0.7107","MoKα","","","0.0644","","","","0.1981","","","","","","0.975","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009980","34.835","0.007","9.135","0.008","12.305","0.005","90","","90","","90","","3916","4","299.2","","299.2","","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C39 H42 Cl2 O6 P Rh -","- C39 H41 Cl2 O6 P Rh -","- C156 H164 Cl8 O24 P4 Rh4 -","4","1","","Yamamoto, Yasuhiro; Sugawara, Kenichiro","Novel insertion of ethynylbenzene derivatives bearing an electron-withdrawing substituent at the 4-position into a P‒C bond and their transannular insertion between a metal atom and an ipso-carbon atom of the phosphine ligand †","Journal of the Chemical Society, Dalton Transactions","2000","","17","2896","","10.1039/b004984k","","","0.7107","MoKα","","","0.0588","","","0.0762","","","","","1.853","1.853","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009981","12.669","0.003","19.594","0.004","14.038","0.003","90","","103.55","0.03","90","","3387.7","1.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H36 N18 O15 Pt -","- C18 H24 N18 O15 Pt -","- C72 H96 N72 O60 Pt4 -","4","1","","Freisinger, Eva; Meier, Susanne; Lippert, Bernhard","Hydrogen bonding patterns of N(7) platinated guanine: Watson‒Crick and different self-pairing motifs in a tris(9-methylguanine) complex of PtII","Journal of the Chemical Society, Dalton Transactions","2000","","19","3274","","10.1039/b004993j","","","0.71069","MoKα","","0.1923","0.0732","","0.1818","0.137","","","","1.006","1.209","1.209","","","","","has coordinates,has disorder","179803","2020-10-21","18:00:00",""
"7009982","10.944","0.002","14.955","0.003","21.437","0.004","73.67","0.03","76.98","0.03","82.08","0.03","3270","1.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H64.4 Cl4 N32 O25 Pt2 -","- C36 H48 Cl4 N32 O25 Pt2 -","- C72 H96 Cl8 N64 O50 Pt4 -","2","1","","Freisinger, Eva; Meier, Susanne; Lippert, Bernhard","Hydrogen bonding patterns of N(7) platinated guanine: Watson‒Crick and different self-pairing motifs in a tris(9-methylguanine) complex of PtII","Journal of the Chemical Society, Dalton Transactions","2000","","19","3274","","10.1039/b004993j","","","0.71069","MoKα","","0.1512","0.0509","","0.118","0.0962","","","","0.822","1.108","1.108","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7009983","10.236","0.002","15.115","0.003","15.132","0.003","68.99","0.03","87.16","0.03","73.72","0.03","2094.5","0.9","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H41.5 Cl1.5 N22 O13 Pt -","- C28 H37.5 Cl1.5 N22 O13 Pt -","- C56 H75 Cl3 N44 O26 Pt2 -","2","1","","Freisinger, Eva; Meier, Susanne; Lippert, Bernhard","Hydrogen bonding patterns of N(7) platinated guanine: Watson‒Crick and different self-pairing motifs in a tris(9-methylguanine) complex of PtII","Journal of the Chemical Society, Dalton Transactions","2000","","19","3274","","10.1039/b004993j","","","0.71069","MoKα","","0.1151","0.0546","","0.1065","0.0925","","","","0.865","1.071","1.071","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7009984","12.639","0.002","15.558","0.002","16.5787","0.0005","113.349","0.001","91.187","0.002","106.02","0.001","2845.4","0.6","296.2","","","","","","","","","","","7","P -1","-P 1","2","","","","- C46 H34 Cu2 F12 N8 O2 P2 -","- C46 H30 Cu2 F12 N8 O2 P2 -","- C92 H60 Cu4 F24 N16 O4 P4 -","2","1","","Maekawa, Masahiko; Konaka, Hisashi; Suenaga, Yusaku; Kuroda-Sowa, Takayoshi; Munakata, Megumu","A variety of one-, two- and three-dimensional copper(I) and silver(I) co-ordination polymers assembled by 1,4-bis(4-pyridyl)butadiyne and 1,4-bis(2-pyridyl)butadiyne","Journal of the Chemical Society, Dalton Transactions","2000","","22","4160","4166","10.1039/b005006g","","","0.7107","MoKa","","","0.111","","","","0.3583","","","","","","1.256","","","","has coordinates","275130","2022-05-06","18:53:40",""
"7009985","14.739","0.006","7.644","0.004","7.582","0.005","75.66","0.05","89.36","0.05","80","0.04","814.6","0.8","296.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C16 H11 Ag N4 O3 -","- C16 H11 Ag N4 O3 -","- C32 H22 Ag2 N8 O6 -","2","1","","Maekawa, Masahiko; Konaka, Hisashi; Suenaga, Yusaku; Kuroda-Sowa, Takayoshi; Munakata, Megumu","A variety of one-, two- and three-dimensional copper(I) and silver(I) co-ordination polymers assembled by 1,4-bis(4-pyridyl)butadiyne and 1,4-bis(2-pyridyl)butadiyne","Journal of the Chemical Society, Dalton Transactions","2000","","22","4160","4166","10.1039/b005006g","","","0.7107","MoKa","","","0.0409","","","","0.1233","","","","","","1.028","","","","has coordinates","275130","2022-05-06","18:53:41",""
"7009986","5.296","0.002","15.876","0.006","10.889","0.003","90","","100.47","0.04","90","","900.3","0.6","296.2","","","","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C17 H14 Ag Cl N2 O5 -","- C17 H14 Ag Cl N2 O5 -","- C34 H28 Ag2 Cl2 N4 O10 -","2","0.5","","Maekawa, Masahiko; Konaka, Hisashi; Suenaga, Yusaku; Kuroda-Sowa, Takayoshi; Munakata, Megumu","A variety of one-, two- and three-dimensional copper(I) and silver(I) co-ordination polymers assembled by 1,4-bis(4-pyridyl)butadiyne and 1,4-bis(2-pyridyl)butadiyne","Journal of the Chemical Society, Dalton Transactions","2000","","22","4160","4166","10.1039/b005006g","","","0.7107","MoKa","","","0.0243","","","","0.0708","","","","","","1.103","","","","has coordinates","275130","2022-05-06","18:53:41",""
"7009987","10.157","0.003","17.818","0.007","11.399","0.003","90","","104.98","0.02","90","","1992.9","1.1","296.2","","","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C18 H14 Ag F3 N2 O4 S -","- C18 H14 Ag F3 N2 O4 S -","- C72 H56 Ag4 F12 N8 O16 S4 -","4","1","","Maekawa, Masahiko; Konaka, Hisashi; Suenaga, Yusaku; Kuroda-Sowa, Takayoshi; Munakata, Megumu","A variety of one-, two- and three-dimensional copper(I) and silver(I) co-ordination polymers assembled by 1,4-bis(4-pyridyl)butadiyne and 1,4-bis(2-pyridyl)butadiyne","Journal of the Chemical Society, Dalton Transactions","2000","","22","4160","4166","10.1039/b005006g","","","0.7107","MoKa","","","0.0547","","","","0.1788","","","","","","1.021","","","","has coordinates","275130","2022-05-06","18:53:41",""
"7009988","10.626","0.003","10.626","0.003","25.718","0.003","90","","90","","90","","2903.9","1.2","296.2","","","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C28 H16 B Cu F4 N4 -","- C28 H16 B Cu F4 N4 -","- C112 H64 B4 Cu4 F16 N16 -","4","0.25","","Maekawa, Masahiko; Konaka, Hisashi; Suenaga, Yusaku; Kuroda-Sowa, Takayoshi; Munakata, Megumu","A variety of one-, two- and three-dimensional copper(I) and silver(I) co-ordination polymers assembled by 1,4-bis(4-pyridyl)butadiyne and 1,4-bis(2-pyridyl)butadiyne","Journal of the Chemical Society, Dalton Transactions","2000","","22","4160","4166","10.1039/b005006g","","","0.7107","MoKa","","","0.093","","","","0.2968","","","","","","0.957","","","","has coordinates","275130","2022-05-06","18:53:41",""
"7009989","9.918","0.003","10.625","0.002","7.398","0.003","95.33","0.02","102.96","0.03","113.84","0.02","680","0.4","296.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C14 H8 Ag N3 O3 -","- C14 H8 Ag N3 O3 -","- C28 H16 Ag2 N6 O6 -","2","1","","Maekawa, Masahiko; Konaka, Hisashi; Suenaga, Yusaku; Kuroda-Sowa, Takayoshi; Munakata, Megumu","A variety of one-, two- and three-dimensional copper(I) and silver(I) co-ordination polymers assembled by 1,4-bis(4-pyridyl)butadiyne and 1,4-bis(2-pyridyl)butadiyne","Journal of the Chemical Society, Dalton Transactions","2000","","22","4160","4166","10.1039/b005006g","","","0.7107","MoKa","","","0.0294","","","","0.0734","","","","","","1.06","","","","has coordinates","275155","2022-05-06","23:16:32",""
"7009990","9.457","0.005","10.912","0.004","15.87","0.004","90","","99.32","0.03","90","","1616.1","1.1","296.2","","","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C15 H8 Ag F3 N2 O3 S -","- C15 H8 Ag F3 N2 O3 S -","- C60 H32 Ag4 F12 N8 O12 S4 -","4","1","","Maekawa, Masahiko; Konaka, Hisashi; Suenaga, Yusaku; Kuroda-Sowa, Takayoshi; Munakata, Megumu","A variety of one-, two- and three-dimensional copper(I) and silver(I) co-ordination polymers assembled by 1,4-bis(4-pyridyl)butadiyne and 1,4-bis(2-pyridyl)butadiyne","Journal of the Chemical Society, Dalton Transactions","2000","","22","4160","4166","10.1039/b005006g","","","0.7107","MoKα","","","0.0413","","","","0.1028","","","","","","1.017","","","","has coordinates","275155","2022-05-06","23:16:32",""
"7009991","14.407","0.004","14.512","0.004","23.321","0.006","90.537","0.014","93.796","0.017","113.4","0.02","4462","2","220","2","220","2","","","","","","","","6","P -1","-P 1","2","","","","- C69.57 H73.94 Cl8.69 Co7 N11.75 O18.69 -","- C69.57 H73.94 Cl8.69 Co7 N11.75 O18.69 -","- C139.14 H147.88 Cl17.38 Co14 N23.5 O37.38 -","2","1","","Brechin, Euan K.; Graham, Alasdair; Parkin, Andrew; Parsons, Simon; Seddon, Annela M.; Winpenny, Richard E. P.","Structural studies of heptanuclear cobalt complexes and larger oligomers based on heptanuclear fragments","Journal of the Chemical Society, Dalton Transactions","2000","","19","3242","","10.1039/b005019i","","","0.71073","MoKα","","0.1598","0.0761","","","0.1428","0.1943","","","","","","1.02","","","","has coordinates,has disorder","179803","2020-10-21","18:00:00",""
"7009992","24.034","0.008","20.018","0.005","16.304","0.004","90","","90","","90","","7844","4","150","2","150","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C71 H53 Cl8 Co7 N9 O19 -","- C71 H53 Cl8 Co7 N9 O19 -","- C284 H212 Cl32 Co28 N36 O76 -","4","0.5","","Brechin, Euan K.; Graham, Alasdair; Parkin, Andrew; Parsons, Simon; Seddon, Annela M.; Winpenny, Richard E. P.","Structural studies of heptanuclear cobalt complexes and larger oligomers based on heptanuclear fragments","Journal of the Chemical Society, Dalton Transactions","2000","","19","3242","","10.1039/b005019i","","","0.71073","MoKα","","0.2048","0.0897","","","0.176","0.2317","","","","","","1.007","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"7009993","14.325","0.005","17.769","0.005","25.176","0.01","81.11","0.02","76.85","0.02","82.24","0.03","6132","4","220","2","220","2","","","","","","","","6","P -1","-P 1","2","","","","- C121 H119.5 Co8 N12.5 Na2 O26 -","- C121 H119.5 Co8 N12.5 Na2 O26 -","- C242 H239 Co16 N25 Na4 O52 -","2","1","","Brechin, Euan K.; Graham, Alasdair; Parkin, Andrew; Parsons, Simon; Seddon, Annela M.; Winpenny, Richard E. P.","Structural studies of heptanuclear cobalt complexes and larger oligomers based on heptanuclear fragments","Journal of the Chemical Society, Dalton Transactions","2000","","19","3242","","10.1039/b005019i","","","0.71073","MoKα","","0.2016","0.0919","","","0.1731","0.2173","","","","","","1.001","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"7009994","17.165","0.005","18.243","0.007","26.613","0.008","90","","96.63","0.04","90","","8278","5","150","2","150","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C119 H76 Cl26 Co13 N20 O30 -","- C119 H76 Cl26 Co13 N20 O30 -","- C238 H152 Cl52 Co26 N40 O60 -","2","0.5","","Brechin, Euan K.; Graham, Alasdair; Parkin, Andrew; Parsons, Simon; Seddon, Annela M.; Winpenny, Richard E. P.","Structural studies of heptanuclear cobalt complexes and larger oligomers based on heptanuclear fragments","Journal of the Chemical Society, Dalton Transactions","2000","","19","3242","","10.1039/b005019i","","","0.71073","MoKα","","0.1881","0.0926","","0.2744","0.2013","","","","1.021","1.12","1.12","","","","","has coordinates,has disorder","179803","2020-10-21","18:00:00",""
"7009995","13.976","0.007","15.049","0.008","22.158","0.012","86.48","0.04","89.39","0.03","66.66","0.04","4270","4","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C65.75 H70.25 Cl8.75 Co7 N9.75 O20 -","- C65.75 H70 Cl8.75 Co7 N9.75 O20 -","- C131.5 H140 Cl17.5 Co14 N19.5 O40 -","2","1","","Brechin, Euan K.; Graham, Alasdair; Parkin, Andrew; Parsons, Simon; Seddon, Annela M.; Winpenny, Richard E. P.","Structural studies of heptanuclear cobalt complexes and larger oligomers based on heptanuclear fragments","Journal of the Chemical Society, Dalton Transactions","2000","","19","3242","","10.1039/b005019i","","","1.54178","CuKα","","0.2016","0.0994","","","0.2227","0.2826","","","0.986","","","","","","","has coordinates,has disorder","179803","2020-10-21","18:00:00",""
"7009996","7.8207","0.0009","20.621","0.002","9.6921","0.0011","90","","107.804","0.002","90","","1488.2","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H10 Br4 Co N2 -","- C10 H10 Br4 Co N2 -","- C40 H40 Br16 Co4 N8 -","4","1","","Gillon, Amy L.; Lewis, Gareth R.; Orpen, A. Guy; Rotter, Sarah; Starbuck, Jonathan; Wang, Xi-Meng; Rodríguez-Martín, Yolanda; Ruiz-Pérez, Catalina","Organic‒inorganic hybrid solids: control of perhalometallate solid state structures †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3897","","10.1039/b005036i","","","0.71073","MoKα","","0.0589","0.0364","","","0.0769","0.0836","","","","","","0.974","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009997","7.8031","0.0008","20.594","0.002","9.7596","0.0009","90","","107.916","0.002","90","","1492.3","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H10 Br4 N2 Zn -","- C10 H10 Br4 N2 Zn -","- C40 H40 Br16 N8 Zn4 -","4","1","","Gillon, Amy L.; Lewis, Gareth R.; Orpen, A. Guy; Rotter, Sarah; Starbuck, Jonathan; Wang, Xi-Meng; Rodríguez-Martín, Yolanda; Ruiz-Pérez, Catalina","Organic‒inorganic hybrid solids: control of perhalometallate solid state structures †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3897","","10.1039/b005036i","","","0.71073","MoKα","","0.0548","0.0322","","","0.0679","0.0731","","","","","","0.928","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009998","15.9959","0.0018","13.1476","0.0014","7.1305","0.0008","90","","114.992","0.002","90","","1359.2","0.3","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Br4 Mn N2 -","- C10 H10 Br4 Mn N2 -","- C40 H40 Br16 Mn4 N8 -","4","0.5","","Gillon, Amy L.; Lewis, Gareth R.; Orpen, A. Guy; Rotter, Sarah; Starbuck, Jonathan; Wang, Xi-Meng; Rodríguez-Martín, Yolanda; Ruiz-Pérez, Catalina","Organic‒inorganic hybrid solids: control of perhalometallate solid state structures †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3897","","10.1039/b005036i","","","0.71073","MoKα","","0.0337","0.0268","","","0.0628","0.0648","","","","","","1.009","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7009999","6.6548","0.0014","11.695","0.002","8.146","0.003","90","","91.32","0.003","90","","633.8","0.3","173","2","173","2","","","","","","","","5","I 1 2/m 1","-I 2y","12","","","","- C10 H10 Cl4 N2 Pt -","- C10 H10 Cl4 N2 Pt -","- C20 H20 Cl8 N4 Pt2 -","2","0.25","","Gillon, Amy L.; Lewis, Gareth R.; Orpen, A. Guy; Rotter, Sarah; Starbuck, Jonathan; Wang, Xi-Meng; Rodríguez-Martín, Yolanda; Ruiz-Pérez, Catalina","Organic‒inorganic hybrid solids: control of perhalometallate solid state structures †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3897","","10.1039/b005036i","","","0.71073","MoKα","","0.0289","0.0289","","","0.0657","0.0657","","","","","","1.083","","","","has coordinates","179803","2020-10-21","18:00:00",""
"7010000","7.675","0.003","19.742","0.007","9.491","0.003","90","","108.992","0.006","90","","1359.8","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H10 Cl4 Co N2 -","- C10 H10 Cl4 Co N2 -","- C40 H40 Cl16 Co4 N8 -","4","1","","Gillon, Amy L.; Lewis, Gareth R.; Orpen, A. Guy; Rotter, Sarah; Starbuck, Jonathan; Wang, Xi-Meng; Rodríguez-Martín, Yolanda; Ruiz-Pérez, Catalina","Organic‒inorganic hybrid solids: control of perhalometallate solid state structures †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3897","","10.1039/b005036i","","","0.71073","MoKα","","0.1158","0.0459","","","0.0744","0.0902","","","","","","0.896","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010001","7.7629","0.0012","20.27","0.003","9.3418","0.0015","90","","107.414","0.013","90","","1402.6","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H10 Cl4 Hg N2 -","- C10 H10 Cl4 Hg N2 -","- C40 H40 Cl16 Hg4 N8 -","4","1","","Gillon, Amy L.; Lewis, Gareth R.; Orpen, A. Guy; Rotter, Sarah; Starbuck, Jonathan; Wang, Xi-Meng; Rodríguez-Martín, Yolanda; Ruiz-Pérez, Catalina","Organic‒inorganic hybrid solids: control of perhalometallate solid state structures †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3897","","10.1039/b005036i","","","0.71073","MoKα","","0.0467","0.0276","","","0.0562","0.0601","","","","","","0.93","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010002","13.012","0.003","16.458","0.003","7.392","0.0011","90","","119.997","0.012","90","","1371","0.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C9.87 H9.87 Cl4 N1.97 Pb -","- C9.866 H9.866 Cl4 N1.9732 Pb1.0134 -","- C39.464 H39.464 Cl16 N7.8928 Pb4.0536 -","4","0.5","","Gillon, Amy L.; Lewis, Gareth R.; Orpen, A. Guy; Rotter, Sarah; Starbuck, Jonathan; Wang, Xi-Meng; Rodríguez-Martín, Yolanda; Ruiz-Pérez, Catalina","Organic‒inorganic hybrid solids: control of perhalometallate solid state structures †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3897","","10.1039/b005036i","","","0.71073","MoKα","","0.0313","0.028","","","0.0639","0.0647","","","","","","1.019","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7010003","10.76","0.004","14.371","0.008","14.981","0.009","114.95","0.05","84.79","0.05","98.11","0.05","2078","2","453","2","453","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C40 H64 N4 O2 W -","- C40 H64 N4 O2 W -","- C80 H128 N8 O4 W2 -","2","1","","Motevalli, Majid; Parkin, Bernadeta C.; Ramnauth, Ramkrishna; Sullivan, Alice C.","The first bis(imido) transition metal Schiff-base complexes","Journal of the Chemical Society, Dalton Transactions","2000","","16","2661","","10.1039/b005043l","","","0.71073","MoKα","","0.0752","0.0659","","","0.2139","0.2232","","","","","","1.042","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010004","7.314","0.002","20.573","0.002","12.094","0.002","90","","104.575","0.008","90","","1761.2","0.6","294","","","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C36 H39 Cl2 Cu N7 O3 -","- C43 H46 Cl2 Cu N7 O4 -","- C86 H92 Cl4 Cu2 N14 O8 -","2","1","","Zhixuan (Jack) Chen; Natasha Karasek; Donald C. Craig; Stephen B. Colbran","Copper(II/I) complexes of a bulky tris(pyrazolylmethyl)amine ligand","J. Chem. Soc., Dalton Trans.","2000","","19","3445","3452","10.1039/b005081o","","","1.54184","CuKα","","","0.033","","","","0.043","","","","","","1.39","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7010005","11.771","0.006","12.059","0.006","13.525","0.008","89.76","0.03","87.17","0.03","83.56","0.03","1905.4","1.8","294","","","","","","","","","","","8","P -1","-P 1","2","","","","- C36 H39 Cl Cu F6 N7 O3 Sb -","- C36 H39 Cl Cu F6 N7 O3 Sb -","- C72 H78 Cl2 Cu2 F12 N14 O6 Sb2 -","2","1","","Zhixuan (Jack) Chen; Natasha Karasek; Donald C. Craig; Stephen B. Colbran","Copper(II/I) complexes of a bulky tris(pyrazolylmethyl)amine ligand","J. Chem. Soc., Dalton Trans.","2000","","19","3445","3452","10.1039/b005081o","","","0.71073","MoKα","","","0.037","","","","0.051","","","","","","1.75","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7010006","11.044","0.007","14.3","0.005","28.578","0.02","90","","90.87","0.03","90","","4513","5","294","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C37 H45 Cu F12 N7 O5 Sb2 -","- C37 H45 Cu F18 N7 O5 Sb3 -","- C148 H180 Cu4 F72 N28 O20 Sb12 -","4","1","","Zhixuan (Jack) Chen; Natasha Karasek; Donald C. Craig; Stephen B. Colbran","Copper(II/I) complexes of a bulky tris(pyrazolylmethyl)amine ligand","J. Chem. Soc., Dalton Trans.","2000","","19","3445","3452","10.1039/B005081O","","","0.71073","MoKα","","","0.048","","","","0.077","","","","","","2.38","","","","has coordinates","176343","2020-10-21","18:00:00",""
"7010007","12.154","0.006","13.182","0.008","14.328","0.009","113.03","0.04","91.98","0.04","117.45","0.02","1809","2","294","","","","","","","","","","","6","P -1","-P 1","2","","","","- C36 H39 Cl2 Cu2 N7 O3 -","- C37 H42 Cl2 Cu2 N7 O3 -","- C74 H84 Cl4 Cu4 N14 O6 -","2","1","","Zhixuan (Jack) Chen; Natasha Karasek; Donald C. Craig; Stephen B. Colbran","Copper(II/I) complexes of a bulky tris(pyrazolylmethyl)amine ligand","J. Chem. Soc., Dalton Trans.","2000","","19","3445","3452","10.1039/b005081o","","","1.54184","CuKα","","","0.047","","","","0.07","","","","","","2.43","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010008","28.454","0.002","6.991","0.002","20.473","0.002","90","","106.756","0.006","90","","3899.6","1.2","301.2","","301.2","","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C17 H15 F6 Hg N2 O P S -","- C17 H15 F6 Hg N2 O P S -","- C136 H120 F48 Hg8 N16 O8 P8 S8 -","8","1","","Vivian Wing-WahYam; Yung-Lin Pui; Kung-Kai Cheung","Synthesis, structure, luminescence, and electrochemical properties of polynuclear mercury(II) chalcogenolate complexes","J. Chem. Soc., Dalton Trans.","2000","","20","3658","3662","10.1039/b005085g","","","0.7107","MoKalpha","","","0.0279","","","0.0348","","","","","1.371","1.371","","","","","has coordinates","288197","2023-12-08","18:09:38",""
"7010009","12.786","0.001","7.134","0.004","20.342","0.002","90","","95.977","0.008","90","","1845.4","1.1","301.2","","301.2","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C16 H13 F6 Hg N2 P Se -","- C16 H13 F6 Hg N2 P Se -","- C64 H52 F24 Hg4 N8 P4 Se4 -","4","1","","Vivian Wing-WahYam; Yung-Lin Pui; Kung-Kai Cheung","Synthesis, structure, luminescence, and electrochemical properties of polynuclear mercury(II) chalcogenolate complexes","J. Chem. Soc., Dalton Trans.","2000","","20","3658","3662","10.1039/b005085g","","","0.7107","MoKalpha","","","0.0285","","","0.0364","","","","","1.73","1.73","","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010010","28.4958","0.0001","10.2352","0.0002","14.806","0.0002","90","","117.203","0.001","90","","3840.68","0.1","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C20 H15 B Cu F4 N3 O2 -","- C20 H15 B Cu F4 N3 O2 -","- C160 H120 B8 Cu8 F32 N24 O16 -","8","1","","Zhang, Jing; Xiong, Ren-Gen; Zuo, Jing-Lin; Che, Chi-Ming; You, Xiao-Zeng","Highly stable copper(I)-olefin coordination polymers capable of co-existing with water and acid","Journal of the Chemical Society, Dalton Transactions","2000","","17","2898","","10.1039/b005101m","","","0.71073","MoKα","","0.1487","0.1067","","","0.3125","0.3357","","","","","","1.023","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010011","7.005","0.0003","19.8147","0.0008","27.205","0.001","90","","90","","90","","3776.1","0.3","293","2","293","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C18 H17 B Cu F4 N3 O3 -","- C18 H17 B Cu F4 N3 O3 -","- C144 H136 B8 Cu8 F32 N24 O24 -","8","1","","Zhang, Jing; Xiong, Ren-Gen; Zuo, Jing-Lin; Che, Chi-Ming; You, Xiao-Zeng","Highly stable copper(I)-olefin coordination polymers capable of co-existing with water and acid","Journal of the Chemical Society, Dalton Transactions","2000","","17","2898","","10.1039/b005101m","","","0.71073","MoKα","","0.1264","0.0626","","","0.1276","0.1515","","","","","","1.016","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010012","15.0072","0.0018","15.25","0.0019","4.3768","0.0005","90","","90","","90","","1001.7","0.2","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","3-isatin thiosemicarbazone","","- C9 H8 N4 O S -","- C9 H8 N4 O S -","- C36 H32 N16 O4 S4 -","4","1","","Casas, José S.; Castiñeiras, Alfonso; Rodríguez-Argüelles, María C.; Sánchez, Agustín; Sordo, José; Vázquez-López, Antonia; Vázquez-López, Ezequiel M.","Reactions of diorganotin(IV) oxides with isatin 3- and 2-thiosemicarbazones and with isatin 2,3-bis(thiosemicarbazone): influence of diphenyldithiophosphinic acid (isatin = 1H-indole-2,3-dione)","Journal of the Chemical Society, Dalton Transactions","2000","","22","4056","","10.1039/b005103i","","","0.71073","MoKα","","0.2315","0.0526","","","0.0989","0.1467","","","","","","0.92","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010013","10.6068","0.0016","11.2736","0.0009","13.7638","0.001","112.017","0.007","99.495","0.01","104.361","0.009","1415.9","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Dimethylbis(diphenyldithiophosphinato)tin(IV)","","- C26 H26 P2 S4 Sn -","- C26 H26 P2 S4 Sn -","- C52 H52 P4 S8 Sn2 -","2","1","","Casas, José S.; Castiñeiras, Alfonso; Rodríguez-Argüelles, María C.; Sánchez, Agustín; Sordo, José; Vázquez-López, Antonia; Vázquez-López, Ezequiel M.","Reactions of diorganotin(IV) oxides with isatin 3- and 2-thiosemicarbazones and with isatin 2,3-bis(thiosemicarbazone): influence of diphenyldithiophosphinic acid (isatin = 1H-indole-2,3-dione)","Journal of the Chemical Society, Dalton Transactions","2000","","22","4056","","10.1039/b005103i","","","0.71073","MoKα","","0.0552","0.0342","","","0.0877","0.0969","","","","","","1.01","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010014","10.558","0.002","10.958","0.002","13.978","0.003","88.723","0.01","77.833","0.01","62.28","0.02","1394","0.5","213","2","213","2","","","","","","","","7","P -1","-P 1","2","","(3-isatinethiosemicarbazonato)-dimethyl-monothiophosphinato-tin(IV) ethanol solvate","","- C25 H29 N4 O3 P S2 Sn -","- C25 H29 N4 O3 P S2 Sn -","- C50 H58 N8 O6 P2 S4 Sn2 -","2","1","","Casas, José S.; Castiñeiras, Alfonso; Rodríguez-Argüelles, María C.; Sánchez, Agustín; Sordo, José; Vázquez-López, Antonia; Vázquez-López, Ezequiel M.","Reactions of diorganotin(IV) oxides with isatin 3- and 2-thiosemicarbazones and with isatin 2,3-bis(thiosemicarbazone): influence of diphenyldithiophosphinic acid (isatin = 1H-indole-2,3-dione)","Journal of the Chemical Society, Dalton Transactions","2000","","22","4056","","10.1039/b005103i","","","1.54056","","","0.0561","0.0508","","","0.141","0.1465","","","","","","1.078","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010015","14.913","0.003","7.3408","0.0014","15.188","0.003","90","","102.933","0.01","90","","1620.5","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(2,3-isatin-bis(thiosemicarbazonato))-dimethyltin(IV)","","- C12 H15 N7 S2 Sn -","- C12 H15 N7 S2 Sn -","- C48 H60 N28 S8 Sn4 -","4","1","","Casas, José S.; Castiñeiras, Alfonso; Rodríguez-Argüelles, María C.; Sánchez, Agustín; Sordo, José; Vázquez-López, Antonia; Vázquez-López, Ezequiel M.","Reactions of diorganotin(IV) oxides with isatin 3- and 2-thiosemicarbazones and with isatin 2,3-bis(thiosemicarbazone): influence of diphenyldithiophosphinic acid (isatin = 1H-indole-2,3-dione)","Journal of the Chemical Society, Dalton Transactions","2000","","22","4056","","10.1039/b005103i","","","0.71073","MoKα","","0.2034","0.0634","","","0.0904","0.1193","","","","","","0.981","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010016","13.6323","0.0001","17.8182","0.0001","19.2083","0.0001","90","","104.518","0.0006","90","","4516.77","0.05","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Bis-[2,6-bis-{N-cyclohexylcarbaldimino}pyridine]copper(II) ditetrafluoroborate nitromethane solvate","","- C41 H57 B2 Cu F8 N7 O2 -","- C41 H57 B2 Cu F8 N7 O2 -","- C164 H228 B8 Cu4 F32 N28 O8 -","4","1","","Holland, Joanne M.; Liu, Xiaoming; Zhao, Jing P.; Mabbs, Frank E.; Kilner, Colin A.; Thornton-Pett, Mark; Halcrow, Malcolm A.","Copper complexes of 2,6-bis(iminomethyl)pyridine derivatives and of 1,3-bis(pyridin-2-yl)pyrazole. Effects of ligand bulk and conformational strain on the ground state of a six-co-ordinate copper(II) ion","Journal of the Chemical Society, Dalton Transactions","2000","","19","3316","","10.1039/b005105p","","","0.71073","MoKα","","0.0601","0.0558","","","0.1543","0.1591","","","","","","1.043","","","","has coordinates,has disorder","179804","2020-10-21","18:00:00",""
"7010017","11.1235","0.0001","17.0639","0.0002","19.9979","0.0003","81.69","0.0008","75.72","0.0008","89.099","0.0008","3639.12","0.08","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","Bis-[2,6-bis-{N-tert-butylcarbaldimino}pyridine]copper(II) ditetrafluoroborate hemi-acetone solvate","","- C31.5 H49 B2 Cu F8 N6 O0.5 -","- C31.5 H49 B2 Cu F8 N6 O0.5 -","- C126 H196 B8 Cu4 F32 N24 O2 -","4","2","","Holland, Joanne M.; Liu, Xiaoming; Zhao, Jing P.; Mabbs, Frank E.; Kilner, Colin A.; Thornton-Pett, Mark; Halcrow, Malcolm A.","Copper complexes of 2,6-bis(iminomethyl)pyridine derivatives and of 1,3-bis(pyridin-2-yl)pyrazole. Effects of ligand bulk and conformational strain on the ground state of a six-co-ordinate copper(II) ion","Journal of the Chemical Society, Dalton Transactions","2000","","19","3316","","10.1039/b005105p","","","0.71073","MoKα","","0.0553","0.043","","","0.1161","0.1266","","","","","","1.027","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7010018","11.6577","0.0002","26.3752","0.0004","16.2105","0.0002","90","","105.199","0.001","90","","4809.96","0.13","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis-[2,6-bis-{N-(2,4,6-trimethylphenyl)carbaldimino}pyridine]copper(I) tetrafluoroborate acetonitrile solvate","","- C52 H57 B Cu F4 N7 -","- C52 H57 B Cu F4 N7 -","- C208 H228 B4 Cu4 F16 N28 -","4","1","","Holland, Joanne M.; Liu, Xiaoming; Zhao, Jing P.; Mabbs, Frank E.; Kilner, Colin A.; Thornton-Pett, Mark; Halcrow, Malcolm A.","Copper complexes of 2,6-bis(iminomethyl)pyridine derivatives and of 1,3-bis(pyridin-2-yl)pyrazole. Effects of ligand bulk and conformational strain on the ground state of a six-co-ordinate copper(II) ion","Journal of the Chemical Society, Dalton Transactions","2000","","19","3316","","10.1039/b005105p","","","0.71073","MoKα","","0.0586","0.0422","","","0.1028","0.1108","","","","","","1.024","","","","has coordinates,has disorder","179804","2020-10-21","18:00:00",""
"7010019","8.7526","0.0019","8.7892","0.0019","19.381","0.005","90","","92.334","0.014","90","","1489.7","0.6","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","Bis-[1,3-di{pyridin-2-yl}pyrazole]copper(II) diperchlorate","","- C26 H20 Cl2 Cu N8 O8 -","- C28 H20 Cl2 Cu N6 O8 -","- C56 H40 Cl4 Cu2 N12 O16 -","2","1","","Holland, Joanne M.; Liu, Xiaoming; Zhao, Jing P.; Mabbs, Frank E.; Kilner, Colin A.; Thornton-Pett, Mark; Halcrow, Malcolm A.","Copper complexes of 2,6-bis(iminomethyl)pyridine derivatives and of 1,3-bis(pyridin-2-yl)pyrazole. Effects of ligand bulk and conformational strain on the ground state of a six-co-ordinate copper(II) ion","Journal of the Chemical Society, Dalton Transactions","2000","","19","3316","","10.1039/b005105p","","","0.71073","MoKα","","0.1249","0.0892","","","0.2276","0.2601","","","","","","1.066","","","","has coordinates,has disorder","179804","2020-10-21","18:00:00",""
"7010020","6.101","0.001","18.445","0.003","6.518","0.001","90","","112.92","0.01","90","","675.58","0.19","150","","150","","","","","","","","solvothermal synthesis","6","P 1 21/n 1","-P 2yn","14","","ethylenediamine copper-antimony sulphide","","- C H4 Cu2 N S3 Sb -","- C H4 Cu2 N S3 Sb -","- C4 H16 Cu8 N4 S12 Sb4 -","4","1","","Powell, Anthony V.; Boissière, Sylvain; Chippindale, Ann M.","A new mixed-valent copper‒antimony sulfide: [H2NCH2CH2NH2]0.5[Cu2SbS3]","Journal of the Chemical Society, Dalton Transactions","2000","","22","4192","","10.1039/b005111j","","","0.71069","MoKα","","","0.0553","","","0.0645","","","","","1.0875","1.0875","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7010021","12.589","0.002","21.768","0.004","14.617","0.003","90","","112.67","0.02","90","","3696.1","1.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tetrakis-(N,N-diisopropylcarbamato)titanium(iv)","","- C28 H56 N4 O8 Ti -","- C28 H56 N4 O8 Ti -","- C112 H224 N16 O32 Ti4 -","4","1","","Daniela Belli Dell'Amico; Fausto Calderazzo; Sandra Ianelli; Luca Labella; Fabio Marchetti; Giancarlo Pelizzi","Stepwise substitution of N,N-di-isopropylcarbamato groups of Ti(O2CNiPr2)4 by triphenylsilanol leading from eight- to six- and four-co-ordinated titanium(IV)","J. Chem. Soc., Dalton Trans.","2000","","23","4339","4342","10.1039/b005114o","","","0.7093","MoKα","","","0.0457","","","0.1052","0.1052","","","","","","0.631","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010022","11.003","0.001","13.298","0.002","18.403","0.003","83.63","0.01","84.05","0.01","66.8","0.01","2454.4","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Bis-(N,N-diisopropylcarbamato)bis(triphenylsilanolato)titanium(iv)","","- C50 H58 N2 O6 Si2 Ti -","- C50 H58 N2 O6 Si2 Ti -","- C100 H116 N4 O12 Si4 Ti2 -","2","1","","Daniela Belli Dell'Amico; Fausto Calderazzo; Sandra Ianelli; Luca Labella; Fabio Marchetti; Giancarlo Pelizzi","Stepwise substitution of N,N-di-isopropylcarbamato groups of Ti(O2CNiPr2)4 by triphenylsilanol leading from eight- to six- and four-co-ordinated titanium(IV)","J. Chem. Soc., Dalton Trans.","2000","","23","4339","4342","10.1039/b005114o","","","0.71073","MoKα","","0.1439","0.0625","","","0.1191","0.1508","","","","","","1.01","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010023","9.6955","0.0004","12.4482","0.0006","20.4091","0.0009","90","","91.194","0.001","90","","2462.67","0.19","203","2","203","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H35 Cl Si Zr -","- C26 H35 Cl Si Zr -","- C104 H140 Cl4 Si4 Zr4 -","4","1","","Lee, Hyosun; Bridgewater, Brian M.; Parkin, Gerard","Influence of a [Me2Si] ansa bridge on the barrier to rotation about the Zr‒phenyl bond and on the generation and reactivity of benzyne intermediates: comparison of the structures and reactivity of [Me2Si(C5Me4)2]Zr(Ph)X and Cp*2Zr(Ph)X (X = H, Cl, Ph)","Journal of the Chemical Society, Dalton Transactions","2000","","24","4490","","10.1039/b005117i","","","0.71073","MoKα","","0.0467","0.032","","","0.0765","0.0829","","","","","","1.024","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010024","8.7032","0.0007","9.6822","0.0008","15.8118","0.0012","89.326","0.001","79.892","0.002","70.091","0.001","1231.66","0.17","223","2","223","2","","","","","","","","4","P -1","-P 1","2","","","","- C28 H37 N Zr -","- C28 H37 N Zr -","- C56 H74 N2 Zr2 -","2","1","","Lee, Hyosun; Bridgewater, Brian M.; Parkin, Gerard","Influence of a [Me2Si] ansa bridge on the barrier to rotation about the Zr‒phenyl bond and on the generation and reactivity of benzyne intermediates: comparison of the structures and reactivity of [Me2Si(C5Me4)2]Zr(Ph)X and Cp*2Zr(Ph)X (X = H, Cl, Ph)","Journal of the Chemical Society, Dalton Transactions","2000","","24","4490","","10.1039/b005117i","","","0.71073","MoKα","","0.0704","0.047","","","0.0991","0.1075","","","","","","1.049","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010025","9.899","0.001","11.497","0.002","13.928","0.002","74.67","0.01","79.25","0.01","86.97","0.01","1501.9","0.4","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C35 H43 Si Zr -","- C35 H43 Si Zr -","- C70 H86 Si2 Zr2 -","2","1","","Lee, Hyosun; Bridgewater, Brian M.; Parkin, Gerard","Influence of a [Me2Si] ansa bridge on the barrier to rotation about the Zr‒phenyl bond and on the generation and reactivity of benzyne intermediates: comparison of the structures and reactivity of [Me2Si(C5Me4)2]Zr(Ph)X and Cp*2Zr(Ph)X (X = H, Cl, Ph)","Journal of the Chemical Society, Dalton Transactions","2000","","24","4490","","10.1039/b005117i","","","0.71073","MoKα","","0.0455","0.0401","","0.1127","0.1079","","","","1.051","1.063","1.063","","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010026","8.4788","0.0004","16.186","0.0008","17.4483","0.0009","89.919","0.001","85.415","0.001","83.084","0.001","2369.5","0.2","203","2","203","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H35 Cl Zr -","- C26 H35 Cl Zr -","- C104 H140 Cl4 Zr4 -","4","2","","Lee, Hyosun; Bridgewater, Brian M.; Parkin, Gerard","Influence of a [Me2Si] ansa bridge on the barrier to rotation about the Zr‒phenyl bond and on the generation and reactivity of benzyne intermediates: comparison of the structures and reactivity of [Me2Si(C5Me4)2]Zr(Ph)X and Cp*2Zr(Ph)X (X = H, Cl, Ph)","Journal of the Chemical Society, Dalton Transactions","2000","","24","4490","","10.1039/b005117i","","","0.71073","MoKα","","0.0573","0.0441","","","0.1152","0.1223","","","","","","1.015","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010027","10.4751","0.001","13.998","0.0013","16.784","0.0015","90","","100.838","0.002","90","","2417.1","0.4","208","2","208","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C28 H38 Si Zr -","- C28 H38 Si Zr -","- C112 H152 Si4 Zr4 -","4","1","","Lee, Hyosun; Bridgewater, Brian M.; Parkin, Gerard","Influence of a [Me2Si] ansa bridge on the barrier to rotation about the Zr‒phenyl bond and on the generation and reactivity of benzyne intermediates: comparison of the structures and reactivity of [Me2Si(C5Me4)2]Zr(Ph)X and Cp*2Zr(Ph)X (X = H, Cl, Ph)","Journal of the Chemical Society, Dalton Transactions","2000","","24","4490","","10.1039/b005117i","","","0.71073","MoKα","","0.0909","0.0454","","","0.0753","0.085","","","","","","1.061","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010028","9.4411","0.0005","10.2964","0.0006","14.6641","0.0008","83.578","0.001","78.987","0.001","74.495","0.001","1345.53","0.13","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H40 N2 Si Zr -","- C30 H40 N2 Si Zr -","- C60 H80 N4 Si2 Zr2 -","2","1","","Lee, Hyosun; Bridgewater, Brian M.; Parkin, Gerard","Influence of a [Me2Si] ansa bridge on the barrier to rotation about the Zr‒phenyl bond and on the generation and reactivity of benzyne intermediates: comparison of the structures and reactivity of [Me2Si(C5Me4)2]Zr(Ph)X and Cp*2Zr(Ph)X (X = H, Cl, Ph)","Journal of the Chemical Society, Dalton Transactions","2000","","24","4490","","10.1039/b005117i","","","0.71073","MoKα","","0.0539","0.0438","","","0.1129","0.1197","","","","","","1.069","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010029","10.2338","0.0005","13.7292","0.0007","17.2395","0.0009","90","","105.576","0.001","90","","2333.2","0.2","203","2","203","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C26 H36 Zr -","- C26 H36 Zr -","- C104 H144 Zr4 -","4","1","","Lee, Hyosun; Bridgewater, Brian M.; Parkin, Gerard","Influence of a [Me2Si] ansa bridge on the barrier to rotation about the Zr‒phenyl bond and on the generation and reactivity of benzyne intermediates: comparison of the structures and reactivity of [Me2Si(C5Me4)2]Zr(Ph)X and Cp*2Zr(Ph)X (X = H, Cl, Ph)","Journal of the Chemical Society, Dalton Transactions","2000","","24","4490","","10.1039/b005117i","","","0.71073","MoKα","","0.0474","0.041","","","0.1063","0.1104","","","","","","1.031","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010030","9.3667","0.001","16.3096","0.0018","34.803","0.004","90","","92.765","0.002","90","","5310.6","1","203","2","203","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C32 H40 Zr -","- C32 H40 Zr -","- C256 H320 Zr8 -","8","2","","Lee, Hyosun; Bridgewater, Brian M.; Parkin, Gerard","Influence of a [Me2Si] ansa bridge on the barrier to rotation about the Zr‒phenyl bond and on the generation and reactivity of benzyne intermediates: comparison of the structures and reactivity of [Me2Si(C5Me4)2]Zr(Ph)X and Cp*2Zr(Ph)X (X = H, Cl, Ph)","Journal of the Chemical Society, Dalton Transactions","2000","","24","4490","","10.1039/b005117i","","","0.71073","MoKα","","0.0623","0.052","","","0.1098","0.1141","","","","","","1.202","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010031","33.377","0.004","10.2787","0.001","22.969","0.003","90","","109.633","0.008","90","","7421.9","1.5","183","2","183","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C86.5 H71 Cl Fe2 O1.5 P4 Ru -","- C86.5 H71 Cl Fe2 O1.5 P4 Ru -","- C346 H284 Cl4 Fe8 O6 P16 Ru4 -","4","1","","Long, Nicholas J.; Martin, Angela J.; White, Andrew J. P.; Williams, David J.; Fontani, Marco; Laschi, Franco; Zanello, Piero","Synthesis and characterisation of unsymmetrical metal (RuII, OsII) and ferrocenyl complexes of 1,3,5-triethynylbenzene","Journal of the Chemical Society, Dalton Transactions","2000","","19","3387","","10.1039/b005186l","","","1.54178","CuKα","","0.1655","0.0983","","0.3165","0.2455","","","","1.053","1.159","1.159","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7010034","10.146","0.002","16.243","0.009","20.054","0.004","90","","101.85","0.02","90","","3234","2","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","[C6H4((NCH2tBu)2GeC(NCH2tBu)2C6H4]","","","- C33 H52 Ge N4 -","- C33 H52 Ge N4 -","- C132 H208 Ge4 N16 -","4","1","","Gehrhus, Barbara; Hitchcock, Peter B.; Lappert, Michael F.","Crystalline (NN)C‒M(NN) complexes: synthesis, structure, bonding and lability [M = Si, Ge, Sn or Pb; (NN) = 1,2-(ButCH2N)2C6H4]","Journal of the Chemical Society, Dalton Transactions","2000","","18","3094","","10.1039/b005216g","","","0.71073","MoKα","","0.0653","0.0424","","0.1036","0.0918","","","","1.055","1.081","1.081","","","","","has coordinates,has disorder","179804","2020-10-21","18:00:00",""
"7010035","10.396","0.003","16.059","0.005","20.2","0.04","90","","103.39","0.06","90","","3281","7","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","[C6H4(NCH2tBu)2CSn(NCH2tBu)2C6H4]","","","- C33 H52 N4 Sn -","- C33 H52 N4 Sn -","- C132 H208 N16 Sn4 -","4","1","","Gehrhus, Barbara; Hitchcock, Peter B.; Lappert, Michael F.","Crystalline (NN)C‒M(NN) complexes: synthesis, structure, bonding and lability [M = Si, Ge, Sn or Pb; (NN) = 1,2-(ButCH2N)2C6H4]","Journal of the Chemical Society, Dalton Transactions","2000","","18","3094","","10.1039/b005216g","","","0.71073","MoKα","","0.0812","0.0472","","","0.0942","0.1079","","","","","","1.008","","","","has coordinates,has disorder","179804","2020-10-21","18:00:00",""
"7010036","10.421","0.004","16.015","0.004","20.254","0.01","90","","102.61","0.04","90","","3299","2","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","[C6H4(NCH2tBu)2CPb(NCH2tBu)2C6H4]","","","- C33 H52 N4 Pb -","- C33 H52 N4 Pb -","- C132 H208 N16 Pb4 -","4","1","","Gehrhus, Barbara; Hitchcock, Peter B.; Lappert, Michael F.","Crystalline (NN)C‒M(NN) complexes: synthesis, structure, bonding and lability [M = Si, Ge, Sn or Pb; (NN) = 1,2-(ButCH2N)2C6H4]","Journal of the Chemical Society, Dalton Transactions","2000","","18","3094","","10.1039/b005216g","","","0.71073","MoKα","","0.0705","0.0408","","","0.0764","0.0856","","","","","","0.989","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7010037","15.651","0.004","14.455","0.004","20.466","0.004","90","","110.88","0.01","90","","4326.1","1.9","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H52 Ag2 Cl2 N8 O12 -","- C32 H52 Ag2 Cl2 N8 O12 -","- C128 H208 Ag8 Cl8 N32 O48 -","4","1","","Zhu, Hai-Liang; Tong, Ye-Xiang; Chen, Xiao-Ming","Influence of ligand backbones and counter ions on structures of helical silver(I) complexes with di-Schiff bases derived from phthalaldehydes and diamine","Journal of the Chemical Society, Dalton Transactions","2000","","22","4182","","10.1039/b005228k","","","0.71073","MoKα","","0.1401","0.0664","","","0.1435","0.1747","","","","","","1.018","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010038","28.884","0.002","15.422","0.001","20.187","0.001","90","","90.31","0.004","90","","8992.1","1","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C32 H53 Ag2 F12 N8 O4.5 P2 -","- C32 H53 Ag2 F12 N8 O4.5 P2 -","- C256 H424 Ag16 F96 N64 O36 P16 -","8","1","","Zhu, Hai-Liang; Tong, Ye-Xiang; Chen, Xiao-Ming","Influence of ligand backbones and counter ions on structures of helical silver(I) complexes with di-Schiff bases derived from phthalaldehydes and diamine","Journal of the Chemical Society, Dalton Transactions","2000","","22","4182","","10.1039/b005228k","","","0.71073","MoKα","","0.095","0.0722","","","0.2073","0.2249","","","","","","1.044","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7010039","12.429","0.002","13.367","0.003","17.158","0.003","81.75","0.01","77.53","0.01","78.7","0.01","2714.1","0.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H29.5 Ag N6 O8.25 -","- C23 H29.5 Ag N6 O8.25 -","- C92 H118 Ag4 N24 O33 -","4","2","","Zhu, Hai-Liang; Tong, Ye-Xiang; Chen, Xiao-Ming","Influence of ligand backbones and counter ions on structures of helical silver(I) complexes with di-Schiff bases derived from phthalaldehydes and diamine","Journal of the Chemical Society, Dalton Transactions","2000","","22","4182","","10.1039/b005228k","","","0.71073","MoKα","","0.1476","0.069","","","0.1339","0.1598","","","","","","0.995","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7010040","5.958","0.001","13.909","0.004","14.576","0.007","90","","90.75","0.02","90","","1207.8","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H13 Ag N3 O4 -","- C8 H13 Ag N3 O4 -","- C32 H52 Ag4 N12 O16 -","4","1","","Zhu, Hai-Liang; Tong, Ye-Xiang; Chen, Xiao-Ming","Influence of ligand backbones and counter ions on structures of helical silver(I) complexes with di-Schiff bases derived from phthalaldehydes and diamine","Journal of the Chemical Society, Dalton Transactions","2000","","22","4182","","10.1039/b005228k","","","0.71073","MoKα","","0.127","0.0728","","","0.1713","0.1981","","","","","","1.021","","","","has coordinates,has disorder","179804","2020-10-21","18:00:00",""
"7010041","10.831","0.004","13.264","0.004","17.913","0.006","86.08","0.002","87.157","0.002","65.773","0.002","2340.6","1.4","125","","125","","","","","","","","?","5","P -1","-P 1","2","","","","- C52 H40 As4 Mo O6 -","- C52 H40 As4 Mo O6 -","- C104 H80 As8 Mo2 O12 -","2","1","","Doerrer, Linda H.; Green, Jennifer C.; Green, Malcolm L. H.; Haiduc, Ionel; Jardine, Christian N.; Pascu, Sofia I.; Silaghi-Dumitrescu, Luminita; Watkin, David J.","Group 6 transition metal carbonyl complexes with chalcogen-bridged diarsenic(III) ligands","Journal of the Chemical Society, Dalton Transactions","2000","","19","3347","","10.1039/b005269h","","","0.71073","MoKα","","","0.0265","","","","0.0307","","","","","","1.0375","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7010042","9.939","0.002","11.591","0.005","13.01","0.005","106.77","0.002","95.13","0.002","112.79","0.002","1288.2","0.8","150","","150","","","","","","","","?","5","P -1","-P 1","2","","","","- C28 H20 As2 Cr O5 -","- C28 H20 As2 Cr O5 -","- C56 H40 As4 Cr2 O10 -","2","1","","Doerrer, Linda H.; Green, Jennifer C.; Green, Malcolm L. H.; Haiduc, Ionel; Jardine, Christian N.; Pascu, Sofia I.; Silaghi-Dumitrescu, Luminita; Watkin, David J.","Group 6 transition metal carbonyl complexes with chalcogen-bridged diarsenic(III) ligands","Journal of the Chemical Society, Dalton Transactions","2000","","19","3347","","10.1039/b005269h","","","0.71073","MoKα","","","0.0279","","","","0.0327","","","","","","1.0458","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7010043","10.664","0.0003","9.616","0.0003","26.238","0.0005","90","","92.816","0.002","90","","2687.33","0.12","125","","125","","","","","","","","?","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H20 As2 Cr O6 -","- C29 H20 As2 Cr O6 -","- C116 H80 As8 Cr4 O24 -","4","1","","Doerrer, Linda H.; Green, Jennifer C.; Green, Malcolm L. H.; Haiduc, Ionel; Jardine, Christian N.; Pascu, Sofia I.; Silaghi-Dumitrescu, Luminita; Watkin, David J.","Group 6 transition metal carbonyl complexes with chalcogen-bridged diarsenic(III) ligands","Journal of the Chemical Society, Dalton Transactions","2000","","19","3347","","10.1039/b005269h","","","0.71069","MoKα","","","0.0272","","","","0.0325","","","","","","1.0608","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7010044","10.79","0.006","13.288","0.007","19.831","0.006","79.572","0.003","85.858","0.003","82.035","0.003","2766","2","298","","298","","","","","","","","?","6","P -1","-P 1","2","","","","- C28 H20 As2 Cr O4 S -","- C28 H20 As2 Cr O4 S -","- C112 H80 As8 Cr4 O16 S4 -","4","2","","Doerrer, Linda H.; Green, Jennifer C.; Green, Malcolm L. H.; Haiduc, Ionel; Jardine, Christian N.; Pascu, Sofia I.; Silaghi-Dumitrescu, Luminita; Watkin, David J.","Group 6 transition metal carbonyl complexes with chalcogen-bridged diarsenic(III) ligands","Journal of the Chemical Society, Dalton Transactions","2000","","19","3347","","10.1039/b005269h","","","0.71069","MoKα","","","0.0444","","","","0.0489","","","","","","1.0959","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7010045","10.456","0.002","26.817","0.005","17.543","0.004","90","","96.14","0.03","90","","4890.8","1.7","150","","150","","","","","","","","?","6","C 1 2/c 1","-C 2yc","15","","","","- C26 H20 As2 Mo0.5 O2 S -","- C26 H20 As2 Mo0.5 O2 S -","- C208 H160 As16 Mo4 O16 S8 -","8","1","","Doerrer, Linda H.; Green, Jennifer C.; Green, Malcolm L. H.; Haiduc, Ionel; Jardine, Christian N.; Pascu, Sofia I.; Silaghi-Dumitrescu, Luminita; Watkin, David J.","Group 6 transition metal carbonyl complexes with chalcogen-bridged diarsenic(III) ligands","Journal of the Chemical Society, Dalton Transactions","2000","","19","3347","","10.1039/b005269h","","","0.71073","MoKα","","","0.0379","","","","0.0373","","","","","","1.0636","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7010046","9.758","0.001","17.658","0.003","10.326","0.001","90","","96.04","0.01","90","","1769.4","0.4","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2,2,2-tris(dimethylamido)-closo-2,1,12-tantalacarborane","","- C8 H29 B9 N3 Ta -","- C8 H29 B9 N3 Ta -","- C32 H116 B36 N12 Ta4 -","4","1","","Batsanov, Andrei S.; Eva, Pauline A.; Fox, Mark A.; Howard, Judith A. K.; Hughes, Andrew K.; Johnson, Andrew L.; Martin, Aileen M.; Wade, Ken","First structural characterisation of a 2,1,12-MC2B9 metallacarborane, [2,2,2-(NMe2)3-closo-2,1,12-TaC2B9H11]. Trends in boron NMR shifts on replacing a {BH} vertex with a metal {MLn} vertex in icosahedral carboranes","Journal of the Chemical Society, Dalton Transactions","2000","","20","3519","","10.1039/b005294i","","","0.71073","MoKα","","0.0223","0.0164","","","0.0352","0.0366","","","","","","1.123","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010047","10.538","0.001","12.001","0.001","14.136","0.002","90","","90","","90","","1787.7","0.3","120","2","120","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","2,2,2-tris(dimethylamido)-closo-2,1,7-tantalacarborane","","- C8 H29 B9 N3 Ta -","- C8 H29 B9 N3 Ta -","- C32 H116 B36 N12 Ta4 -","4","0.5","","Batsanov, Andrei S.; Eva, Pauline A.; Fox, Mark A.; Howard, Judith A. K.; Hughes, Andrew K.; Johnson, Andrew L.; Martin, Aileen M.; Wade, Ken","First structural characterisation of a 2,1,12-MC2B9 metallacarborane, [2,2,2-(NMe2)3-closo-2,1,12-TaC2B9H11]. Trends in boron NMR shifts on replacing a {BH} vertex with a metal {MLn} vertex in icosahedral carboranes","Journal of the Chemical Society, Dalton Transactions","2000","","20","3519","","10.1039/b005294i","","","0.71073","MoKα","","0.0554","0.0524","","","0.1364","0.1377","","","","","","1.32","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010048","14.298","0.002","13.7595","0.0015","28.23","0.004","90","","90","","90","","5553.8","1.3","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C24 H30 Cl2 Fe N6 O8 -","- C24 H30 Cl2 Fe N6 O8 -","- C192 H240 Cl16 Fe8 N48 O64 -","8","1","","Fallis, Ian A.; Farley, Richard D.; Malik, K. M. Abdul; Murphy, Damien M.; Smith, Hayley J.","Divalent first-row transition metal complexes of the rigid pendant-arm ligand 1,4,7-tris(2-aminophenyl)-1,4,7-triazacyclononane †","Journal of the Chemical Society, Dalton Transactions","2000","","20","3632","","10.1039/b005402j","","","0.71073","MoKα","","0.1089","0.0413","","0.1044","0.0935","","","","0.95","1.201","1.201","","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010049","14.282","0.004","13.765","0.005","28.182","0.004","90","","90","","90","","5540","3","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C24 H30 Cl2 N6 Ni O8 -","- C24 H30 Cl2 N6 Ni O8 -","- C192 H240 Cl16 N48 Ni8 O64 -","8","1","","Fallis, Ian A.; Farley, Richard D.; Malik, K. M. Abdul; Murphy, Damien M.; Smith, Hayley J.","Divalent first-row transition metal complexes of the rigid pendant-arm ligand 1,4,7-tris(2-aminophenyl)-1,4,7-triazacyclononane †","Journal of the Chemical Society, Dalton Transactions","2000","","20","3632","","10.1039/b005402j","","","0.71073","MoKα","","0.182","0.0672","","0.1801","0.1499","","","","0.957","1.204","1.204","","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010050","11.064","0.006","11.197","0.004","13.814","0.007","75.13","0.03","74.41","0.04","67.95","0.03","1504.4","1.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H36 Cl2 Cu N6 O9 -","- C26 H36 Cl2 Cu N6 O9 -","- C52 H72 Cl4 Cu2 N12 O18 -","2","1","","Fallis, Ian A.; Farley, Richard D.; Malik, K. M. Abdul; Murphy, Damien M.; Smith, Hayley J.","Divalent first-row transition metal complexes of the rigid pendant-arm ligand 1,4,7-tris(2-aminophenyl)-1,4,7-triazacyclononane †","Journal of the Chemical Society, Dalton Transactions","2000","","20","3632","","10.1039/b005402j","","","0.71073","MoKα","","0.2316","0.0838","","0.2153","0.1688","","","","0.875","1.217","1.217","","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010051","15.799","0.008","15.86","0.01","17.17","0.01","89.17","0.03","89.64","0.04","76.57","0.05","4184","4","223.2","","223.2","","","","","","","","","6","P -1","-P 1","2","","","","- C40 H30 Cl2 N8 O8 Ru -","- C42 H32.5 Cl2 N8.5 O10 Ru -","- C168 H130 Cl8 N34 O40 Ru4 -","4","2","","Komatsuzaki, Nobuko; Katoh, Ryuzi; Himeda, Yuichiro; Sugihara, Hideki; Arakawa, Hironori; Kasuga, Kazuyuki","Structure and photochemical properties of ruthenium complexes having dimethyl-substituted DPPZ or TPPHZ as a ligand †","Journal of the Chemical Society, Dalton Transactions","2000","","18","3053","","10.1039/b005428n","","","0.7107","MoKα","","0.0738","0.0738","","","0.0865","0.093","","","","","","2.225","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7010052","16.623","0.003","10.299","0.002","11.368","0.002","90","","119.23","0.03","90","","1698.4","0.7","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C18 H12 Co N2 O4 -","- C18 H12 Co N2 O4 -","- C72 H48 Co4 N8 O16 -","4","0.5","","Tao, Jun; Tong, Ming-Liang; Chen, Xiao-Ming","Hydrothermal synthesis and crystal structures of three-dimensional co-ordination frameworks constructed with mixed terephthalate (tp) and 4,4'-bipyridine (4,4'-bipy) ligands: [M(tp)(4,4'-bipy)] (M = CoII, CdII or ZnII)","Journal of the Chemical Society, Dalton Transactions","2000","","20","3669","","10.1039/b005438k","","","0.71073","MoKα","","0.0411","0.0337","","","0.0908","0.0942","","","","","","1.031","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010053","16.108","0.003","11.675","0.002","20.171","0.004","90","","111.99","0.03","90","","3517.4","1.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H12 Cd N2 O4 -","- C18 H8 Cd N2 O4 -","- C144 H64 Cd8 N16 O32 -","8","1","","Tao, Jun; Tong, Ming-Liang; Chen, Xiao-Ming","Hydrothermal synthesis and crystal structures of three-dimensional co-ordination frameworks constructed with mixed terephthalate (tp) and 4,4'-bipyridine (4,4'-bipy) ligands: [M(tp)(4,4'-bipy)] (M = CoII, CdII or ZnII)","Journal of the Chemical Society, Dalton Transactions","2000","","20","3669","","10.1039/b005438k","","","0.71073","MoKα","","0.0355","0.026","","","0.0672","0.0707","","","","","","1.045","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010054","9.187","0.002","10.276","0.002","10.976","0.002","67.89","0.03","68.19","0.03","65.69","0.03","845.6","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H12 N2 O4 Zn -","- C18 H9 N2 O4 Zn -","- C36 H18 N4 O8 Zn2 -","2","1","","Tao, Jun; Tong, Ming-Liang; Chen, Xiao-Ming","Hydrothermal synthesis and crystal structures of three-dimensional co-ordination frameworks constructed with mixed terephthalate (tp) and 4,4'-bipyridine (4,4'-bipy) ligands: [M(tp)(4,4'-bipy)] (M = CoII, CdII or ZnII)","Journal of the Chemical Society, Dalton Transactions","2000","","20","3669","","10.1039/b005438k","","","0.71073","MoKα","","0.0571","0.0463","","","0.1216","0.1282","","","","","","0.987","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010055","10.716","0.002","18.008","0.002","18.978","0.004","90","","98.01","0.01","90","","3626.5","1.1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","bis[1,3-(diphenylphosphino)propane]- [eta-3-(1-methoxy-2-cicloocten-1-yl]-palladium(II) exafluorophosphate","","- C36 H41 F6 O P3 Pd -","- C36 H41 F6 O P3 Pd -","- C144 H164 F24 O4 P12 Pd4 -","4","1","","Milani, Barbara; Paronetto, Federica; Zangrando, Ennio","Ligand driven σ,π-η3 structural rearrangements of organopalladium complexes: their relevance to the CO/styrene copolymerisation reaction","Journal of the Chemical Society, Dalton Transactions","2000","","18","3055","","10.1039/b005492p","","","0.71073","MoKα","","0.1062","0.049","","0.1389","0.1256","","","","0.975","1.189","1.189","","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010056","5.864","0.004","15.723","0.006","6.963","0.003","90","","100.36","0.04","90","","631.5","0.6","293","2","293","2","","","","","","","Hydrothermal synthesis djp440bi","5","P 1 21/c 1","-P 2ybc","14","Sodium cobalt oxalate","Disodium dicobalto(2+)tris[ethandioate(2-)] dihydrate","","- C3 H2 Co Na O7 -","- C3 H2 Co Na O7 -","- C12 H8 Co4 Na4 O28 -","4","1","","Price, Daniel J.; Powell, Annie K.; Wood, Paul T.","Hydrothermal synthesis, structure, stability and magnetism of Na2Co2(C2O4)3(H2O)2: a new metal oxalate ladder †","Journal of the Chemical Society, Dalton Transactions","2000","","20","3566","","10.1039/b005494l","","","0.71073","MoKα","","0.038","0.0211","","0.0579","0.0526","","","","1.029","1.059","1.059","","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010057","3.729","0.001","19.753","0.004","8.203","0.002","90","","101.91","0.03","90","","591.2","0.3","300","2","300","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","dipotassium bis(oxalodihydroxamato)nickolate(II) dihydrate","","- C4 H8 K2 N4 Ni O10 -","- C4 H8 K2 N4 Ni O10 -","- C8 H16 K4 N8 Ni2 O20 -","2","0.5","","Jolanta Świątek-Kozłowska; Igor O. Fritsky; Agnieszka Dobosz; Aldona Karaczyn; Nikolai M. Dudarenko; Tatiana Yu. Sliva; Elżbieta Gumienna-Kontecka; Lucjan Jerzykiewicz","Chelating dihydroxamic acids: study of metal speciation and co-ordination compounds with Ni2+ and Cu2+","J. Chem. Soc., Dalton Trans.","2000","","22","4064","4068","10.1039/b005500j","","","0.71073","MoKα","","0.0299","0.0234","","","0.0647","0.0738","","","","","","1.181","","","","has coordinates","193981","2020-10-21","18:00:00",""
"7010058","5.8163","0.0003","8.7676","0.0004","14.8481","0.0009","77.31","0.002","83.073","0.002","84.686","0.002","731.58","0.07","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C7 H6 Br1.5 I1.5 O4 S3 -","- C7 H6 Br1.5 I1.5 O4 S3 -","- C14 H12 Br3 I3 O8 S6 -","2","1","","Skabara, Peter J.; Bricklebank, Neil; Berridge, Rory; Long, Stephen; Light, Mark E.; Coles, Simon J.; Hursthouse, Michael B.","Crystal engineering towards highly ordered polymeric structures of 1,3-dithiole-2-thione‒dihalogen adducts †","Journal of the Chemical Society, Dalton Transactions","2000","","19","3235","","10.1039/b005570k","","","0.71073","MoKα","","0.0567","0.0535","","","0.1539","0.1574","","","","","","1.074","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7010059","13.529","0.004","33.568","0.01","14.134","0.005","90","","104.69","0.05","90","","6209","4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C68 H76 O2 P2 Rh2 S2 -","- C68 H76 O2 P2 Rh2 S2 -","- C272 H304 O8 P8 Rh8 S8 -","4","1","","Dilworth, Jonathan R.; Morales, David; Zheng, Yifan","Rhodium and iridium complexes with thiolate and tertiary phosphine ligands. The synthesis and structures of trans-[Ir(SC6H3Cl2-2,6)(CO)(PPh3)2], [Rh2(?-SC6H3Pri3-2,4,6)2(CO)2(PPh3)2], [Rh2H2(?-SC6H4PPh2-2)2(CO)2(PPh3)2][BF4]2, and [Rh2I6(MeSC6H4PPh2-2)2]","Journal of the Chemical Society, Dalton Transactions","2000","","17","3007","","10.1039/b005588n","","","0.71069","MoKα","","0.1006","0.0637","","0.1432","0.1356","","","","0.973","1.182","1.182","","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010060","9.2039","0.001","11.6","0.002","19.014","0.003","99.934","0.01","95.243","0.01","106.744","0.01","1893.3","0.5","293","2","","","","","","","","","","7","P -1","-P 1","2","","","","- C43 H33 Cl2 Ir O P2 S -","- C43 H33 Cl2 Ir O P2 S -","- C86 H66 Cl4 Ir2 O2 P4 S2 -","2","1","","Dilworth, Jonathan R.; Morales, David; Zheng, Yifan","Rhodium and iridium complexes with thiolate and tertiary phosphine ligands. The synthesis and structures of trans-[Ir(SC6H3Cl2-2,6)(CO)(PPh3)2], [Rh2(?-SC6H3Pri3-2,4,6)2(CO)2(PPh3)2], [Rh2H2(?-SC6H4PPh2-2)2(CO)2(PPh3)2][BF4]2, and [Rh2I6(MeSC6H4PPh2-2)2]","Journal of the Chemical Society, Dalton Transactions","2000","","17","3007","","10.1039/b005588n","","","","MoKα","","0.0262","0.0222","","0.0591","0.0575","","","","1.131","1.15","1.15","","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010061","11.931","0.002","13.554","0.009","22.814","0.004","97.7","0.03","97.87","0.01","97.41","0.04","3581","3","293","2","291","2","","","","","","","","8","P -1","-P 1","2","","","","- C74 H60 B2 F8 O2 P4 Rh2 S2 -","- C74 H58 B2 F8 O3 P4 Rh2 S2 -","- C148 H116 B4 F16 O6 P8 Rh4 S4 -","2","1","","Dilworth, Jonathan R.; Morales, David; Zheng, Yifan","Rhodium and iridium complexes with thiolate and tertiary phosphine ligands. The synthesis and structures of trans-[Ir(SC6H3Cl2-2,6)(CO)(PPh3)2], [Rh2(?-SC6H3Pri3-2,4,6)2(CO)2(PPh3)2], [Rh2H2(?-SC6H4PPh2-2)2(CO)2(PPh3)2][BF4]2, and [Rh2I6(MeSC6H4PPh2-2)2]","Journal of the Chemical Society, Dalton Transactions","2000","","17","3007","","10.1039/b005588n","","","0.71073","MoKα","","0.1009","0.0685","","0.2476","0.1951","","","","1.008","0.958","0.958","","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010062","12.503","0.002","12.982","0.005","14.481","0.003","90","0.013","92.51","","90","","2348.2","1.1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C19 H17 I3 P Rh S -","- C19 H17 I3 P Rh S -","- C76 H68 I12 P4 Rh4 S4 -","4","1","","Dilworth, Jonathan R.; Morales, David; Zheng, Yifan","Rhodium and iridium complexes with thiolate and tertiary phosphine ligands. The synthesis and structures of trans-[Ir(SC6H3Cl2-2,6)(CO)(PPh3)2], [Rh2(?-SC6H3Pri3-2,4,6)2(CO)2(PPh3)2], [Rh2H2(?-SC6H4PPh2-2)2(CO)2(PPh3)2][BF4]2, and [Rh2I6(MeSC6H4PPh2-2)2]","Journal of the Chemical Society, Dalton Transactions","2000","","17","3007","","10.1039/b005588n","","","0.71073","MoKα","","0.0738","0.043","","0.0971","0.0925","","","","0.801","1.003","1.003","","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010063","9.8222","0.0003","11.8553","0.0004","10.4718","0.0004","90","","94.866","0.002","90","","1215","0.07","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H6 Co N8 O -","- C9 H6 Co N8 O -","- C36 H24 Co4 N32 O4 -","4","1","","Sun, Bai-Wang; Gao, Song; Ma, Bao-Qing; Niu, De-Zhong; Wang, Zhe-Ming","Syntheses, structures and magnetic properties of three-dimensional co-ordination polymers constructed by dimer subunits","Journal of the Chemical Society, Dalton Transactions","2000","","22","4187","","10.1039/b005612j","","","0.71073","MoKα","","0.0687","0.05","","","0.1281","0.1516","","","","","","1.243","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010064","9.7889","0.0005","11.7071","0.0006","10.5283","0.0004","90","","94.61","0.003","90","","1202.64","0.1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H6 N8 Ni O -","- C9 H6 N8 Ni O -","- C36 H24 N32 Ni4 O4 -","4","1","","Sun, Bai-Wang; Gao, Song; Ma, Bao-Qing; Niu, De-Zhong; Wang, Zhe-Ming","Syntheses, structures and magnetic properties of three-dimensional co-ordination polymers constructed by dimer subunits","Journal of the Chemical Society, Dalton Transactions","2000","","22","4187","","10.1039/b005612j","","","0.71073","MoKα","","0.0995","0.0594","","","0.1377","0.1814","","","","","","1.138","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010065","9.8655","0.0003","12.164","0.0004","10.5046","0.0003","90","","94.795","0.002","90","","1256.18","0.07","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H6 Mn N8 O -","- C9 H6 Mn N8 O -","- C36 H24 Mn4 N32 O4 -","4","1","","Sun, Bai-Wang; Gao, Song; Ma, Bao-Qing; Niu, De-Zhong; Wang, Zhe-Ming","Syntheses, structures and magnetic properties of three-dimensional co-ordination polymers constructed by dimer subunits","Journal of the Chemical Society, Dalton Transactions","2000","","22","4187","","10.1039/b005612j","","","0.71073","MoKα","","0.0414","0.0336","","","0.0889","0.0934","","","","","","1.059","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010066","13.837","0.002","14.443","0.006","16.918","0.005","80.9","0.02","81.53","0.02","62.38","0.02","2947.4","1.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C50 H30 Au2 Co6 O13 P2 -","- C50 H30 Au2 Co6 O13 P2 -","- C100 H60 Au4 Co12 O26 P4 -","2","1","","Reina, Roser; Riba, Olga; Rossell, Oriol; Seco, Miquel; de Montauzon, Dominique; Pellinghelli, Maria Angela; Tiripicchio, Antonio; Font-Bardía, Mercè; Solans, Xavier","Mixed cobalt/gold clusters based on octahedral or prismatic Co6C skeletons","Journal of the Chemical Society, Dalton Transactions","2000","","23","4464","","10.1039/b005651k","","","0.71073","MoKα","","0.2108","0.1327","","","0.3151","0.3647","","","","","","1.192","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010067","9.63","0.006","22.128","0.007","21.598","0.008","90","","95.44","0.03","90","","4582","4","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C40 H35 Au Co6 N O13 P -","- C40 H35 Au Co6 N O13 P -","- C160 H140 Au4 Co24 N4 O52 P4 -","4","1","","Reina, Roser; Riba, Olga; Rossell, Oriol; Seco, Miquel; de Montauzon, Dominique; Pellinghelli, Maria Angela; Tiripicchio, Antonio; Font-Bardía, Mercè; Solans, Xavier","Mixed cobalt/gold clusters based on octahedral or prismatic Co6C skeletons","Journal of the Chemical Society, Dalton Transactions","2000","","23","4464","","10.1039/b005651k","","","0.71069","MoKα","","0.1933","0.0492","","","0.103","0.14","","","","","","0.84","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010068","8.921","0.002","11.935","0.002","13.274","0.005","90","","90","","90","","1413.3","0.7","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C3 H8 Ca0.5 Ni0.5 O7 -","- C3 H8 Ca0.5 Ni0.5 O7 -","- C24 H64 Ca4 Ni4 O56 -","8","1","","de Muro, Izaskun Gil; Insausti, Maite; Lezama, Luis; Urtiaga, M. Karmele; Arriortua, M. Isabel; Rojo, Teófilo","Study of the [CaM(C3H2O4)2(H2O)4]·nH2O [M = Mn, Fe or Co (n = 0) and Ni (n = 2)] systems: synthesis, structure, spectroscopic and magnetic properties","Journal of the Chemical Society, Dalton Transactions","2000","","19","3360","","10.1039/b005661h","","","0.7107","MoKα","","0.1408","0.05","","","0.0936","0.1498","","","","","","1.077","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7010069","14.086","0.002","7.488","0.001","13.273","0.003","90","","118.68","0.02","90","","1228.2","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C6 H12 Ca Mn O12 -","- C6 H12 Ca Mn O12 -","- C24 H48 Ca4 Mn4 O48 -","4","0.5","","de Muro, Izaskun Gil; Insausti, Maite; Lezama, Luis; Urtiaga, M. Karmele; Arriortua, M. Isabel; Rojo, Teófilo","Study of the [CaM(C3H2O4)2(H2O)4]·nH2O [M = Mn, Fe or Co (n = 0) and Ni (n = 2)] systems: synthesis, structure, spectroscopic and magnetic properties","Journal of the Chemical Society, Dalton Transactions","2000","","19","3360","","10.1039/b005661h","","","0.7107","MoKα","","0.0445","0.0269","","0.0851","0.0633","","","","1.019","1.042","1.042","","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010070","10.5702","0.0008","6.6361","0.0005","14.9708","0.0011","90","","91.221","0.003","90","","1049.89","0.14","89","2","89","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","[Au(CH3OCNHCH3)2][C7Cl2NO3].CHCl3","","","- C14 H15 Au Cl5 N3 O5 -","- C14 H15 Au Cl5 N3 O5 -","- C28 H30 Au2 Cl10 N6 O10 -","2","0.5","","Jiang, Feilong; Olmstead, Marilyn M.; Balch, Alan L.","Aurophilic attractions: one cation, [Au{C(OMe)NMeH}2]+, but three different structural arrangements in the solid state salts","Journal of the Chemical Society, Dalton Transactions","2000","","22","4098","","10.1039/b005684g","","","0.71073","MoKα","","0.0196","0.018","","","0.044","0.0446","","","","","","1.059","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010071","9.333","0.0005","9.4169","0.0005","10.4907","0.0006","75.623","0.001","68.21","0.001","89.039","0.001","826.4","0.08","90","2","90","2","","","","","","","","6","P -1","-P 1","2","[Au(CH3OCNHCH3)2][C7Cl2NO3]","","","- C13 H14 Au Cl2 N3 O5 -","- C13 H14 Au Cl2 N3 O5 -","- C26 H28 Au2 Cl4 N6 O10 -","2","1","","Jiang, Feilong; Olmstead, Marilyn M.; Balch, Alan L.","Aurophilic attractions: one cation, [Au{C(OMe)NMeH}2]+, but three different structural arrangements in the solid state salts","Journal of the Chemical Society, Dalton Transactions","2000","","22","4098","","10.1039/b005684g","","","0.71073","MoKα","","0.0424","0.028","","","0.048","0.0508","","","","","","0.908","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010072","6.5408","0.0003","13.5187","0.0007","14.8583","0.0008","90","","90","","90","","1313.82","0.12","89","2","89","2","","","","","","","","6","P n m a","-P 2ac 2n","62","[Au(CH3OCNHCH3)2][CF3COO]","","","- C8 H14 Au F3 N2 O4 -","- C8 H14 Au F3 N2 O4 -","- C32 H56 Au4 F12 N8 O16 -","4","0.5","","Jiang, Feilong; Olmstead, Marilyn M.; Balch, Alan L.","Aurophilic attractions: one cation, [Au{C(OMe)NMeH}2]+, but three different structural arrangements in the solid state salts","Journal of the Chemical Society, Dalton Transactions","2000","","22","4098","","10.1039/b005684g","","","0.71073","MoKα","","0.0202","0.0171","","","0.0395","0.0405","","","","","","1.068","","","","has coordinates,has disorder","179804","2020-10-21","18:00:00",""
"7010073","12.2534","0.0019","22.046","0.003","19.251","0.002","90","","108.157","0.013","90","","4941.5","1.2","173","2","173","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C54 H51 B Cl2 F3 N P4 Ru -","- C54 H51 B Cl2 F3 N P4 Ru -","- C216 H204 B4 Cl8 F12 N4 P16 Ru4 -","4","1","","Rocchini, Eliana; Rigo, Pierluigi; Mezzetti, Antonio; Stephan, Tim; Morris, Robert H.; Lough, Alan J.; Forde, Cameron E.; Fong, Tina P.; Drouin, Samantha D.","Synthesis and properties of iron-group hydrido-cyano complexes trans-[MH(CN)(L)2], M = Fe, Ru or Os, L = diphosphine, and their hydrogen, trifluoroboron and triphenylboron isocyanide derivatives of the type trans-[MH(CNH)(L)2]O3SCF3, trans-[MH(CNBX3)(L)2], X = F or Ph, and trans-[M(H2)(CNBF3)(dppp)2]BF4 [dppp = Ph2P(CH2)3PPh2]","Journal of the Chemical Society, Dalton Transactions","2000","","20","3591","","10.1039/b005687l","","","0.71073","MoKα","","0.0562","0.0395","","","0.1002","0.105","","","","","","1.006","","","","has coordinates,has disorder","209453","2020-10-21","18:00:00",""
"7010074","14.9769","0.0011","22.955","0.003","18.864","0.003","90","","108.859","0.009","90","","6137.2","1.4","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C72 H66 B Cl2 N P4 Ru -","- C72 H66 B Cl2 N P4 Ru -","- C288 H264 B4 Cl8 N4 P16 Ru4 -","4","1","","Rocchini, Eliana; Rigo, Pierluigi; Mezzetti, Antonio; Stephan, Tim; Morris, Robert H.; Lough, Alan J.; Forde, Cameron E.; Fong, Tina P.; Drouin, Samantha D.","Synthesis and properties of iron-group hydrido-cyano complexes trans-[MH(CN)(L)2], M = Fe, Ru or Os, L = diphosphine, and their hydrogen, trifluoroboron and triphenylboron isocyanide derivatives of the type trans-[MH(CNH)(L)2]O3SCF3, trans-[MH(CNBX3)(L)2], X = F or Ph, and trans-[M(H2)(CNBF3)(dppp)2]BF4 [dppp = Ph2P(CH2)3PPh2]","Journal of the Chemical Society, Dalton Transactions","2000","","20","3591","","10.1039/b005687l","","","0.71073","MoKα","","0.0555","0.0325","","","0.0669","0.0714","","","","","","0.895","","","","has coordinates","209453","2020-10-21","18:00:00",""
"7010075","12.825","0.002","21.23","0.003","18.373","0.002","90","","107.904","0.012","90","","4760.2","1.2","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C53 H50 B F4 N Os P4 -","- C53 H50 B F4 N Os P4 -","- C212 H200 B4 F16 N4 Os4 P16 -","4","1","","Rocchini, Eliana; Rigo, Pierluigi; Mezzetti, Antonio; Stephan, Tim; Morris, Robert H.; Lough, Alan J.; Forde, Cameron E.; Fong, Tina P.; Drouin, Samantha D.","Synthesis and properties of iron-group hydrido-cyano complexes trans-[MH(CN)(L)2], M = Fe, Ru or Os, L = diphosphine, and their hydrogen, trifluoroboron and triphenylboron isocyanide derivatives of the type trans-[MH(CNH)(L)2]O3SCF3, trans-[MH(CNBX3)(L)2], X = F or Ph, and trans-[M(H2)(CNBF3)(dppp)2]BF4 [dppp = Ph2P(CH2)3PPh2]","Journal of the Chemical Society, Dalton Transactions","2000","","20","3591","","10.1039/b005687l","","","0.71073","MoKα","","0.0757","0.0439","","","0.0956","0.1028","","","","","","0.929","","","","has coordinates","209453","2020-10-21","18:00:00",""
"7010076","16.536","0.004","17.005","0.002","22.28","0.008","90","","96.73","0.02","90","","6222","3","173","2","173","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C54 H50 F3 N O3 P4 Ru S -","- C54 H50 F3 N O3 P4 Ru S -","- C216 H200 F12 N4 O12 P16 Ru4 S4 -","4","1","","Rocchini, Eliana; Rigo, Pierluigi; Mezzetti, Antonio; Stephan, Tim; Morris, Robert H.; Lough, Alan J.; Forde, Cameron E.; Fong, Tina P.; Drouin, Samantha D.","Synthesis and properties of iron-group hydrido-cyano complexes trans-[MH(CN)(L)2], M = Fe, Ru or Os, L = diphosphine, and their hydrogen, trifluoroboron and triphenylboron isocyanide derivatives of the type trans-[MH(CNH)(L)2]O3SCF3, trans-[MH(CNBX3)(L)2], X = F or Ph, and trans-[M(H2)(CNBF3)(dppp)2]BF4 [dppp = Ph2P(CH2)3PPh2]","Journal of the Chemical Society, Dalton Transactions","2000","","20","3591","","10.1039/b005687l","","","0.71073","MoKα","","0.0588","0.0457","","","0.126","0.1319","","","","","","1.046","","","","has coordinates,has disorder","209453","2020-10-21","18:00:00",""
"7010077","10.153","0.001","21.418","0.003","14.176","0.002","90","","97.8","0.02","90","","3054.1","0.6","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C34 H47 O3 P -","- C34 H47 O3 P -","- C136 H188 O12 P4 -","4","1","","Siefert, Rolf; Weyhermüller, Thomas; Chaudhuri, Phalguni","Isolation, structural and spectroscopic investigations of complexes with tridentate [O,P,O] and [O,O,O] donor ligands","Journal of the Chemical Society, Dalton Transactions","2000","","24","4656","","10.1039/b005693f","","","0.71073","MoKα","","0.0648","0.0478","","0.1259","0.1158","","","","1.013","1.058","1.058","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7010078","13.432","0.001","15.174","0.002","17.048","0.002","89.99","0.02","79","0.02","72.07","0.02","3238.8","0.8","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C68 H92 Ni O4 P2 -","- C68 H92 Ni O4 P2 -","- C136 H184 Ni2 O8 P4 -","2","1","","Siefert, Rolf; Weyhermüller, Thomas; Chaudhuri, Phalguni","Isolation, structural and spectroscopic investigations of complexes with tridentate [O,P,O] and [O,O,O] donor ligands","Journal of the Chemical Society, Dalton Transactions","2000","","24","4656","","10.1039/b005693f","","","0.71073","MoKα","","0.1152","0.0589","","0.1412","0.1193","","","","0.979","1.07","1.07","","","","","has coordinates,has disorder","179804","2020-10-21","18:00:00",""
"7010079","14.428","0.002","17.91","0.003","27.35","0.005","90","","95.61","0.02","90","","7034","2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C73 H103 Co O6.25 P2 -","- C73 H101 Co O6 P2 -","- C292 H404 Co4 O24 P8 -","4","1","","Siefert, Rolf; Weyhermüller, Thomas; Chaudhuri, Phalguni","Isolation, structural and spectroscopic investigations of complexes with tridentate [O,P,O] and [O,O,O] donor ligands","Journal of the Chemical Society, Dalton Transactions","2000","","24","4656","","10.1039/b005693f","","","0.71073","MoKα","","0.1306","0.0663","","0.1907","0.1626","","","","1.004","1.202","1.202","","","","","has coordinates,has disorder","179804","2020-10-21","18:00:00",""
"7010080","13.4953","0.0009","19.8157","0.0012","24.397","0.002","90","","92.23","0.02","90","","6519.3","0.8","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C68 H94 Cl O5 P2 Rh -","- C68 H94 Cl O5 P2 Rh -","- C272 H376 Cl4 O20 P8 Rh4 -","4","1","","Siefert, Rolf; Weyhermüller, Thomas; Chaudhuri, Phalguni","Isolation, structural and spectroscopic investigations of complexes with tridentate [O,P,O] and [O,O,O] donor ligands","Journal of the Chemical Society, Dalton Transactions","2000","","24","4656","","10.1039/b005693f","","","0.71073","MoKα","","0.0679","0.0378","","0.089","0.0813","","","","0.963","1.073","1.073","","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010081","15.036","0.002","16.294","0.003","18.969","0.003","99.19","0.02","102.99","0.02","108.59","0.02","4155.3","1.5","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C78 H121 Co2 O11.5 P2 -","- C78 H118 Co2 O11.5 P2 -","- C156 H236 Co4 O23 P4 -","2","1","","Siefert, Rolf; Weyhermüller, Thomas; Chaudhuri, Phalguni","Isolation, structural and spectroscopic investigations of complexes with tridentate [O,P,O] and [O,O,O] donor ligands","Journal of the Chemical Society, Dalton Transactions","2000","","24","4656","","10.1039/b005693f","","","0.71073","MoKα","","0.1266","0.0691","","0.1984","0.1642","","","","1.015","1.112","1.112","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7010082","14.069","0.003","15.14","0.003","16.208","0.003","90","","97.21","0.03","90","","3425.1","1.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H26 Mo2 O11 S3 -","- C25 H26 Mo2 O11 S3 -","- C100 H104 Mo8 O44 S12 -","4","1","","Adams, Harry; Allott, Christopher; Bancroft, Matthew N.; Morris, Michael J.","Wraparound ligands: addition of activated alkynes to sulfur- and thiolate-bridged dimolybdenum complexes derived from trithiocarbonates","Journal of the Chemical Society, Dalton Transactions","2000","","24","4520","","10.1039/b005700m","","","0.71073","MoKα","","0.1715","0.1112","","0.4402","0.2999","","","","1.037","0.973","0.973","","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010083","9.9813","0.0005","16.7621","0.0009","16.0913","0.0009","90","","90.77","0.001","90","","2692","0.2","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C25 H28 Mo2 O8 S3 -","- C25 H28 Mo2 O8 S3 -","- C100 H112 Mo8 O32 S12 -","4","1","","Adams, Harry; Allott, Christopher; Bancroft, Matthew N.; Morris, Michael J.","Wraparound ligands: addition of activated alkynes to sulfur- and thiolate-bridged dimolybdenum complexes derived from trithiocarbonates","Journal of the Chemical Society, Dalton Transactions","2000","","24","4520","","10.1039/b005700m","","","0.71073","MoKα","","0.0565","0.0451","","","0.1071","0.1161","","","","","","1.138","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010084","8.637","0.006","30.228","0.002","9.501","0.001","90","","92.77","0.06","90","","2477.6","1.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H24 Mo2 O6 S3 -","- C23 H24 Mo2 O6 S3 -","- C92 H96 Mo8 O24 S12 -","4","1","","Adams, Harry; Allott, Christopher; Bancroft, Matthew N.; Morris, Michael J.","Wraparound ligands: addition of activated alkynes to sulfur- and thiolate-bridged dimolybdenum complexes derived from trithiocarbonates","Journal of the Chemical Society, Dalton Transactions","2000","","24","4520","","10.1039/b005700m","","","0.71073","MoKα","","0.0672","0.0519","","0.1906","0.1312","","","","1.132","1.006","1.006","","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010085","10.132","0.002","18.609","0.004","14.999","0.003","90","","108.04","0.03","90","","2689","1.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H26 Mo2 O8 S3 -","- C25 H26 Mo2 O8 S3 -","- C100 H104 Mo8 O32 S12 -","4","1","","Adams, Harry; Allott, Christopher; Bancroft, Matthew N.; Morris, Michael J.","Wraparound ligands: addition of activated alkynes to sulfur- and thiolate-bridged dimolybdenum complexes derived from trithiocarbonates","Journal of the Chemical Society, Dalton Transactions","2000","","24","4520","","10.1039/b005700m","","","0.71073","MoKα","","0.0523","0.0472","","0.1346","0.1293","","","","1.091","1.109","1.109","","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010086","14.095","0.002","15.534","0.003","21.134","0.004","90","","98.38","0.02","90","","4577.9","1.4","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C37 H51 Fe N12 Ni2 O6 S3 -","- C37 H51 Fe N12 Ni2 O6 S3 -","- C148 H204 Fe4 N48 Ni8 O24 S12 -","4","1","","Verani, Cláudio Nazari; Rentschler, Eva; Weyhermüller, Thomas; Bill, Eckhard; Chaudhuri, Phalguni","On the rational synthesis and properties of exchange-coupled heterotrinuclear systems containing [MAMBMB] and [MAMBMC] cores †","Journal of the Chemical Society, Dalton Transactions","2000","","23","4263","","10.1039/b005768l","","","0.71073","MoKα","","0.1203","0.0529","","0.1294","0.1119","","","","0.997","1.199","1.199","","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010087","14.981","0.008","13.289","0.007","12.952","0.005","90","","92.86","0.04","90","","2575","2","200","2","200","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C12 H44 Li4 O12 -","- C12 H44 Li4 O12 -","- C48 H176 Li16 O48 -","4","0.5","","Starikova, Zoya A.; Turevskaya, Evgeniya P.; Turova, Nataliya Ya.; Yanovsky, Alexsandr I.","The structure of the LiOMe·2MeOH crystal solvate. A new structural type for tetrameric alkoxides","Journal of the Chemical Society, Dalton Transactions","2000","","19","3237","","10.1039/b005782g","","","0.71073","MoKα","","0.138","0.0586","","0.1804","0.1312","","","","0.867","1.055","1.055","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7010088","6.7128","0.0007","8.2692","0.0012","12.497","0.002","90","","104.418","0.011","90","","671.85","0.16","150","2","150","2","","","","","","","","6","P 1 c 1","P -2yc","7","","","","- C11 H11 Cl N O5 Re -","- C11 H11 Cl N O5 Re -","- C22 H22 Cl2 N2 O10 Re2 -","2","1","","Creber, Michel L.; Orrell, Keith G.; Osborne, Anthony G.; Šik, Vladimir; Hursthouse, Michael B.; Abdul Malik, K. M.","Dynamic NMR investigations of fluxionality of 2-(dimethoxymethyl)pyridine and 2,6-bis(dimethoxymethyl)pyridine in rhenium(I) and platinum(IV) complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","22","4218","","10.1039/b005821l","","","0.71069","MoKα","","0.0519","0.0486","","0.1246","0.1243","0.1408","","","1.091","1.112","1.112","0.993","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010089","8.939","0.002","12.575","0.005","14.183","0.004","79.66","0.02","73.25","0.02","87.47","0.03","1501.8","0.8","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C11 H20 I N O2 Pt -","- C11 H20 I N O2 Pt -","- C44 H80 I4 N4 O8 Pt4 -","4","2","","Creber, Michel L.; Orrell, Keith G.; Osborne, Anthony G.; Šik, Vladimir; Hursthouse, Michael B.; Abdul Malik, K. M.","Dynamic NMR investigations of fluxionality of 2-(dimethoxymethyl)pyridine and 2,6-bis(dimethoxymethyl)pyridine in rhenium(I) and platinum(IV) complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","22","4218","","10.1039/b005821l","","","0.71069","MoKα","","0.0649","0.0502","","0.1323","0.126","0.1408","","","1.001","1.091","1.091","0.993","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010090","17.151","0.004","9.616","0.007","22.314","0.009","90","","105.27","0.04","90","","3550","3","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C30 H52 Li2 N6 Si2 -","- C30 H52 Li2 N6 Si2 -","- C120 H208 Li8 N24 Si8 -","4","0.5","","David Doyle; Yurii K. Gun'ko; Peter B. Hitchcock; Michael F. Lappert","Synthesis and structures of lithium, aluminium, gallium and lanthanide amidinates containing a γ-pendant amine functionality","J. Chem. Soc., Dalton Trans.","2000","","22","4093","4097","10.1039/b005824f","","","0.71073","MoKα","","0.0581","0.0417","","0.1077","0.0982","","","","1.026","1.058","1.058","","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010091","8.8881","0.0003","11.4278","0.0005","10.3472","0.0005","90","","109.373","0.002","90","","991.47","0.07","173","2","173","2","","","","","","","synthesis as described","6","P 1 21 1","P 2yb","4","[AlCl2{Me3SiNC(Ph)N(CH2)3NMe2}]","","","- C15 H26 Al Cl2 N3 Si -","- C15 H26 Al Cl2 N3 Si -","- C30 H52 Al2 Cl4 N6 Si2 -","2","1","","David Doyle; Yurii K. Gun'ko; Peter B. Hitchcock; Michael F. Lappert","Synthesis and structures of lithium, aluminium, gallium and lanthanide amidinates containing a γ-pendant amine functionality","J. Chem. Soc., Dalton Trans.","2000","","22","4093","4097","10.1039/b005824f","","x-ray","0.71073","MoKα","","0.0319","0.0291","","","0.0736","0.0753","","","","","","1.048","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010092","8.8921","0.0002","11.4453","0.0003","10.4095","0.0003","90","","109.221","0.002","90","","1000.35","0.05","173","2","173","2","","","","","","","synthesis as described","6","P 1 21 1","P 2yb","4","[GaCl2(Me3SiNCPhNCH2CH2CH2NMe2)]","","","- C15 H26 Cl2 Ga N3 Si -","- C15 H26 Cl2 Ga N3 Si -","- C30 H52 Cl4 Ga2 N6 Si2 -","2","1","","David Doyle; Yurii K. Gun'ko; Peter B. Hitchcock; Michael F. Lappert","Synthesis and structures of lithium, aluminium, gallium and lanthanide amidinates containing a γ-pendant amine functionality","J. Chem. Soc., Dalton Trans.","2000","","22","4093","4097","10.1039/b005824f","","x-ray","0.71073","MoKα","","0.0239","0.0231","","","0.0564","0.0568","","","","","","1.08","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010093","10.034","0.004","18.888","0.003","22.335","0.004","90","","94.28","0.02","90","","4221","2","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C70 H128 Ce2 Cl2 N12 Si4 -","- C70 H128 Ce2 Cl2 N12 Si4 -","- C140 H256 Ce4 Cl4 N24 Si8 -","2","0.5","","David Doyle; Yurii K. Gun'ko; Peter B. Hitchcock; Michael F. Lappert","Synthesis and structures of lithium, aluminium, gallium and lanthanide amidinates containing a γ-pendant amine functionality","J. Chem. Soc., Dalton Trans.","2000","","22","4093","4097","10.1039/b005824f","","","0.71073","MoKα","","0.0629","0.0383","","0.0881","0.077","","","","1.044","1.061","1.061","","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010094","12.333","0.003","13.439","0.003","14.021","0.004","109.87","0.01","91.58","0.02","114.21","0.01","1955.2","0.9","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","","","- C35 H54 Al2 Li2 N2 O5 -","- C35 H54 Al2 Li2 N2 O5 -","- C70 H108 Al4 Li4 N4 O10 -","2","1","","Armstrong, David R.; Davies, Robert P.; Linton, David J.; Schooler, Paul; Shields, Gregory P.; Snaith, Ronald; Wheatley, Andrew E. H.","Selective oxygen capture by lithium aluminates: a solid state and theoretical structural study †","Journal of the Chemical Society, Dalton Transactions","2000","","23","4304","","10.1039/b005897l","","","1.54178","CuKα","","0.0703","0.064","","","0.1707","0.1766","","","","","","1.031","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010095","33.134","0.0016","33.134","0.0016","14.415","0.0004","90","","90","","90","","15825.7","1.2","180","2","180","2","","","","","","","","6","I 41/a :2","-I 4ad","88","rs9944","","","- C38 H50 Al2 Li2 N2 O2 -","- C38 H50 Al2 Li2 N2 O2 -","- C608 H800 Al32 Li32 N32 O32 -","16","1","","Armstrong, David R.; Davies, Robert P.; Linton, David J.; Schooler, Paul; Shields, Gregory P.; Snaith, Ronald; Wheatley, Andrew E. H.","Selective oxygen capture by lithium aluminates: a solid state and theoretical structural study †","Journal of the Chemical Society, Dalton Transactions","2000","","23","4304","","10.1039/b005897l","","","0.7107","MoKα","","0.1574","0.0926","","","0.2474","0.2922","","","","","","1.042","","","","has coordinates,has disorder","179804","2020-10-21","18:00:00",""
"7010096","9.787","0.005","11.779","0.005","14.112","0.003","108.2","0.03","101.91","0.03","108.08","0.03","1383.8","1.1","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","","","- C52 H66 Al2 Li2 N2 O4 -","- C52 H66 Al2 Li2 N2 O4 -","- C52 H66 Al2 Li2 N2 O4 -","1","0.5","","Armstrong, David R.; Davies, Robert P.; Linton, David J.; Schooler, Paul; Shields, Gregory P.; Snaith, Ronald; Wheatley, Andrew E. H.","Selective oxygen capture by lithium aluminates: a solid state and theoretical structural study †","Journal of the Chemical Society, Dalton Transactions","2000","","23","4304","","10.1039/b005897l","","","0.71069","MoKα","","0.194","0.1029","","0.3447","0.2837","","","","1.045","1.267","1.267","","","","","has coordinates,has disorder","179804","2020-10-21","18:00:00",""
"7010097","16.71","0.003","12.16","0.002","19.666","0.005","90","","104.82","0.02","90","","3863.1","1.4","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C34 H46 Cl4 Co N4 P2 Pt -","- C34 H46 Cl4 Co N4 P2 Pt -","- C136 H184 Cl16 Co4 N16 P8 Pt4 -","4","1","","Burrows, Andrew D.; Mahon, Mary F.; Palmer, Mark T.","Amine-functionalised aminophosphines: synthesis, reversible co-ordination to platinum and use in heteronuclear dimer formation","Journal of the Chemical Society, Dalton Transactions","2000","","20","3615","","10.1039/b005899h","","","0.71069","MoKα","","0.057","0.0367","","0.0886","0.0838","","","","1.017","1.114","1.114","","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010098","11.9111","0.0002","16.9049","0.0003","21.4067","0.0003","90","","96.744","0.001","90","","4280.54","0.12","295","2","295","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C49 H39 Cl N3 O3 P2 Rh -","- C49 H39 Cl N3 O3 P2 Rh -","- C196 H156 Cl4 N12 O12 P8 Rh4 -","4","1","","Dutta, Swati; Peng, Shie-Ming; Bhattacharya, Samaresh","Synthesis, structure and redox properties of some 2-(arylazo)phenolate complexes of rhodium(III) †","Journal of the Chemical Society, Dalton Transactions","2000","","24","4623","","10.1039/b005902l","","","0.71073","MoKα","","0.0636","0.0348","","0.0982","0.0823","","","","1.044","1.088","1.088","","","","","has coordinates","179804","2020-10-21","18:00:00",""
"7010099","9.981","0.002","15.61","0.004","8.943","0.002","100.06","0.02","93.74","0.02","100.16","0.02","1343.8","0.5","293","","293","","","","","","","","","7","P -1","-P 1","2","","","","- C22 H33 Cl Co N6 O4 S2 -","- C22 H33 Cl Co N6 O4 S2 -","- C44 H66 Cl2 Co2 N12 O8 S4 -","2","1","","Bhattacharyya, Sudeep; Ghosh, Dipesh; Mukhopadhyay, Suman; Jensen, William P.; Tiekink, Edward R. T.; Chaudhury, Muktimoy","Syntheses, structure and properties of cobalt-(II) and -(III) complexes of pentadentate N4S ligands with appended pyrazolyl groups: evidence for cobalt(II)‒dioxygen reversible binding","Journal of the Chemical Society, Dalton Transactions","2000","","24","4677","","10.1039/b005906o","","","0.7107","MoKalpha","","","0.0479","","","0.05","","","","","1.69","1.69","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7010100","12.86","0.01","13.13","0.01","16.01","0.02","90","","92.5","0.07","90","","2701","4","135","","135","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C22 H33 Cl2 Co N6 O4 S2 -","- C22 H33 Cl2 Co N6 O4 S2 -","- C88 H132 Cl8 Co4 N24 O16 S8 -","4","1","","Bhattacharyya, Sudeep; Ghosh, Dipesh; Mukhopadhyay, Suman; Jensen, William P.; Tiekink, Edward R. T.; Chaudhury, Muktimoy","Syntheses, structure and properties of cobalt-(II) and -(III) complexes of pentadentate N4S ligands with appended pyrazolyl groups: evidence for cobalt(II)‒dioxygen reversible binding","Journal of the Chemical Society, Dalton Transactions","2000","","24","4677","","10.1039/b005906o","","","0.7107","MoKα","","","0.07","","","","0.081","","","","","","2.14","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7010101","10.1239","0.0001","11.1114","0.0001","20.6214","0.0003","84.247","0.001","85.49","0.001","80.884","0.001","2274.23","0.05","150","1","150","1","","","","","","","","6","P -1","-P 1","2","","","","- C41 H62 Cl4 Cu2 N2 O7 -","- C41 H62 Cl4 Cu2 N2 O7 -","- C82 H124 Cl8 Cu4 N4 O14 -","2","1","","Ku, Shou-Ming; Wu, Chin-Yi; Lai, Chung K.","Bimetallomesogens: formation of calamitic or columnar mesophases by μ-exogenous-bridged groups in N,N '-(propan-2-ol)-bis(4-alkoxysalicylaldimine)copper(II) complexes †","Journal of the Chemical Society, Dalton Transactions","2000","","20","3491","","10.1039/b005936f","","","0.71073","MoKα","","0.0981","0.0828","","0.2342","0.2203","","","","1.01","1.046","1.046","","","","","has coordinates,has disorder","179805","2020-10-21","18:00:00",""
"7010102","9.8942","0.0005","13.5625","0.0009","18.4975","0.0012","69.437","0.003","76.902","0.004","69.586","0.003","2162.7","0.2","173","","173","","","","","","","","","6","P -1","-P 1","2","","","","- C44 H45 Cl4 O2 P2 Re2 -","- C44 H45 Cl4 O2 P2 Re2 -","- C88 H90 Cl8 O4 P4 Re4 -","2","1","","Bera, Jitendra K.; Lau, Sophia S.; Fanwick, Phillip E.; Walton, Richard A.","Reactions of the dirhenium(III,III) complex cis-Re2(μ-O2CMe)2Cl4(H2O)2 that lead to the dirhenium(III,II) complexes Re2(μ-O2CMe)Cl4(PR3)2 and tetrarheniumcyclodiyne clusters of the type Re4(μ-O)4Cl4(PR3)4","Journal of the Chemical Society, Dalton Transactions","2000","","23","4277","","10.1039/b005975g","","","0.71073","MO-Kα","","","0.041","","","","0.099","","","","","","0.998","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010103","9.9534","0.0005","10.2535","0.0005","10.901","0.0005","114.311","0.003","107.608","0.003","93.089","0.003","945.76","0.09","193","","193","","","","","","","","","6","P -1","-P 1","2","","","","- C36 H66 Cl3 O P2 Re -","- C36 H66 Cl4 O2 P2 Re -","- C36 H66 Cl4 O2 P2 Re -","1","0.5","","Bera, Jitendra K.; Lau, Sophia S.; Fanwick, Phillip E.; Walton, Richard A.","Reactions of the dirhenium(III,III) complex cis-Re2(μ-O2CMe)2Cl4(H2O)2 that lead to the dirhenium(III,II) complexes Re2(μ-O2CMe)Cl4(PR3)2 and tetrarheniumcyclodiyne clusters of the type Re4(μ-O)4Cl4(PR3)4","Journal of the Chemical Society, Dalton Transactions","2000","","23","4277","","10.1039/b005975g","","","0.71073","MO-Kα","","","0.043","","","","0.114","","","","","","1.102","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010104","9.4968","0.0003","12.9135","0.0005","24.8886","0.001","97.9692","0.0019","91.753","0.002","110.195","0.002","2826.83","0.19","173","","173","","","","","","","","","6","P -1","-P 1","2","","","","- C55 H54 Cl7 O2 P4 Re -","- C55 H54 Cl7 O2 P4 Re -","- C110 H108 Cl14 O4 P8 Re2 -","2","1","","Bera, Jitendra K.; Lau, Sophia S.; Fanwick, Phillip E.; Walton, Richard A.","Reactions of the dirhenium(III,III) complex cis-Re2(μ-O2CMe)2Cl4(H2O)2 that lead to the dirhenium(III,II) complexes Re2(μ-O2CMe)Cl4(PR3)2 and tetrarheniumcyclodiyne clusters of the type Re4(μ-O)4Cl4(PR3)4","Journal of the Chemical Society, Dalton Transactions","2000","","23","4277","","10.1039/b005975g","","","0.71073","MO-Kα","","","0.061","","","","0.123","","","","","","1.09","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010105","13.9995","0.0007","23.5126","0.0007","14.3633","0.0007","90","","114.2","0.0016","90","","4312.4","0.3","296","","296","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C86 H92 Cl4 O18 P4 Re4 -","- C86 H92 Cl4 O18 P4 Re8 -","- C172 H184 Cl8 O36 P8 Re16 -","2","0.5","","Bera, Jitendra K.; Lau, Sophia S.; Fanwick, Phillip E.; Walton, Richard A.","Reactions of the dirhenium(III,III) complex cis-Re2(μ-O2CMe)2Cl4(H2O)2 that lead to the dirhenium(III,II) complexes Re2(μ-O2CMe)Cl4(PR3)2 and tetrarheniumcyclodiyne clusters of the type Re4(μ-O)4Cl4(PR3)4","Journal of the Chemical Society, Dalton Transactions","2000","","23","4277","","10.1039/b005975g","","","0.71073","MO-Kα","","","0.062","","","","0.104","","","","","","1.138","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010106","16.5256","0.0003","18.6675","0.0004","33.0129","0.0004","90","","100.512","0.0011","90","","10013.3","0.3","193","","193","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C44 H48 Cl8 O6 P2 Re2 -","- C44 H48 Cl8 O6 P2 Re4 -","- C352 H384 Cl64 O48 P16 Re32 -","8","2","","Bera, Jitendra K.; Lau, Sophia S.; Fanwick, Phillip E.; Walton, Richard A.","Reactions of the dirhenium(III,III) complex cis-Re2(μ-O2CMe)2Cl4(H2O)2 that lead to the dirhenium(III,II) complexes Re2(μ-O2CMe)Cl4(PR3)2 and tetrarheniumcyclodiyne clusters of the type Re4(μ-O)4Cl4(PR3)4","Journal of the Chemical Society, Dalton Transactions","2000","","23","4277","","10.1039/b005975g","","","0.71073","MO-Kα","","","0.053","","","","0.122","","","","","","0.946","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010107","14.377","0.004","19.726","0.006","14.775","0.004","90","","111.669","0.009","90","","3894.1","1.9","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C36 H30 Cl2 Co2 O7 P2 S3 -","- C36 H30 Cl2 Co2 O7 P2 S3 -","- C144 H120 Cl8 Co8 O28 P8 S12 -","4","1","","Adams, Harry; Guio, Laurence V. Y.; Morris, Michael J.; Pratt, A. James","A novel route to dithiolenes from 1,3-dithiole-2-thiones at a dicobalt centre","Journal of the Chemical Society, Dalton Transactions","2000","","20","3489","","10.1039/b006052f","","","0.71073","MoKα","","0.1479","0.0605","","","0.1275","0.1504","","","","","","0.846","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010108","9.9531","0.0009","31.429","0.002","21.014","0.002","90","","91.577","0.008","90","","6571","1","183","2","183","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C54 H36 F35 N3 S7 Ti -","- C54 H36 F35 N3 S7 Ti -","- C216 H144 F140 N12 S28 Ti4 -","4","1","","Carmalt, Claire J.; Dinnage, Christopher W.; Parkin, Ivan P.; White, Andrew J. P.; Williams, David J.","Synthesis and structural characterisation of titanium(IV) thiolate compounds","Journal of the Chemical Society, Dalton Transactions","2000","","20","3500","","10.1039/b006115h","","","1.54178","CuKα","","0.0933","0.0536","","0.1477","0.1227","","","","1.041","1.111","1.111","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7010109","15.2002","0.0012","17.6154","0.0012","14.117","0.002","90","","91.179","0.012","90","","3779.1","0.7","193","2","193","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C32 H22 F20 N2 S4 Ti -","- C32 H22 F20 N2 S4 Ti -","- C128 H88 F80 N8 S16 Ti4 -","4","0.5","","Carmalt, Claire J.; Dinnage, Christopher W.; Parkin, Ivan P.; White, Andrew J. P.; Williams, David J.","Synthesis and structural characterisation of titanium(IV) thiolate compounds","Journal of the Chemical Society, Dalton Transactions","2000","","20","3500","","10.1039/b006115h","","","1.54178","CuKα","","0.0684","0.0552","","0.1595","0.1427","","","","1.061","1.088","1.088","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7010114","10.2048","0.0018","11.1782","0.0015","12.417","0.002","73.383","0.011","85.05","0.02","72.56","0.02","1294.9","0.4","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C25 H10 O10 Ru3 -","- C25 H10 O10 Ru3 -","- C50 H20 O20 Ru6 -","2","1","","Charmant, Jonathan P. H.; Crawford, Paul; King, Philip J.; Quesada-Pato, Roberto; Sappa, Enrico","Acid promoted formation of tri- and penta-ruthenium allenylidene complexes","Journal of the Chemical Society, Dalton Transactions","2000","","23","4390","","10.1039/b006146h","","","0.71073","MoKα","","0.0207","0.0168","","","0.0363","0.0368","","","","","","0.919","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010115","9.82","0.005","12.992","0.005","14.957","0.005","98.72","0.05","104.12","0.06","110.94","0.04","1667.2","1.5","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C30 H10 O15 Ru5 -","- C30 H10 O15 Ru5 -","- C60 H20 O30 Ru10 -","2","1","","Charmant, Jonathan P. H.; Crawford, Paul; King, Philip J.; Quesada-Pato, Roberto; Sappa, Enrico","Acid promoted formation of tri- and penta-ruthenium allenylidene complexes","Journal of the Chemical Society, Dalton Transactions","2000","","23","4390","","10.1039/b006146h","","","0.71073","MoKα","","0.0368","0.0288","","","0.0636","0.0647","","","","","","0.882","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010116","21.794","0.003","16.8602","0.0018","32.854","0.004","90","","90","","90","","12072","3","173","2","173","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C25 H8 O15 Ru5 -","- C25 H8 O15 Ru5 -","- C400 H128 O240 Ru80 -","16","2","","Charmant, Jonathan P. H.; Crawford, Paul; King, Philip J.; Quesada-Pato, Roberto; Sappa, Enrico","Acid promoted formation of tri- and penta-ruthenium allenylidene complexes","Journal of the Chemical Society, Dalton Transactions","2000","","23","4390","","10.1039/b006146h","","","0.71073","MoKα","","0.1366","0.0501","","","0.0562","0.0723","","","","","","0.945","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010117","11.5235","0.0012","15.8652","0.0016","17.0294","0.0019","65.921","0.006","81.485","0.005","76.398","0.005","2758","0.5","107","","107","","","","","","","","","6","P -1","-P 1","2","","","","- C43 H59 Cl Fe6 N4 O29 -","- C42.714 H50.5 Cl Fe6 N4 O27.422 -","- C85.428 H101 Cl2 Fe12 N8 O54.844 -","2","1","","Seddon, Elisa J.; Huffman, John C.; Christou, George","A new core topology in hexanuclear iron(III) carboxylate chemistry: [Fe6O3(O2CMe)9(OEt)2(bpy)2](ClO4) †","Journal of the Chemical Society, Dalton Transactions","2000","","23","4446","","10.1039/b006150f","","","0.71069","MoKα","","","0.0375","","","","0.0353","","","","","","1.5993","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7010118","15.379","0.003","11.402","0.002","23.776","0.005","90","","100.94","0.03","90","","4093.4","1.4","293","2","293","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C38 H42.5 Cl5 N2 O P Pt -","- C38 H42.5 Cl5 N2 O P Pt -","- C152 H170 Cl20 N8 O4 P4 Pt4 -","4","2","","Kuznetsov, Maxim L.; Bokach, Nadezhda A.; Kukushkin, Vadim Yu.; Pakkanen, Tapani; Wagner, Gabriele; Pombeiro, Armando J. L.","Metal-assisted coupling of oximes and nitriles: a synthetic, structural and theoretical study","Journal of the Chemical Society, Dalton Transactions","2000","","24","4683","","10.1039/b006168i","","","0.71073","MoKα","","0.0436","0.0436","","","0.1185","0.1185","","","","","","1.042","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7010119","13.658","0.004","15.846","0.006","19.138","0.007","111.07","0.02","105.09","0.02","96.08","0.02","3639","2","150","","150","","","","","","","","Li[(i-Pr)2[9]aneN3] + [Mo{2,6-C6H3(i-Pr)2}2Cl2(DME)2]","5","P -1","-P 1","2","","[Mo{(i-Pr)2[9]aneN3}{2,6-C6H3(i-Pr)2}2Cl]","","- C36 H60 Cl Mo N5 -","- C36 H60 Cl Mo N5 -","- C144 H240 Cl4 Mo4 N20 -","4","2","","Fletcher, John S.; Male, Nigel A. H.; Wilson, Paul J.; Rees, Leigh H.; Mountford, Philip; Schröder, Martin","New Group 5 and 6 transition metal imido complexes with monodeprotonated triazacyclononane ligands","Journal of the Chemical Society, Dalton Transactions","2000","","22","4130","","10.1039/b006177h","","","0.71069","MoKα","","","0.0475","","","","0.0564","","","","","","0.8528","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010121","16.723","0.005","17.039","0.005","7.124","0.007","90","","102.36","0.02","90","","1983","2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H14 N2 Ni S8 -","- C12 H14 N2 Ni S8 -","- C48 H56 N8 Ni4 S32 -","4","1","","Bigoli, Francesco; Cassoux, Patrick; Deplano, Paola; Mercuri, Maria Laura; Pellinghelli, Maria Angela; Pintus, Gloria; Serpe, Angela; Trogu, Emanuele F.","Synthesis, structure and properties of new unsymmetrical nickel dithiolene complexes useful as near-infrared dyes","Journal of the Chemical Society, Dalton Transactions","2000","","24","4639","","10.1039/b006206p","","","1.54184","CuKα","","0.0999","0.0635","","","0.1776","0.1979","","","","","","0.825","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010122","10.519","0.003","11.153","0.003","9.575","0.006","90","","90","","90","","1123.3","0.8","213","2","213","2","","","","","","","","4","P n n m","-P 2 2n","58","","","","- C18 H44 N4 Zn2 -","- C18 H44 N4 Zn2 -","- C36 H88 N8 Zn4 -","2","0.25","","Coward, Kathleen M.; Jones, Anthony C.; Steiner, Alexander; Bickley, Jamie F.; Smith, Lesley M.; Pemble, Martyn E.","Dimethylzinc adducts with macrocyclic amines","Journal of the Chemical Society, Dalton Transactions","2000","","19","3480","","10.1039/b006253g","","","0.71073","MoKα","","0.0525","0.0312","","","0.0731","0.0764","","","","","","0.945","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010123","12.5","0.002","8.1763","0.0008","14.442","0.002","90","","109.052","0.018","90","","1395.2","0.4","213","2","213","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 H54 N6 Zn2 -","- C22 H54 N6 Zn2 -","- C44 H108 N12 Zn4 -","2","0.5","","Coward, Kathleen M.; Jones, Anthony C.; Steiner, Alexander; Bickley, Jamie F.; Smith, Lesley M.; Pemble, Martyn E.","Dimethylzinc adducts with macrocyclic amines","Journal of the Chemical Society, Dalton Transactions","2000","","19","3480","","10.1039/b006253g","","","0.71073","MoKα","","0.0405","0.0318","","","0.0776","0.0803","","","","","","1.026","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010124","10.697","0.001","15.1764","0.001","20.0577","0.001","90","","93.224","0.008","90","","3251.1","0.4","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H20 Fe4 N4 Ni S8 -","- C28 H20 Fe4 N4 Ni S8 -","- C112 H80 Fe16 N16 Ni4 S32 -","4","0.5","","Bellamy, Dena; Christofides, Aristides; Connelly, Neil G.; Lewis, Gareth R.; Orpen, A. Guy; Thornton, Peter","Structure dependence on redox state and charge in [Fe4(μ3-S4)(η-C5H5)4]m[M(mnt)2]n (M = Ni or Pt, m, n = 1 or 2)","Journal of the Chemical Society, Dalton Transactions","2000","","22","4038","","10.1039/b006262f","","","0.71073","MoKα","","0.0407","0.027","","0.0577","0.0542","","","","0.984","1.043","1.043","","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010125","10.6645","0.0011","16.224","0.002","15.863","0.002","90","","100.836","0.01","90","","2695.7","0.6","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C48 H40 Fe8 N4 Ni S12 -","- C48 H40 Fe8 N4 Ni S12 -","- C96 H80 Fe16 N8 Ni2 S24 -","2","0.5","","Bellamy, Dena; Christofides, Aristides; Connelly, Neil G.; Lewis, Gareth R.; Orpen, A. Guy; Thornton, Peter","Structure dependence on redox state and charge in [Fe4(μ3-S4)(η-C5H5)4]m[M(mnt)2]n (M = Ni or Pt, m, n = 1 or 2)","Journal of the Chemical Society, Dalton Transactions","2000","","22","4038","","10.1039/b006262f","","","0.71073","MoKα","","0.0557","0.0448","","0.1449","0.1311","","","","1.256","1.255","1.255","","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010126","15.4336","0.001","15.681","0.002","20.781","0.003","99.398","0.009","109.254","0.014","103.937","0.013","4443.6","1.1","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H20 Fe4 N8 Pt2 S12 -","- C36 H20 Fe4 N8 Pt2 S12 -","- C144 H80 Fe16 N32 Pt8 S48 -","4","2","","Bellamy, Dena; Christofides, Aristides; Connelly, Neil G.; Lewis, Gareth R.; Orpen, A. Guy; Thornton, Peter","Structure dependence on redox state and charge in [Fe4(μ3-S4)(η-C5H5)4]m[M(mnt)2]n (M = Ni or Pt, m, n = 1 or 2)","Journal of the Chemical Society, Dalton Transactions","2000","","22","4038","","10.1039/b006262f","","","0.71073","MoKα","","0.0565","0.0402","","0.09","0.0778","","","","1.184","1.133","1.133","","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010127","9.1195","0.001","12.193","0.002","15.364","0.003","104.153","0.01","94.414","0.008","90.92","0.006","1650.5","0.5","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H20 Fe4 N4 Pt S8 -","- C28 H20 Fe4 N4 Pt S8 -","- C56 H40 Fe8 N8 Pt2 S16 -","2","1","","Bellamy, Dena; Christofides, Aristides; Connelly, Neil G.; Lewis, Gareth R.; Orpen, A. Guy; Thornton, Peter","Structure dependence on redox state and charge in [Fe4(μ3-S4)(η-C5H5)4]m[M(mnt)2]n (M = Ni or Pt, m, n = 1 or 2)","Journal of the Chemical Society, Dalton Transactions","2000","","22","4038","","10.1039/b006262f","","","0.71073","MoKα","","0.0315","0.0308","","0.083","0.0817","","","","1.114","1.106","1.106","","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010128","10.5944","0.001","16.3005","0.0015","15.665","0.0015","90","","100.977","0.015","90","","2655.8","0.5","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C48 H40 Fe8 N4 Pt S12 -","- C48 H40 Fe8 N4 Pt S12 -","- C96 H80 Fe16 N8 Pt2 S24 -","2","0.5","","Bellamy, Dena; Christofides, Aristides; Connelly, Neil G.; Lewis, Gareth R.; Orpen, A. Guy; Thornton, Peter","Structure dependence on redox state and charge in [Fe4(μ3-S4)(η-C5H5)4]m[M(mnt)2]n (M = Ni or Pt, m, n = 1 or 2)","Journal of the Chemical Society, Dalton Transactions","2000","","22","4038","","10.1039/b006262f","","","0.71073","MoKα","","0.0251","0.0232","","0.0595","0.0573","","","","1.116","1.107","1.107","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7010129","14.555","0.0008","15.5053","0.0007","18.2403","0.0009","89.686","0.003","68.223","0.002","85.079","0.003","3807.1","0.3","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C77.5 H71 Cl11 Co2 N4 P4 -","- C77.5 H71 Cl11 Co2 N4 P4 -","- C155 H142 Cl22 Co4 N8 P8 -","2","1","","Al-Benna, Sarah; Sarsfield, Mark J.; Thornton-Pett, Mark; Ormsby, Daniel L.; Maddox, Peter J.; Brès, Philippe; Bochmann, Manfred","Sterically hindered iminophosphorane complexes of vanadium, iron, cobalt and nickel: a synthetic, structural and catalytic study †","Journal of the Chemical Society, Dalton Transactions","2000","","23","4247","","10.1039/b006329k","","","0.71073","MoKα","","0.1416","0.0974","","","0.2222","0.2434","","","","","","1.11","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7010130","13.0035","0.0001","21.2311","0.0002","18.1551","0.0001","90","","107.994","0.0005","90","","4767.08","0.07","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C50 H57 Br Cl2 N2 Ni P2 -","- C50 H57 Br Cl2 N2 Ni P2 -","- C200 H228 Br4 Cl8 N8 Ni4 P8 -","4","1","","Al-Benna, Sarah; Sarsfield, Mark J.; Thornton-Pett, Mark; Ormsby, Daniel L.; Maddox, Peter J.; Brès, Philippe; Bochmann, Manfred","Sterically hindered iminophosphorane complexes of vanadium, iron, cobalt and nickel: a synthetic, structural and catalytic study †","Journal of the Chemical Society, Dalton Transactions","2000","","23","4247","","10.1039/b006329k","","","0.71073","MoKα","","0.0307","0.0272","","","0.0678","0.0702","","","","","","1.032","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010131","9.4409","0.0002","20.1425","0.0005","22.0698","0.0005","79.809","0.0013","79.541","0.0014","88.65","0.0015","4061.86","0.16","150","2","150","2","","","","","","","","8","P -1","-P 1","2","","","","- C36 H43 Br2 Cl2 Fe N3 P2 Si2 -","- C36 H43 Br2 Cl2 Fe N3 P2 Si2 -","- C144 H172 Br8 Cl8 Fe4 N12 P8 Si8 -","4","2","","Al-Benna, Sarah; Sarsfield, Mark J.; Thornton-Pett, Mark; Ormsby, Daniel L.; Maddox, Peter J.; Brès, Philippe; Bochmann, Manfred","Sterically hindered iminophosphorane complexes of vanadium, iron, cobalt and nickel: a synthetic, structural and catalytic study †","Journal of the Chemical Society, Dalton Transactions","2000","","23","4247","","10.1039/b006329k","","","0.71073","MoKα","","0.1024","0.068","","","0.1534","0.1738","","","","","","1.08","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010132","9.165","0.002","14.166","0.004","16.807","0.003","90","","96.78","0.03","90","","2166.8","0.9","160","2","160","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C21 H32 Cl N2 Nb -","- C21 H31.916 Cl1.084 N1.916 Nb -","- C84 H127.664 Cl4.336 N7.664 Nb4 -","4","1","","Humphries, Martin J.; Green, Malcolm L. H.; Leech, Michael A.; Gibson, Vernon C.; Jolly, Matthew; Williams, David N.; Elsegood, Mark R. J.; Clegg, William","Niobium η-cyclopentadienyl compounds with imido and amido ligands derived from tert-butylamine","Journal of the Chemical Society, Dalton Transactions","2000","","22","4044","","10.1039/b006333i","","","0.71073","MoKα","","0.0612","0.0396","","","0.1021","0.1113","","","","","","1.069","","","","has coordinates,has disorder","179805","2020-10-21","18:00:00",""
"7010133","6.3922","0.0006","8.4863","0.0008","10.0086","0.0009","106.187","0.001","96.428","0.002","101.436","0.002","502.92","0.08","293","2","293","2","","","","","","","","5","P -1","-P 1","2","manganese phosphonoacetate","","","- C4 H4 Mn3 O10 P2 -","- C4 H4 Mn3 O10 P2 -","- C8 H8 Mn6 O20 P4 -","2","1","","Stock, Norbert; Frey, Stephanie A.; Stucky, Galen D.; Cheetham, Anthony K.","Synthesis and characterization of two manganese phosphonocarboxylates: Mn3(O3PCH2COO)2 and Mn3(O3PCH2CH2COO)2","Journal of the Chemical Society, Dalton Transactions","2000","","23","4292","","10.1039/b006411o","","","0.71073","MoKα","","0.0381","0.032","","","0.077","0.0795","","","","","","1.039","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010134","8.207","0.003","9.34","0.003","9.188","0.003","90","","104.906","0.006","90","","680.6","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","manganese phosphonopropionate","","","- C6 H8 Mn3 O10 P2 -","- C6 H8 Mn3 O10 P2 -","- C12 H16 Mn6 O20 P4 -","2","0.5","","Stock, Norbert; Frey, Stephanie A.; Stucky, Galen D.; Cheetham, Anthony K.","Synthesis and characterization of two manganese phosphonocarboxylates: Mn3(O3PCH2COO)2 and Mn3(O3PCH2CH2COO)2","Journal of the Chemical Society, Dalton Transactions","2000","","23","4292","","10.1039/b006411o","","","0.71073","MoKα","","0.1163","0.0889","","","0.2329","0.2506","","","","","","1.096","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010135","12.9877","0.0014","9.2177","0.0006","11.6041","0.0012","90","","111.104","0.008","90","","1296","0.2","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H19 Cl N2 Pt -","- C12 H19 Cl N2 Pt -","- C48 H76 Cl4 N8 Pt4 -","4","1","","Albrecht, Martin; Lutz, Martin; Schreurs, Antoine M. M.; Lutz, Egbert T. H.; Spek, Anthony L.; van Koten, Gerard","Self-assembled organoplatinum(II) supermolecules as crystalline, SO2 gas-triggered switches †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3797","","10.1039/b006419j","","","0.71073","MoKα","","0.0294","0.0247","","","0.0491","0.0506","","","","","","1.126","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010136","16.7796","0.0001","10.0141","0.0001","9.094","0.0001","90","","90","","90","","1528.09","0.02","150","2","150","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C12 H19 Cl N2 O2 Pt S -","- C12 H19 Cl N2 O2 Pt S -","- C48 H76 Cl4 N8 O8 Pt4 S4 -","4","1","","Albrecht, Martin; Lutz, Martin; Schreurs, Antoine M. M.; Lutz, Egbert T. H.; Spek, Anthony L.; van Koten, Gerard","Self-assembled organoplatinum(II) supermolecules as crystalline, SO2 gas-triggered switches †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3797","","10.1039/b006419j","","","0.71073","MoKα","","0.0214","0.021","","","0.0529","0.0531","","","","","","1.054","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010137","8.0291","0.0009","15.1212","0.0013","25.985","0.004","90","","90","","90","","3154.8","0.7","150","2","150","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C12 H19 I N2 O2 Pt S -","- C12 H19 I N2 O2 Pt S -","- C96 H152 I8 N16 O16 Pt8 S8 -","8","1","","Albrecht, Martin; Lutz, Martin; Schreurs, Antoine M. M.; Lutz, Egbert T. H.; Spek, Anthony L.; van Koten, Gerard","Self-assembled organoplatinum(II) supermolecules as crystalline, SO2 gas-triggered switches †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3797","","10.1039/b006419j","","","0.71073","MoKα","","0.0815","0.0413","","","0.0656","0.0752","","","","","","0.982","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010138","17.598","0.0001","10.0198","0.0002","14.9081","0.0003","90","","99.119","0.001","90","","2595.5","0.08","203","2","203","2","","","","","","","","6","C 1 c 1","C -2yc","9","","[Mo Cl2 (N C6 H3 Me-2 -CH Me2-6)2 (dme)]","","- C24 H36 Cl2 Mo N2 O2 -","- C24 H36 Cl2 Mo N2 O2 -","- C96 H144 Cl8 Mo4 N8 O8 -","4","1","","Nielson, Alastair J.; Glenny, Mark W.; Rickard, Clifton E. F.; Waters, Joyce M.","Regiospecific influences of phenyl ring substituents in monoimido complexes of tantalum and tungsten and bis imido complexes of molybdenum","Journal of the Chemical Society, Dalton Transactions","2000","","24","4569","","10.1039/b006420n","","","0.71073","MoKα","","0.023","0.0198","","","0.0526","0.0543","","","","","","1.038","","","","has coordinates","288155","2023-12-07","17:20:21",""
"7010139","8.7929","0.0001","16.8765","0.0001","18.3315","0.0002","76.505","0.001","88.259","0.001","86.306","0.001","2639.34","0.05","203","2","203","2","","","","","","","","6","P -1","-P 1","2","","[Mo Cl2 (N C6 H4 CMe3-2)2(dme)]","","- C24 H36 Cl2 Mo N2 O2 -","- C24 H36 Cl2 Mo N2 O2 -","- C96 H144 Cl8 Mo4 N8 O8 -","4","2","","Nielson, Alastair J.; Glenny, Mark W.; Rickard, Clifton E. F.; Waters, Joyce M.","Regiospecific influences of phenyl ring substituents in monoimido complexes of tantalum and tungsten and bis imido complexes of molybdenum","Journal of the Chemical Society, Dalton Transactions","2000","","24","4569","","10.1039/b006420n","","","0.71073","MoKα","","0.0499","0.0344","","","0.0749","0.0914","","","","","","1.145","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010140","8.6183","0.0014","27.756","0.004","9.486","0.002","90","0.01","103.9","0.02","90","0.01","2202.7","0.7","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[W Cl3 (N C10 H7) (P Me3)2]","","- C16 H25 Cl3 N P2 W -","- C16 H25 Cl3 N P2 W -","- C64 H100 Cl12 N4 P8 W4 -","4","1","","Nielson, Alastair J.; Glenny, Mark W.; Rickard, Clifton E. F.; Waters, Joyce M.","Regiospecific influences of phenyl ring substituents in monoimido complexes of tantalum and tungsten and bis imido complexes of molybdenum","Journal of the Chemical Society, Dalton Transactions","2000","","24","4569","","10.1039/b006420n","","","0.71069","MoKα","","0.0933","0.0603","","","0.156","0.1756","","","","","","1.031","","","","has coordinates,has disorder","179805","2020-10-21","18:00:00",""
"7010141","8.688","","9.4309","0.0001","19.9949","0.0003","90.39","","94.694","0.001","116.93","","1453.97","0.03","203","2","203","2","","","","","","","","6","P -1","-P 1","2","","[W Cl2 (N C6H4 CMe3-2)(P Me3)3]","","- C22.5 H43.5 Cl2 N P3 W -","- C22.5 H43.5 Cl2 N P3 W -","- C45 H87 Cl4 N2 P6 W2 -","2","1","","Nielson, Alastair J.; Glenny, Mark W.; Rickard, Clifton E. F.; Waters, Joyce M.","Regiospecific influences of phenyl ring substituents in monoimido complexes of tantalum and tungsten and bis imido complexes of molybdenum","Journal of the Chemical Society, Dalton Transactions","2000","","24","4569","","10.1039/b006420n","","","0.71073","MoKα","","0.0275","0.0261","","","0.0675","0.0683","","","","","","1.067","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7010142","9.1057","0.0001","15.0474","0.0001","19.8071","0.0001","90","","90","","90","","2713.91","0.04","203","2","203","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","[W Cl2 (N C6 H4 Ph-2) (P Me3)3]","[W Cl2 (N C6 H4 Ph-2) (P Me3)3]","","- C21 H36 Cl2 N P3 W -","- C21 H36 Cl2 N P3 W -","- C84 H144 Cl8 N4 P12 W4 -","4","1","","Nielson, Alastair J.; Glenny, Mark W.; Rickard, Clifton E. F.; Waters, Joyce M.","Regiospecific influences of phenyl ring substituents in monoimido complexes of tantalum and tungsten and bis imido complexes of molybdenum","Journal of the Chemical Society, Dalton Transactions","2000","","24","4569","","10.1039/b006420n","","","0.71073","MoKα","","0.0216","0.0206","","","0.0465","0.0468","","","","","","0.979","","","","has coordinates,has disorder","288155","2023-12-07","17:20:22",""
"7010143","8.3472","0.0001","10.0506","0.0002","16.8679","0.0002","100.66","","93.253","0.001","93.475","0.001","1384.81","0.04","203","2","203","2","","","","","","","","5","P -1","-P 1","2","","[Ta Cl4 (N C6 H4 CMe3-2)(py)].pyH.C H2 Cl2","","- C21 H26 Cl6 N3 Ta -","- C21 H26 Cl6 N3 Ta -","- C42 H52 Cl12 N6 Ta2 -","2","1","","Nielson, Alastair J.; Glenny, Mark W.; Rickard, Clifton E. F.; Waters, Joyce M.","Regiospecific influences of phenyl ring substituents in monoimido complexes of tantalum and tungsten and bis imido complexes of molybdenum","Journal of the Chemical Society, Dalton Transactions","2000","","24","4569","","10.1039/b006420n","","","0.71073","MoKα","","0.0507","0.0427","","","0.1107","0.1157","","","","","","1.069","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010144","14.912","0.002","14.169","0.004","21.961","0.004","90","","97.324","0.012","90","","4602.2","1.7","200","2","200","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C19 H24 Cl F6 N2 O Ru Sb -","- C19 H24 Cl F6 N2 O Ru Sb -","- C152 H192 Cl8 F48 N16 O8 Ru8 Sb8 -","8","2","","Davenport, Adam J.; Davies, David L.; Fawcett, John; Garratt, Shaun A.; Russell, David R.","Arene ruthenium complexes with pyridyloxazolines: synthesis and applications as asymmetric catalysts for Diels‒Alder reactions †","Journal of the Chemical Society, Dalton Transactions","2000","","23","4432","","10.1039/b006530g","","","0.71073","MoKα","","0.082","0.0553","","","0.1294","0.1446","","","","","","1.026","","","","has coordinates,has disorder","179805","2020-10-21","18:00:00",""
"7010145","12.446","0.002","12.77","0.005","26.884","0.003","90","","90","","90","","4272.8","1.9","190","2","190","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C50 H50 B Cl N2 O2 Ru -","- C50 H50 B Cl N2 O2 Ru -","- C200 H200 B4 Cl4 N8 O8 Ru4 -","4","1","","Davenport, Adam J.; Davies, David L.; Fawcett, John; Garratt, Shaun A.; Russell, David R.","Arene ruthenium complexes with pyridyloxazolines: synthesis and applications as asymmetric catalysts for Diels‒Alder reactions †","Journal of the Chemical Society, Dalton Transactions","2000","","23","4432","","10.1039/b006530g","","","0.71073","MoKα","","0.0548","0.0444","","0.1196","0.1106","","","","1.049","1.047","1.047","","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010146","11.524","0.003","11.672","0.002","19.208","0.007","90","","90","","90","","2583.6","1.2","190","2","190","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C24 H24 Cl F6 N2 O Ru Sb -","- C24 H24 Cl F6 N2 O Ru Sb -","- C96 H96 Cl4 F24 N8 O4 Ru4 Sb4 -","4","1","","Davenport, Adam J.; Davies, David L.; Fawcett, John; Garratt, Shaun A.; Russell, David R.","Arene ruthenium complexes with pyridyloxazolines: synthesis and applications as asymmetric catalysts for Diels‒Alder reactions †","Journal of the Chemical Society, Dalton Transactions","2000","","23","4432","","10.1039/b006530g","","","0.71073","MoKα","","0.0493","0.0428","","0.1094","0.1035","","","","1.064","1.057","1.057","","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010147","8.924","0.004","11.185","0.007","14.678","0.012","85.61","0.06","80.07","0.05","71.32","0.04","1366.8","1.6","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H28 B2 F4 P2 Pt -","- C28 H28 B2 F4 P2 Pt -","- C56 H56 B4 F8 P4 Pt2 -","2","1","","Lu, Norman; Norman, Nicholas C.; Orpen, A. Guy; Quayle, Michael J.; Timms, Peter L.; Whittell, George R.","Transition metal complexes incorporating the BF2 ligand formed by oxidative addition of the B‒B bond in B2F4","Journal of the Chemical Society, Dalton Transactions","2000","","22","4032","","10.1039/b006535h","","","0.71073","MoKα","","0.0497","0.0343","","0.0688","0.0647","","","","0.988","1.027","1.027","","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010148","9.9312","0.0008","18.493","0.002","38.273","0.004","90","","90","","90","","7029.1","1.2","173","2","173","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C37 H30 B3 F6 Ir O P2 -","- C37 H30 B3 F6 Ir O P2 -","- C296 H240 B24 F48 Ir8 O8 P16 -","8","1","","Lu, Norman; Norman, Nicholas C.; Orpen, A. Guy; Quayle, Michael J.; Timms, Peter L.; Whittell, George R.","Transition metal complexes incorporating the BF2 ligand formed by oxidative addition of the B‒B bond in B2F4","Journal of the Chemical Society, Dalton Transactions","2000","","22","4032","","10.1039/b006535h","","","0.71073","MoKα","","0.0613","0.0358","","0.0658","0.0582","","","","1.097","1.142","1.142","","","","","has coordinates,has disorder","179805","2020-10-21","18:00:00",""
"7010149","8.707","0.004","10.872","0.005","14.645","0.008","85.32","0.03","79.59","0.02","72.21","0.04","1297.8","1.1","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C28 H28 Cl3.5 N2 O4 P2 Pt -","- C28 H28 Cl0.34 N1.66 O3.32 P2 Pt -","- C56 H56 Cl0.68 N3.32 O6.64 P4 Pt2 -","2","1","","Lu, Norman; Norman, Nicholas C.; Orpen, A. Guy; Quayle, Michael J.; Timms, Peter L.; Whittell, George R.","Transition metal complexes incorporating the BF2 ligand formed by oxidative addition of the B‒B bond in B2F4","Journal of the Chemical Society, Dalton Transactions","2000","","22","4032","","10.1039/b006535h","","","0.71073","MoKα","","0.1403","0.0647","","0.1156","0.0895","","","","0.973","0.987","0.987","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7010150","13.2859","0.0006","13.2859","0.0006","13.2859","0.0006","90","","90","","90","","2345.16","0.18","293","2","293","2","","","","","","","","6","P 21 3","P 2ac 2ab 3","198","","","","- C6.86 H20.57 B0.57 Co0.57 F2.29 P2.29 -","- C6.85714 H20.5714 B0.571429 Co0.571429 F2.28571 P2.28571 -","- C48 H144 B4 Co4 F16 P16 -","7","0.583333","","Lu, Norman; Norman, Nicholas C.; Orpen, A. Guy; Quayle, Michael J.; Timms, Peter L.; Whittell, George R.","Transition metal complexes incorporating the BF2 ligand formed by oxidative addition of the B‒B bond in B2F4","Journal of the Chemical Society, Dalton Transactions","2000","","22","4032","","10.1039/b006535h","","","0.71073","MoKα","","0.0443","0.0311","","","0.0685","0.0728","","","","","","0.971","","","","has coordinates,has disorder","179805","2020-10-21","18:00:00",""
"7010151","20.802","0.009","11.124","0.004","20.806","0.009","90","","119.27","0.04","90","","4200","3","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","{[Co2(4-apy)3(NO3)4]CH2Cl2}","Cobalt 4,4'-azopyridine Nitrate Complex, Dichloromethane solvate","","- C15.5 H13 Cl Co N8 O6 -","- C15.5 H13 Cl Co N8 O6 -","- C124 H104 Cl8 Co8 N64 O48 -","8","1","","Withersby, Matthew A.; Blake, Alexander J.; Champness, Neil R.; Cooke, Paul A.; Hubberstey, Peter; Realf, Annabel L.; Teat, Simon J.; Schröder, Martin","Engineering of co-ordination polymers of trans-4,4'-azobis(pyridine) and trans-1,2-bis(pyridin-4-yl)ethene: a range of interpenetrated network motifs","Journal of the Chemical Society, Dalton Transactions","2000","","19","3261","","10.1039/b006543i","","","0.71073","MoKα","","0.1076","0.074","","","0.1639","0.1942","","","","","","1.121","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7010152","21.197","0.005","11.166","0.012","21.389","0.004","90","","122.24","0.02","90","","4282","5","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","[Cd2(4-apy)3(NO3)4](CH2Cl2)(H2O)2","Cadmium 4,4'-azopyridine Nitrate Complex, water/dichloromethane solvate","","- C15.5 H15 Cd Cl N8 O7 -","- C15.5 H13 Cd Cl N8 O7 -","- C124 H104 Cd8 Cl8 N64 O56 -","8","1","","Withersby, Matthew A.; Blake, Alexander J.; Champness, Neil R.; Cooke, Paul A.; Hubberstey, Peter; Realf, Annabel L.; Teat, Simon J.; Schröder, Martin","Engineering of co-ordination polymers of trans-4,4'-azobis(pyridine) and trans-1,2-bis(pyridin-4-yl)ethene: a range of interpenetrated network motifs","Journal of the Chemical Society, Dalton Transactions","2000","","19","3261","","10.1039/b006543i","","","0.71073","MoKα","","0.0577","0.045","","","0.1024","0.1184","","","","","","1.164","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"7010153","17.327","0.003","17.327","0.003","7.7288","0.0016","90","","90","","90","","2320.4","0.7","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","{[Cu(4-apy)2]BF4}n","Copper(I) trans-4,4-azobis(pyridine) tetrafluoroborate complex","","- C20 H16 B Cu F4 N8 -","- C20 H16 B Cu F4 N8 -","- C80 H64 B4 Cu4 F16 N32 -","4","0.25","","Withersby, Matthew A.; Blake, Alexander J.; Champness, Neil R.; Cooke, Paul A.; Hubberstey, Peter; Realf, Annabel L.; Teat, Simon J.; Schröder, Martin","Engineering of co-ordination polymers of trans-4,4'-azobis(pyridine) and trans-1,2-bis(pyridin-4-yl)ethene: a range of interpenetrated network motifs","Journal of the Chemical Society, Dalton Transactions","2000","","19","3261","","10.1039/b006543i","","","0.71073","MoKα","","0.0576","0.0453","","","0.1162","0.126","","","","","","1.105","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"7010154","10.767","0.002","10.767","0.002","21.03","0.003","90","","90","","90","","2438","0.7","150","2","150","2","","","","","","","","7","P 4/n c c :2","-P 4a 2ac","130","{[Cu(4-apy)2(OH2)2](SiF6)(H2O)","Copper(II) trans-azobis(4-pyridine) Hexafluorosilicate Water Adduct","","- C20 H22 Cu F6 N8 O3 Si -","- C20 H21 Cu F6 N8 O3 Si -","- C80 H84 Cu4 F24 N32 O12 Si4 -","4","0.25","","Withersby, Matthew A.; Blake, Alexander J.; Champness, Neil R.; Cooke, Paul A.; Hubberstey, Peter; Realf, Annabel L.; Teat, Simon J.; Schröder, Martin","Engineering of co-ordination polymers of trans-4,4'-azobis(pyridine) and trans-1,2-bis(pyridin-4-yl)ethene: a range of interpenetrated network motifs","Journal of the Chemical Society, Dalton Transactions","2000","","19","3261","","10.1039/b006543i","","","0.6917","Synchrotron","","0.0487","0.035","","","0.0879","0.0937","","","","","","1.071","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7010155","5.196","0.001","12.74","0.003","9.716","0.002","90","","94.82","0.003","90","","640.9","0.2","296.2","","296.2","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C10 H12 Ag2 N2 O6 -","- C10 H12 Ag2 N2 O6 -","- C20 H24 Ag4 N4 O12 -","2","1","","Nomiya, Kenji; Takahashi, Satoshi; Noguchi, Ryusuke","Water-soluble silver(I) complexes of (R)-(+)- and (S )-(−)-2-pyrrolidone-5-carboxylic acid and their antimicrobial activities. Chiral helical polymer and polymer sheet structures in the solid-state formed by self-assembly of dimeric [Ag(Hpyrrld)]2 cores","Journal of the Chemical Society, Dalton Transactions","2000","","23","4369","","10.1039/b006552h","","","0.7107","MoKα","","0.0497","0.05","","0.069","","0.069","","","1.216","","","1.22","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7010156","7.459","0.001","5.312","0.005","15.961","0.001","90","","92.11","0.01","90","","632","0.6","296.2","","296.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H12 Ag2 N2 O6 -","- C10 H12 Ag2 N2 O6 -","- C20 H24 Ag4 N4 O12 -","2","0.5","","Nomiya, Kenji; Takahashi, Satoshi; Noguchi, Ryusuke","Water-soluble silver(I) complexes of (R)-(+)- and (S )-(−)-2-pyrrolidone-5-carboxylic acid and their antimicrobial activities. Chiral helical polymer and polymer sheet structures in the solid-state formed by self-assembly of dimeric [Ag(Hpyrrld)]2 cores","Journal of the Chemical Society, Dalton Transactions","2000","","23","4369","","10.1039/b006552h","","","0.7107","MoKα","","0.0339","0.034","","0.025","","0.025","","","1.233","","","1.23","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7010157","23.427","0.004","8.938","0.004","16.696","0.004","90","","118.01","0.01","90","","3086.5","1.7","296.2","","296.2","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H44 Au Cl2 N S2 -","- C56 H88 Au Cl4 N S4 -","- C224 H352 Au4 Cl16 N4 S16 -","4","0.5","","Watase, Seiji; Nakamoto, Masami; Kitamura, Takayuki; Kanehisa, Nobuko; Kai, Yasushi; Yanagida, Shozo","Solid-state luminescence and crystal structures of novel gold(I) benzenethiolate complexes","Journal of the Chemical Society, Dalton Transactions","2000","","20","3585","","10.1039/b006572m","","","0.7107","MoKα","","0.0346","0.0346","","","0.0285","0.0285","","","","","","1.559","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7010158","14.191","0.003","13.549","0.005","17.109","0.003","90","","108.68","0.01","90","","3116.3","1.4","296.2","","296.2","","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C28 H44 Au Cl2 N S2 -","- C27.89 H44 Au Cl2 N S2 -","- C111.56 H176 Au4 Cl8 N4 S8 -","4","1","","Watase, Seiji; Nakamoto, Masami; Kitamura, Takayuki; Kanehisa, Nobuko; Kai, Yasushi; Yanagida, Shozo","Solid-state luminescence and crystal structures of novel gold(I) benzenethiolate complexes","Journal of the Chemical Society, Dalton Transactions","2000","","20","3585","","10.1039/b006572m","","","0.7107","MoKα","","0.0437","0.0437","","","0.0318","0.035","","","","","","1.645","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7010159","14.222","0.002","13.923","0.002","16.953","0.002","90","","109.173","0.01","90","","3170.7","0.8","296.2","","296.2","","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C30 H50 Au N S2 -","- C30 H50 Au N S2 -","- C120 H200 Au4 N4 S8 -","4","1","","Watase, Seiji; Nakamoto, Masami; Kitamura, Takayuki; Kanehisa, Nobuko; Kai, Yasushi; Yanagida, Shozo","Solid-state luminescence and crystal structures of novel gold(I) benzenethiolate complexes","Journal of the Chemical Society, Dalton Transactions","2000","","20","3585","","10.1039/b006572m","","","0.7107","MoKα","","0.0318","0.0318","","","0.0243","0.0243","","","","","","1.476","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7010160","8.7922","0.0009","14.3189","0.0011","15.9028","0.0014","90.002","0.007","89.993","0.008","89.992","0.008","2002.1","0.3","293","2","293","2","","","","","","","","6","P b c m","-P 2c 2b","57","","","","- C14 H32 Cl Fe N S3 -","- C14 H32 Cl Fe N2 S3 -","- C56 H128 Cl4 Fe4 N8 S12 -","4","0.5","","Davies, Sian C.; Durrant, Marcus C.; Hughes, David L.; Richards, Raymond L.; Sanders, J. Roger","Iron, cobalt and vanadium complexes of the N(CH2CH2S)33− ligand with chloride, azide, cyanide and carbonyl co-ligands","Journal of the Chemical Society, Dalton Transactions","2000","","24","4694","","10.1039/b006591i","","","0.71069","MoKα","","0.054","0.0396","","0.1125","0.1008","","","","1.066","1.115","1.115","","","","","has coordinates,has disorder","179805","2020-10-21","18:00:00",""
"7010161","15.905","0.002","14.2539","0.0015","18.458","0.003","90","","90","","90","","4184.6","1","293","2","293","2","","","","","","","","5","C 2 2 21","C 2c 2","20","","","","- C14 H32 Fe N5 S3 -","- C14 H32 Fe N5 S3 -","- C112 H256 Fe8 N40 S24 -","8","1","","Davies, Sian C.; Durrant, Marcus C.; Hughes, David L.; Richards, Raymond L.; Sanders, J. Roger","Iron, cobalt and vanadium complexes of the N(CH2CH2S)33− ligand with chloride, azide, cyanide and carbonyl co-ligands","Journal of the Chemical Society, Dalton Transactions","2000","","24","4694","","10.1039/b006591i","","","0.71069","Mo-Kα","","0.0713","0.0473","","0.1275","0.107","","","","1.057","1.143","1.143","","","","","has coordinates,has disorder","179805","2020-10-21","18:00:00",""
"7010162","8.853","0.0007","14.18","0.0011","15.869","0.0015","90","","90","","90","","1992.1","0.3","293","2","293","2","","","","","","","","6","P b c m","-P 2c 2b","57","","","","- C15 H32 Fe N2 O S3 -","- C15 H32 Fe N2 O S3 -","- C60 H128 Fe4 N8 O4 S12 -","4","0.5","","Davies, Sian C.; Durrant, Marcus C.; Hughes, David L.; Richards, Raymond L.; Sanders, J. Roger","Iron, cobalt and vanadium complexes of the N(CH2CH2S)33− ligand with chloride, azide, cyanide and carbonyl co-ligands","Journal of the Chemical Society, Dalton Transactions","2000","","24","4694","","10.1039/b006591i","","","0.71069","Mo-Kα","","0.082","0.0462","","0.1234","0.1029","","","","1.033","1.142","1.142","","","","","has coordinates,has disorder","179805","2020-10-21","18:00:00",""
"7010163","13.5324","0.0004","13.5324","0.0004","24.499","0.002","90","","90","","90","","4486.4","0.4","293","2","293","2","","","","","","","","6","I 41 c d","I 4bw -2c","110","","","","- C14 H24 Fe3 N2 O2 S6 -","- C14 H24 Fe3 N2 O2 S6 -","- C112 H192 Fe24 N16 O16 S48 -","8","0.5","","Davies, Sian C.; Durrant, Marcus C.; Hughes, David L.; Richards, Raymond L.; Sanders, J. Roger","Iron, cobalt and vanadium complexes of the N(CH2CH2S)33− ligand with chloride, azide, cyanide and carbonyl co-ligands","Journal of the Chemical Society, Dalton Transactions","2000","","24","4694","","10.1039/b006591i","","","0.71069","Mo-Kα","","0.0293","0.0228","","0.0463","0.044","","","","0.99","1.016","1.016","","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010164","13.5277","0.0005","13.5277","0.0005","24.414","0.005","90","","90","","90","","4467.7","0.9","293","2","293","2","","","","","","","","7","I 41 c d","I 4bw -2c","110","","","","- C14 H24 Co Fe2 N2 O2 S6 -","- C14 H24 Co Fe2 N2 O2 S6 -","- C112 H192 Co8 Fe16 N16 O16 S48 -","8","0.5","","Davies, Sian C.; Durrant, Marcus C.; Hughes, David L.; Richards, Raymond L.; Sanders, J. Roger","Iron, cobalt and vanadium complexes of the N(CH2CH2S)33− ligand with chloride, azide, cyanide and carbonyl co-ligands","Journal of the Chemical Society, Dalton Transactions","2000","","24","4694","","10.1039/b006591i","","","0.71069","Mo-Kα","","0.0417","0.0298","","0.0518","0.0478","","","","0.951","0.995","0.995","","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010165","8.865","0.0011","14.1311","0.0014","15.757","0.002","90","0.008","90","0.009","90","0.009","1973.9","0.4","293","2","293","2","","","","","","","","5","P b c m","-P 2c 2b","57","","","","- C15 H32 Co N3 S3 -","- C15 H32 Co N3 S3 -","- C60 H128 Co4 N12 S12 -","4","0.5","","Davies, Sian C.; Durrant, Marcus C.; Hughes, David L.; Richards, Raymond L.; Sanders, J. Roger","Iron, cobalt and vanadium complexes of the N(CH2CH2S)33− ligand with chloride, azide, cyanide and carbonyl co-ligands","Journal of the Chemical Society, Dalton Transactions","2000","","24","4694","","10.1039/b006591i","","","0.71069","Mo-Kα","","0.1006","0.0459","","0.1232","0.0945","","","","0.972","1.066","1.066","","","","","has coordinates,has disorder","179805","2020-10-21","18:00:00",""
"7010170","10.839","0.002","10.805","0.002","21.387","0.006","90","","91.09","0.02","90","","2504.3","1","296.2","","","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C22 H24 Br2 Cl2 Cu N4 Ni O2 -","- C22 H24 Br2 Cl2 Cu N4 Ni O2 -","- C88 H96 Br8 Cl8 Cu4 N16 Ni4 O8 -","4","1","","Yonemura, Masami; Usuki, Naoki; Nakamura, Yuuki; Ohba, Masaaki; Ōkawa, Hisashi","Macrocyclic effect upon site-selective CuIIMII or MIICuII core formation with unsymmetric phenol-based macrocyclic ligands †","Journal of the Chemical Society, Dalton Transactions","2000","","20","3624","","10.1039/b006605m","","","0.7107","MoKa","","","0.0457","","","","0.0495","","","","","","1.217","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7010171","23.676","0.006","27.32","0.01","8.951","0.008","90","","90","","90","","5790","6","23","","23","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","?","- C208 H224 Br16 Cu8 N32 O40 -","- C208 H224 Br16 Cu8 N32 O40 -","","","","Yonemura, Masami; Usuki, Naoki; Nakamura, Yuuki; Ohba, Masaaki; Ōkawa, Hisashi","Macrocyclic effect upon site-selective CuIIMII or MIICuII core formation with unsymmetric phenol-based macrocyclic ligands","Journal of the Chemical Society, Dalton Transactions","2000","","20","3624","","10.1039/b006605m","","","0.7107","MoKalpha","","","0.053","","","0.043","","","","","3.24","3.24","","","","","has coordinates","288156","2023-12-07","18:40:59",""
"7010172","11.124","0.003","16.144","0.004","11.082","0.004","109.15","0.02","105.59","0.03","93.44","0.03","1786.7","1","23","","23","","","","","","","","","8","P -1","-P 1","2","","","","?","- C52 H70 Br4 Cl4 Cu2 N10 Ni2 O24 -","- C52 H70 Br4 Cl4 Cu2 N10 Ni2 O24 -","","","","Yonemura, Masami; Usuki, Naoki; Nakamura, Yuuki; Ohba, Masaaki; Ōkawa, Hisashi","Macrocyclic effect upon site-selective CuIIMII or MIICuII core formation with unsymmetric phenol-based macrocyclic ligands","Journal of the Chemical Society, Dalton Transactions","2000","","20","3624","","10.1039/b006605m","","","0.7107","MoKalpha","","","0.064","","","0.067","","","","","4.02","4.02","","","","","has coordinates","288156","2023-12-07","18:40:59",""
"7010179","14.8356","0.0004","11.8116","0.0003","19.4734","0.0004","90","","101.587","0.001","90","","3342.83","0.14","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C53 H43 O20 Os6 Sb2 -","- C53 H43 O20 Os6 Sb2 -","- C106 H86 O40 Os12 Sb4 -","2","0.5","","Leong, Weng Kee; Chen, Guizhu","The reaction of [Os3(μ-H)(CO)10(μ-CO)]− with Ph2SbCl: a cluster with a six-membered Os4Sb2 ring and another with fluxional metal‒metal bonds †","Journal of the Chemical Society, Dalton Transactions","2000","","23","4442","","10.1039/b006669i","","","0.71073","MoKα","","0.0506","0.0323","","0.0808","0.0704","","","","1.189","1.164","1.164","","","","","has coordinates,has disorder","179805","2020-10-21","18:00:00",""
"7010180","12.631","","18.0529","0.0002","17.1885","0.0001","90","","94.469","0.001","90","","3907.51","0.05","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C34.5 H21 Cl O10 Os3 P Sb -","- C34.5 H21 Cl O10 Os3 P Sb -","- C138 H84 Cl4 O40 Os12 P4 Sb4 -","4","1","","Leong, Weng Kee; Chen, Guizhu","The reaction of [Os3(μ-H)(CO)10(μ-CO)]− with Ph2SbCl: a cluster with a six-membered Os4Sb2 ring and another with fluxional metal‒metal bonds †","Journal of the Chemical Society, Dalton Transactions","2000","","23","4442","","10.1039/b006669i","","","0.71073","MoKα","","0.0809","0.0462","","","0.0857","0.0983","","","","","","1.068","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7010181","13.3803","0.0002","17.9495","0.0002","17.6996","0.0001","90","","98.097","0.001","90","","4208.53","0.08","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C37 H27 O10 Os3 Sb2 -","- C37 H27 O10 Os3 Sb2 -","- C148 H108 O40 Os12 Sb8 -","4","1","","Leong, Weng Kee; Chen, Guizhu","The reaction of [Os3(μ-H)(CO)10(μ-CO)]− with Ph2SbCl: a cluster with a six-membered Os4Sb2 ring and another with fluxional metal‒metal bonds †","Journal of the Chemical Society, Dalton Transactions","2000","","23","4442","","10.1039/b006669i","","","0.71073","MoKα","","0.1125","0.0576","","","0.1212","0.149","","","","","","1.032","","","","has coordinates,has disorder","179805","2020-10-21","18:00:00",""
"7010182","9.1216","0.0014","41.242","0.008","9.3324","0.0012","90","","117.221","0.011","90","","3122","0.9","122","1","122","1","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C74 H62 O3 P4 S4 -","- C74 H62 O3 P4 S4 -","- C148 H124 O6 P8 S8 -","2","1","","Ólafsson, Sigurjón Norberg; Flensburg, Claus; Andersen, Peter","Lead(IV) complexes with phosphinoyldithioformates, R2P(O)CS2− (R = Ph or PhCH2). Syntheses and characterization. Crystal structures of [PPh4][S2CP(O)Ph2]·0.5H2O, [PbPh2{S2CP(O)Ph2}2] and [PbPh2Cl{S2CP(O)Ph2}]","Journal of the Chemical Society, Dalton Transactions","2000","","23","4360","","10.1039/b006672i","","","1.5418","CuKα","","0.0303","0.0294","","","0.0731","0.0735","","","","","","1.887","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7010183","14.403","0.003","17.634","0.005","14.42","0.004","90","","90.03","0.02","90","","3662.4","1.6","122","1","122","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C38 H30 O2 P2 Pb S4 -","- C38 H30 O2 P2 Pb S4 -","- C152 H120 O8 P8 Pb4 S16 -","4","1","","Ólafsson, Sigurjón Norberg; Flensburg, Claus; Andersen, Peter","Lead(IV) complexes with phosphinoyldithioformates, R2P(O)CS2− (R = Ph or PhCH2). Syntheses and characterization. Crystal structures of [PPh4][S2CP(O)Ph2]·0.5H2O, [PbPh2{S2CP(O)Ph2}2] and [PbPh2Cl{S2CP(O)Ph2}]","Journal of the Chemical Society, Dalton Transactions","2000","","23","4360","","10.1039/b006672i","","","0.71073","MoKα","","0.0582","0.0394","","","0.0886","0.0964","","","","","","1.22","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010184","14.911","0.003","8.2427","0.0017","20.384","0.004","90","","103.468","0.016","90","","2436.4","0.9","122","1","122","1","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C25 H20 Cl O P Pb S2 -","- C25 H20 Cl O P Pb S2 -","- C100 H80 Cl4 O4 P4 Pb4 S8 -","4","1","","Ólafsson, Sigurjón Norberg; Flensburg, Claus; Andersen, Peter","Lead(IV) complexes with phosphinoyldithioformates, R2P(O)CS2− (R = Ph or PhCH2). Syntheses and characterization. Crystal structures of [PPh4][S2CP(O)Ph2]·0.5H2O, [PbPh2{S2CP(O)Ph2}2] and [PbPh2Cl{S2CP(O)Ph2}]","Journal of the Chemical Society, Dalton Transactions","2000","","23","4360","","10.1039/b006672i","","","0.71073","MoKα","","0.039","0.0227","","","0.0374","0.0391","","","","","","1.214","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010185","7.071","0.004","21.964","0.012","16.564","0.01","90","","96.15","0.04","90","","2558","3","195","2","195","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C23 H6 O11 Os3 S2 -","- C23 H6 O11 Os3 S2 -","- C92 H24 O44 Os12 S8 -","4","1","","Adams, Christopher J.; Clarke, Lionel P.; Martín-Castro, Ana M.; Raithby, Paul R.; Shields, Gregory P.","A new two-strand chain cluster: the synthesis and characterisation of [Os3(CO)11{μ3-η4-(C4H3S)C2C2(C4H3S)}] †","Journal of the Chemical Society, Dalton Transactions","2000","","22","4015","","10.1039/b006696f","","","0.71073","MoKα","","0.0693","0.0626","","0.1766","0.1665","","","","1.059","1.069","1.069","","","","","has coordinates,has disorder","179805","2020-10-21","18:00:00",""
"7010186","16.4602","0.0004","15.9627","0.0004","19.6781","0.0004","90","","114.202","0.0014","90","","4716","0.2","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","[Hydrido-tris-(3,5-diphenylpyrazolyl)borato][2-hydroxy-5-methyl- benzoquinonato]copper(II) dichloromethane solvate","","- C52.8 H40.6 B Cl1.6 Cu N6 O3 -","- C52.7 H39 B Cl1.6 Cu N6 O3 -","- C210.8 H156 B4 Cl6.4 Cu4 N24 O12 -","4","1","","Foster, Caroline L.; Liu, Xiaoming; Kilner, Colin A.; Thornton-Pett, Mark; Halcrow, Malcolm A.","Complexes of 2-hydroxy-5-methyl-1,4-benzoquinone as models for the 'TPQ-on' form of copper amine oxidases","Journal of the Chemical Society, Dalton Transactions","2000","","24","4563","","10.1039/b006700h","","","0.71073","MoKα","","0.0854","0.0651","","","0.1821","0.1954","","","","","","1.053","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7010187","17.1926","0.0009","10.0741","0.0005","26.6057","0.0011","90","","105.775","0.003","90","","4434.6","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[Hydrido-tris-(3,5-diphenylpyrazolyl)borato][2-hydroxy-5-methyl- benzoquinonato]zinc(II)","","- C52 H39 B N6 O3 Zn -","- C52 H39 B N6 O3 Zn -","- C208 H156 B4 N24 O12 Zn4 -","4","1","","Foster, Caroline L.; Liu, Xiaoming; Kilner, Colin A.; Thornton-Pett, Mark; Halcrow, Malcolm A.","Complexes of 2-hydroxy-5-methyl-1,4-benzoquinone as models for the 'TPQ-on' form of copper amine oxidases","Journal of the Chemical Society, Dalton Transactions","2000","","24","4563","","10.1039/b006700h","","","0.71073","MoKα","","0.0932","0.0521","","","0.1327","0.1641","","","","","","1.07","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010188","14.73","0.003","17.167","0.003","24.701","0.005","90","","106.55","0.02","90","","5987","2","294","2","294","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C48 H64 B2 Cl4 Mo2 N14 O6 -","- C48 H64 B2 Cl4 Mo2 N14 O6 -","- C192 H256 B8 Cl16 Mo8 N56 O24 -","4","1","","Berridge, Timothy E.; Barton, Matthew T.; Hamor, Thomas A.; Jones, Christopher J.; McQuillan, Ferida S.; Paxton, Keith; Rowley, Natalie M.","The syntheses of metallomacrocycles containing unsymmetrical bridging ligands and the crystal structures of DL-[Mo{HB(3,5-Me2C3HN2)3}(NO)(OC6H4CH2CH2O-4)]2·2CH2Cl2 and DL-[W{HB(3,5-Me2C3HN2)3}(NO)(OC6H3NO2-4-CH2CH2O-3)]2· CH2Cl2 †","Journal of the Chemical Society, Dalton Transactions","2000","","24","4645","","10.1039/b006716o","","","0.7107","MoKa","","0.0769","0.0562","","","0.1386","0.1507","","","","1.123","1.123","1.09","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010189","12.489","0.004","24.166","0.009","20.568","0.011","90","","92.82","0.02","90","","6200","5","294","2","294","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C47 H60 B2 Cl2 N16 O10 W2 -","- C47 H60 B2 Cl2 N16 O10 W2 -","- C188 H240 B8 Cl8 N64 O40 W8 -","4","1","","Berridge, Timothy E.; Barton, Matthew T.; Hamor, Thomas A.; Jones, Christopher J.; McQuillan, Ferida S.; Paxton, Keith; Rowley, Natalie M.","The syntheses of metallomacrocycles containing unsymmetrical bridging ligands and the crystal structures of DL-[Mo{HB(3,5-Me2C3HN2)3}(NO)(OC6H4CH2CH2O-4)]2·2CH2Cl2 and DL-[W{HB(3,5-Me2C3HN2)3}(NO)(OC6H3NO2-4-CH2CH2O-3)]2· CH2Cl2 †","Journal of the Chemical Society, Dalton Transactions","2000","","24","4645","","10.1039/b006716o","","","0.7107","MoKa","","0.0861","0.0583","","","0.1518","0.1669","","","","1.137","1.137","1.084","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010190","9.213","0.005","15.832","0.008","11.821","0.006","90","","106.31","0.02","90","","1654.8","1.5","153","2","153","2","","","","","","","","6","P 1 21 1","P 2yb","4","","(mu2-hydrido)(tri(phenyl)phosphine)bis(mu2-carbonyl)(octacarbonyl) tri-osmium(cyclopentadienyl)ruthenium","","- C33 H21 O10 Os3 P Ru -","- C33 H21 O10 Os3 P Ru -","- C66 H42 O20 Os6 P2 Ru2 -","2","1","","Buntem, Radchada; Gallagher, John F.; Lewis, Jack; Raithby, Paul R.; Rennie, Moira-Ann; Shields, Gregory P.","Use of the monocationic fragment [Ru(η5-C5H5)(MeCN)3]+ as an ionic coupling reagent in the synthesis of mixed-metal phosphine clusters †","Journal of the Chemical Society, Dalton Transactions","2000","","23","4297","","10.1039/b006746f","","","0.71073","MoKα","","0.0333","0.0332","","0.089","0.0889","","","","1.043","1.044","1.044","","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010191","8.878","0.004","22.669","0.017","9.415","0.004","90","","114.06","0.04","90","","1730.2","1.8","290","2","290","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C34 H21 O11 Os3 P Ru -","- C34 H21 O11 Os3 P Ru -","- C68 H42 O22 Os6 P2 Ru2 -","2","1","","Buntem, Radchada; Gallagher, John F.; Lewis, Jack; Raithby, Paul R.; Rennie, Moira-Ann; Shields, Gregory P.","Use of the monocationic fragment [Ru(η5-C5H5)(MeCN)3]+ as an ionic coupling reagent in the synthesis of mixed-metal phosphine clusters †","Journal of the Chemical Society, Dalton Transactions","2000","","23","4297","","10.1039/b006746f","","","0.71073","MoKα","","0.0494","0.0462","","0.108","0.1055","","","","1.175","1.178","1.178","","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010192","17.049","0.006","9.548","0.002","19.163","0.006","90","","94.62","0.03","90","","3109.3","1.6","290","2","290","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H19 O14 Os3 P Ru2 -","- C24 H19 O14 Os3 P Ru2 -","- C96 H76 O56 Os12 P4 Ru8 -","4","1","","Buntem, Radchada; Gallagher, John F.; Lewis, Jack; Raithby, Paul R.; Rennie, Moira-Ann; Shields, Gregory P.","Use of the monocationic fragment [Ru(η5-C5H5)(MeCN)3]+ as an ionic coupling reagent in the synthesis of mixed-metal phosphine clusters †","Journal of the Chemical Society, Dalton Transactions","2000","","23","4297","","10.1039/b006746f","","","0.71073","MoKα","","0.0567","0.043","","0.1163","0.1017","","","","1.095","1.082","1.082","","","","","has coordinates,has disorder","179805","2020-10-21","18:00:00",""
"7010196","8.8109","0.0005","10.8325","0.0007","11.6965","0.0007","85.825","0.001","87.127","0.001","85.462","0.001","1108.8","0.12","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C16 H28 Cl2 F Mg N3 O8 -","- C16 H24 Cl2 F Mg N3 O8 -","- C32 H48 Cl4 F2 Mg2 N6 O16 -","2","1","","Chen, Zhen-Feng; Xiong, Ren-Gen; Zuo, Jing-Lin; Guo, Zijian; You, Xiao-Zeng; Fun, Hoong-Kun","X-Ray crystal structures of Mg2+ and Ca2+ dimers of the antibacterial drug norfloxacin","Journal of the Chemical Society, Dalton Transactions","2000","","22","4013","","10.1039/b006806n","","","0.71073","MoKα","","0.1165","0.0632","","","0.1653","0.1928","","","","","","0.908","","","","has coordinates,has disorder","179805","2020-10-21","18:00:00",""
"7010197","26.4943","0.0001","15.3545","0.0001","27.8604","0.0002","90","","109.244","0.001","90","","10700.5","0.13","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C96 H128 Ca2 Cl4 F6 N18 O28 -","- C96 H128 Ca2 Cl4 F6 N18 O28 -","- C384 H512 Ca8 Cl16 F24 N72 O112 -","4","0.5","","Chen, Zhen-Feng; Xiong, Ren-Gen; Zuo, Jing-Lin; Guo, Zijian; You, Xiao-Zeng; Fun, Hoong-Kun","X-Ray crystal structures of Mg2+ and Ca2+ dimers of the antibacterial drug norfloxacin","Journal of the Chemical Society, Dalton Transactions","2000","","22","4013","","10.1039/b006806n","","","0.71073","MoKα","","0.1447","0.0771","","","0.1736","0.2005","","","","","","0.945","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010199","11.02","0.004","21.034","0.007","10.018","0.012","90","","90","","90","","2322","3","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H8 O12 Ru4 -","- C18 H8 O12 Ru4 -","- C72 H32 O48 Ru16 -","4","1","","Clarke, Lionel P.; Davies, John E.; Raithby, Paul R.; Shields, Gregory P.","Novel coordination modes of partially hydrogenated diyne ligands on metal carbonyl clusters †","Journal of the Chemical Society, Dalton Transactions","2000","","24","4527","","10.1039/b006810l","","","0.71073","MoKα","","0.1043","0.0631","","0.1285","0.1122","","","","1.01","1.054","1.054","","","","","has coordinates","179805","2020-10-21","18:00:00",""
"7010200","13.257","0.003","9.861","0.002","19.176","0.003","90","","111.64","0.01","90","","2330.1","0.8","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C18 H8 O12 Ru4 -","- C18 H8 O12 Ru4 -","- C72 H32 O48 Ru16 -","4","0.5","","Clarke, Lionel P.; Davies, John E.; Raithby, Paul R.; Shields, Gregory P.","Novel coordination modes of partially hydrogenated diyne ligands on metal carbonyl clusters †","Journal of the Chemical Society, Dalton Transactions","2000","","24","4527","","10.1039/b006810l","","","0.71073","MoKα","","0.0509","0.0356","","0.1709","0.0946","","","","1.035","1.046","1.046","","","","","has coordinates","179806","2020-10-21","18:00:00",""
"7010201","19.012","0.004","9.359","0.002","34.315","0.007","90","","90","","90","","6106","2","293","2","293","2","","","","","","","dichloromethane/hexane at -30 deg. C.","4","P n a 21","P 2c -2n","33","","","","- C28 H12 O12 Ru4 -","- C28 H12 O12 Ru4 -","- C224 H96 O96 Ru32 -","8","2","","Clarke, Lionel P.; Davies, John E.; Raithby, Paul R.; Shields, Gregory P.","Novel coordination modes of partially hydrogenated diyne ligands on metal carbonyl clusters †","Journal of the Chemical Society, Dalton Transactions","2000","","24","4527","","10.1039/b006810l","","","0.71073","MoKα","","0.1241","0.0602","","0.2325","0.1438","","","","1.04","1.02","1.02","","","","","has coordinates","179806","2020-10-21","18:00:00",""
"7010202","10.748","0.003","18.891","0.004","15.778","0.003","90","","107.87","0.01","90","","3049","1.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C28 H12 O12 Ru4 -","- C28 H12 O12 Ru4 -","- C112 H48 O48 Ru16 -","4","1","","Clarke, Lionel P.; Davies, John E.; Raithby, Paul R.; Shields, Gregory P.","Novel coordination modes of partially hydrogenated diyne ligands on metal carbonyl clusters †","Journal of the Chemical Society, Dalton Transactions","2000","","24","4527","","10.1039/b006810l","","","0.71073","MoKα","","0.1233","0.0443","","0.2145","0.0927","","","","1.001","1.052","1.052","","","","","has coordinates","179806","2020-10-21","18:00:00",""
"7010203","10.457","0.003","13.594","0.005","9.919","0.002","100.9","0.02","105.55","0.02","78.18","0.03","1316.1","0.7","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C25 H14 O9 Ru3 -","- C25 H14 O9 Ru3 -","- C50 H28 O18 Ru6 -","2","1","","Clarke, Lionel P.; Davies, John E.; Raithby, Paul R.; Shields, Gregory P.","Novel coordination modes of partially hydrogenated diyne ligands on metal carbonyl clusters †","Journal of the Chemical Society, Dalton Transactions","2000","","24","4527","","10.1039/b006810l","","","0.71069","MoKα","","0.0552","0.0441","","0.1442","0.1291","","","","1.226","1.188","1.188","","","","","has coordinates","179806","2020-10-21","18:00:00",""
"7010204","7.514","0.006","11.991","0.004","13.584","0.002","90","","90","","90","","1223.9","1.1","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C11 H13 Cl2 N Ti -","- C11 H13 Cl2 N Ti -","- C44 H52 Cl8 N4 Ti4 -","4","1","","Martins, Ana M.; Ascenso, José R.; de Azevedo, Cristina G.; Calhorda, Maria J.; Dias, Alberto R.; Rodrigues, Sandra S.; Toupet, Loîc; de Leonardis, Piero; Veiros, Luis F.","Titanium indenyldimethylamido complexes: synthesis, characterisation and theoretical calculations. Crystal structure of [Ti(η5-Ind)(NMe2)Cl2]","Journal of the Chemical Society, Dalton Transactions","2000","","23","4332","","10.1039/b006889f","","","0.71069","MoKα","","0.1032","0.0497","","","0.1075","0.1233","","","","","","1.006","","","","has coordinates","179806","2020-10-21","18:00:00",""
"7010205","31.137","0.002","11.866","0.002","8.4282","0.0009","90","","96.9","0.01","90","","3091.4","0.7","273","2","273","2","","","","","","","synthesized","4","C 1 2/m 1","-C 2y","12","","Catena-(bis(μ-trifluoroacetato-O,O')-tetracalbonyl-di-rhodium(I))","","- C8 F6 O8 Rh2 -","- C8 F6 O8 Rh2 -","- C64 F48 O64 Rh16 -","8","1","","Cotton, F. Albert; Dikarev, Evgeny V.; Petrukhina, Marina A.","cis-Di(μ-trifluoroacetate)dirhodium tetracarbonyl: structure and chemistry †","Journal of the Chemical Society, Dalton Transactions","2000","","23","4241","","10.1039/b006894m","","","0.71073","MoKα","","0.0514","0.0436","","0.1227","0.1139","","","","1.102","1.133","1.133","","","","","has coordinates,has disorder","179806","2020-10-21","18:00:00",""
"7010206","10.14","0.001","22.979","0.003","8.786","0.001","90","","102.636","0.002","90","","1997.6","0.4","213","2","213","2","","","","","","","synthesized","5","C 1 2/m 1","-C 2y","12","","Tetrakis((μ-trifluoroacetato-O,O')-(μ-carbonyl)-tetrahydrofuran)- tetra-rhodium(I)","","- C28 H32 F12 O16 Rh4 -","- C28 F12 O16 Rh4 -","- C56 F24 O32 Rh8 -","2","0.25","","Cotton, F. Albert; Dikarev, Evgeny V.; Petrukhina, Marina A.","cis-Di(μ-trifluoroacetate)dirhodium tetracarbonyl: structure and chemistry †","Journal of the Chemical Society, Dalton Transactions","2000","","23","4241","","10.1039/b006894m","","","0.71073","MoKα","","0.0784","0.0514","","0.1462","0.1259","","","","1.084","1.116","1.116","","","","","has coordinates,has disorder","179806","2020-10-21","18:00:00",""
"7010207","18.3351","0.0009","16.5713","0.0005","29.009","0.002","90","","90","","90","","8814","0.8","213","2","213","2","","","","","","","synthesized","5","P b c a","-P 2ac 2ab","61","","Bis(μ-trifluoroacetato-O,O')-bis(ν4-cyclo-octa-1,5-diene)- di-rhodium(I)","","- C20 H24 F6 O4 Rh2 -","- C20 H24 F6 O4 Rh2 -","- C320 H384 F96 O64 Rh32 -","16","2","","Cotton, F. Albert; Dikarev, Evgeny V.; Petrukhina, Marina A.","cis-Di(μ-trifluoroacetate)dirhodium tetracarbonyl: structure and chemistry †","Journal of the Chemical Society, Dalton Transactions","2000","","23","4241","","10.1039/b006894m","","","0.71073","MoKα","","0.0407","0.0361","","0.0906","0.0847","","","","1.088","1.083","1.083","","","","","has coordinates,has disorder","179806","2020-10-21","18:00:00",""
"7010211","28.808","0.009","9.246","0.004","29.477","0.009","90","","115.87","0.02","90","","7065","5","123","2","123","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C64 H89 Li4 N8 Na5 O5 -","- C64 H89 Li4 N8 Na5 O5 -","- C256 H356 Li16 N32 Na20 O20 -","4","0.5","","Kennedy, Alan R.; MacLellan, Jonathan G.; Mulvey, Robert E.; Robertson, Alan","A new approach to lithium‒heavier alkali metal interchange reactions: synthesis of a tetralithium pentasodium mixed alkoxide‒amide dome-shaped cage compound with an encapsulated hydroxide molecule †","Journal of the Chemical Society, Dalton Transactions","2000","","22","4112","","10.1039/b006990f","","","0.71069","MoKα","","0.1286","0.081","","","0.2061","0.2335","","","","","","1.052","","","","has coordinates","179806","2020-10-21","18:00:00",""
"7010212","13.6687","0.0002","13.6687","0.0002","32.4627","0.0008","90","","90","","120","","5252.54","0.17","293","2","293","2","","","","","","","","7","R 3 :H","R 3","146","","","","- C70 H64 Cl5 Cu2 N9 O8 P2 -","- C70 H64 Cl5 Cu2 N9 O8 P2 -","- C210 H192 Cl15 Cu6 N27 O24 P6 -","3","0.333333","","Chen, Zhen-Feng; Xiong, Ren-Gen; Zhang, Jing; Zuo, Jing-Lin; You, Xiao-Zeng; Che, Chi-Ming; Fun, Hoong-Kun","The first chiral 2-D molecular triangular grid †","Journal of the Chemical Society, Dalton Transactions","2000","","22","4010","","10.1039/b007004l","","","0.71073","MoKα","","0.1005","0.0563","","","0.1236","0.1404","","","","","","0.947","","","","has coordinates","179806","2020-10-21","18:00:00",""
"7010213","7.9276","0.0019","10.012","0.003","11.075","0.004","101","0.02","110.705","0.014","107.892","0.014","736.9","0.4","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C32 H38 N4 Sb2 -","- C32 H38 N4 Sb2 -","- C32 H38 N4 Sb2 -","1","0.5","","Bryant, Richard; James, Siân C.; Jeffery, John C.; Norman, Nicholas C.; Orpen, A. Guy; Weckenmann, Ulrike","Antimony imido and imido‒amido compounds: a new route to an imidoantimony macrocycle","Journal of the Chemical Society, Dalton Transactions","2000","","22","4007","","10.1039/b007020n","","","0.71073","MoKα","","0.0417","0.0337","","","0.0684","0.0735","","","","","","1.117","","","","has coordinates","179806","2020-10-21","18:00:00",""
"7010217","12.857","0.003","13.962","0.003","26.23","0.005","90","","90","","90","","4708.5","1.7","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C35 H47 Li3 N8 O3 Sb2 -","- C35 H47 Li3 N8 O3 Sb2 -","- C140 H188 Li12 N32 O12 Sb8 -","4","1","","Coles, Simon J.; Hursthouse, Michael B.; Joy, Jonathan S.; Paver, Michael A.","A novel chiral distibine-centred polyimido anion","Journal of the Chemical Society, Dalton Transactions","2000","","19","3239","","10.1039/b007031i","","","0.71073","MoKα","","0.2253","0.0783","","","0.1682","0.2206","","","","","","0.951","","","","has coordinates,has disorder","179806","2020-10-21","18:00:00",""
"7010218","14.926","0.008","11.024","0.005","16.663","0.009","90","","97.83","0.05","90","","2716","2","123","2","123","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H38 Li2 N2 O8 P2 -","- C20 H38 Li2 N2 O8 P2 -","- C80 H152 Li8 N8 O32 P8 -","4","1","","Henderson, Kenneth W.; Kennedy, Alan R.; McKeown, Arlene E.; Strachan, Diane","Lithiated α-cyanophosphonates: self-assembly of two-dimensional molecular sheets composed of interconnected twenty-four membered rings †","Journal of the Chemical Society, Dalton Transactions","2000","","23","4348","","10.1039/b007038f","","","0.71069","MoKα","","0.0958","0.0651","","","0.1584","0.1711","","","","","","1.06","","","","has coordinates,has disorder","179806","2020-10-21","18:00:00",""
"7010219","22.243","0.003","9.837","0.002","15.585","0.003","90","","107.131","0.008","90","","3258.8","1","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C24 H46 Li2 N2 O8 P2 -","- C24 H39.524 Li2 N2 O8 P2 -","- C96 H158.096 Li8 N8 O32 P8 -","4","0.5","","Henderson, Kenneth W.; Kennedy, Alan R.; McKeown, Arlene E.; Strachan, Diane","Lithiated α-cyanophosphonates: self-assembly of two-dimensional molecular sheets composed of interconnected twenty-four membered rings †","Journal of the Chemical Society, Dalton Transactions","2000","","23","4348","","10.1039/b007038f","","","0.71073","MoKα","","0.1486","0.0755","","","0.1744","0.2204","","","","","","1.014","","","","has coordinates,has disorder","179806","2020-10-21","18:00:00",""
"7010220","9.6425","0.0002","16.5602","0.0005","18.7869","0.0006","65.1871","0.0012","89.7847","0.0018","89.3632","0.0018","2722.81","0.13","200","0.1","200","0.1","","","","","","","","5","P -1","-P 1","2","","","","- C28 H29 N5 O5 Ru -","- C28 H29 N5 O5 Ru -","- C112 H116 N20 O20 Ru4 -","4","2","","Kelson, Eric P.; Phengsy, Proma P.","Synthesis and structure of a ruthenium(II) complex incorporating κN bound 2-pyridonato ligands; a new catalytic system for transfer hydrogenation of ketones","Journal of the Chemical Society, Dalton Transactions","2000","","22","4023","","10.1039/b007041f","","","0.71073","MoKα","","0.088","0.0518","","","0.0959","0.1081","","","","","","1.039","","","","has coordinates","179806","2020-10-21","18:00:00",""
"7010222","17.424","0.002","9.424","0.001","16.739","0.003","90","","112.03","0.02","90","","2547.9","0.7","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C16 H2 O16 Re4 S -","- C16 H2 O16 Re4 S -","- C64 H8 O64 Re16 S4 -","4","0.5","","Egold, Hans; Schwarze, Detlef; Schraa, Markus; Flörke, Ulrich","The syntheses of novel sulfur centred spirocyclic cluster complexes starting from [Re2(μ-H)(μ-SH)(CO)8]","Journal of the Chemical Society, Dalton Transactions","2000","","23","4385","","10.1039/b007148j","","","0.71073","MoKα","","0.0631","0.0357","","","0.069","0.0778","","","","","","0.97","","","","has coordinates","179806","2020-10-21","18:00:00",""
"7010223","35.48","0.009","11.534","0.002","16.023","0.006","90","","111.67","0.02","90","","6094","3","203","2","203","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C18.5 H2.5 Cl1.5 O18 Os3 Re2 S -","- C18.5 H Cl1.5 O18 Os3 Re2 S -","- C148 H8 Cl12 O144 Os24 Re16 S8 -","8","1","","Egold, Hans; Schwarze, Detlef; Schraa, Markus; Flörke, Ulrich","The syntheses of novel sulfur centred spirocyclic cluster complexes starting from [Re2(μ-H)(μ-SH)(CO)8]","Journal of the Chemical Society, Dalton Transactions","2000","","23","4385","","10.1039/b007148j","","","0.71073","MoKα","","0.0772","0.0424","","","0.0784","0.09","","","","","","0.966","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7010224","14.214","0.005","18.351","0.004","15.578","0.003","90","","107.49","0.02","90","","3875.5","1.8","193","2","193","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C23 H3 Cl3 Fe2 O22 Re4 S2 -","- C23 H3 Cl3 Fe2 O22 Re4 S2 -","- C92 H12 Cl12 Fe8 O88 Re16 S8 -","4","1","","Egold, Hans; Schwarze, Detlef; Schraa, Markus; Flörke, Ulrich","The syntheses of novel sulfur centred spirocyclic cluster complexes starting from [Re2(μ-H)(μ-SH)(CO)8]","Journal of the Chemical Society, Dalton Transactions","2000","","23","4385","","10.1039/b007148j","","","0.71073","MoKα","","0.0654","0.0442","","","0.1035","0.1136","","","","","","1.041","","","","has coordinates","179806","2020-10-21","18:00:00",""
"7010225","8.805","0.002","28.614","0.006","11.87","0.002","90","","104.12","0.01","90","","2900.2","1","193","2","203","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C19 H2 O19 Os3 Re2 S -","- C19 O19 Os3 Re2 S -","- C76 O76 Os12 Re8 S4 -","4","1","","Egold, Hans; Schwarze, Detlef; Schraa, Markus; Flörke, Ulrich","The syntheses of novel sulfur centred spirocyclic cluster complexes starting from [Re2(μ-H)(μ-SH)(CO)8]","Journal of the Chemical Society, Dalton Transactions","2000","","23","4385","","10.1039/b007148j","","","0.71073","MoKα","","0.1066","0.0527","","","0.1216","0.1667","","","","","","1.096","","","","has coordinates","179806","2020-10-21","18:00:00",""
"7010226","8.775","0.002","12.804","0.002","12.648","0.002","90","","103.61","0.02","90","","1381.2","0.5","180","","180","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H14 Cl2 N Nb -","- C13 H14 Cl2 N Nb -","- C52 H56 Cl8 N4 Nb4 -","4","1","","Humphries, Martin J.; Green, Malcolm L. H.; Douthwaite, Richard E.; Rees, Leigh H.","Niobium‒η-cyclopentadienyl compounds with imido and amido ligands derived from 2,6-dimethylaniline","Journal of the Chemical Society, Dalton Transactions","2000","","24","4555","","10.1039/b007178l","","","0.71073","MoKα","","","0.0508","","","0.0533","","","","","1.0881","1.0881","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7010227","7.969","0.01","17.246","0.02","18.845","0.01","76.26","0.06","89.6","0.03","89.97","0.05","2516","5","293","2","293","2","","","","","","","synthesis as described","4","P -1","-P 1","2","","","","- C58 H68 N6 Nb2 -","- C58 H68 N6 Nb2 -","- C116 H136 N12 Nb4 -","2","1","","Humphries, Martin J.; Green, Malcolm L. H.; Douthwaite, Richard E.; Rees, Leigh H.","Niobium‒η-cyclopentadienyl compounds with imido and amido ligands derived from 2,6-dimethylaniline","Journal of the Chemical Society, Dalton Transactions","2000","","24","4555","","10.1039/b007178l","","","0.71073","MoKα","","0.0689","0.0667","","0.1551","0.1319","","","","1.437","1.43","1.43","","","","","has coordinates,has disorder","179806","2020-10-21","18:00:00",""
"7010228","8.49","0.002","24.276","0.005","10.274","0.002","90","","108.29","0.03","90","","2010.5","0.8","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H27 N2 Nb -","- C22 H27 N2 Nb -","- C88 H108 N8 Nb4 -","4","1","","Humphries, Martin J.; Green, Malcolm L. H.; Douthwaite, Richard E.; Rees, Leigh H.","Niobium‒η-cyclopentadienyl compounds with imido and amido ligands derived from 2,6-dimethylaniline","Journal of the Chemical Society, Dalton Transactions","2000","","24","4555","","10.1039/b007178l","","","0.71073","MoKα","","0.0553","0.0553","","0.1178","0.1178","","","","1.392","1.392","1.392","","","","","has coordinates","179806","2020-10-21","18:00:00",""
"7010231","21.949","0.004","20.864","0.004","25.809","0.005","90","","95.61","0.03","90","","11762","4","190","","","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C109 H107 Co F18 Lu N23 O22 S6 -","- C109 H99 Co F18 Lu N23 O22 S6 -","- C436 H396 Co4 F72 Lu4 N92 O88 S24 -","4","1","","Rigault, Stéphane; Piguet, Claude; Bernardinelli, Gérald; Hopfgartner, Gérard","Combination of crystal-field dependent and independent paramagnetic NMR hyperfine shift analysis methods for investigating the solution structures of inert self-assembled heterodimetallic d‒f supramolecular complexes","Journal of the Chemical Society, Dalton Transactions","2000","","24","4587","","10.1039/b007219m","","","0.71073","MoKα","","","0.061","","","","0.063","","","","","","2.06","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7010245","11.763","0.001","26.994","0.003","12.907","0.001","90","","90.296","0.002","90","","4098.3","0.7","150","","150","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C48 H60 B N3 -","- C48 H60 B N3 -","- C192 H240 B4 N12 -","4","1","","Baker, Murray V.; Brown, David H.; Skelton, Brian W.; White, Allan H.","An investigation of 1,4,7-tri(4-alkynyl)-1,4,7-triazacyclononanes: ligand synthesis and metal co-ordination chemistry †","Journal of the Chemical Society, Dalton Transactions","2000","","24","4607","","10.1039/b007324p","","","0.71073","MoKα","","0.078","0.048","","0.086","","0.058","","","1.213","","","0.997","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7010246","25.283","0.005","14.986","0.003","21.337","0.004","90","","90","","90","","8084","3","153","","153","","","","","","","","","5","I b a 2","I 2 -2c","45","","","","- C45 H51 Mo N3 O4 -","- C45 H51 Mo N3 O4 -","- C360 H408 Mo8 N24 O32 -","8","1","","Baker, Murray V.; Brown, David H.; Skelton, Brian W.; White, Allan H.","An investigation of 1,4,7-tri(4-alkynyl)-1,4,7-triazacyclononanes: ligand synthesis and metal co-ordination chemistry †","Journal of the Chemical Society, Dalton Transactions","2000","","24","4607","","10.1039/b007324p","","","0.71073","MoKα","","0.051","0.037","","0.049","","0.045","","","1.485","","","1.548","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7010247","11.485","0.001","12.312","0.002","30.35","0.004","90","","90","","90","","4291.6","1","153","","153","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C47 H57 F6 N3 P Rh -","- C47 H57 F6 N3 P Rh -","- C188 H228 F24 N12 P4 Rh4 -","4","1","","Baker, Murray V.; Brown, David H.; Skelton, Brian W.; White, Allan H.","An investigation of 1,4,7-tri(4-alkynyl)-1,4,7-triazacyclononanes: ligand synthesis and metal co-ordination chemistry †","Journal of the Chemical Society, Dalton Transactions","2000","","24","4607","","10.1039/b007324p","","","0.71073","MoKα","","0.05","0.038","","0.044","","0.041","","","1.418","","","1.417","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7010248","16.974","0.002","12.331","0.002","17.456","0.002","90","","101.945","0.002","90","","3574.5","0.8","153","","153","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C39 H45 Cl2 Cu N3 -","- C39 H45 Cl2 Cu N3 -","- C156 H180 Cl8 Cu4 N12 -","4","1","","Baker, Murray V.; Brown, David H.; Skelton, Brian W.; White, Allan H.","An investigation of 1,4,7-tri(4-alkynyl)-1,4,7-triazacyclononanes: ligand synthesis and metal co-ordination chemistry †","Journal of the Chemical Society, Dalton Transactions","2000","","24","4607","","10.1039/b007324p","","","0.71073","MoKα","","0.039","0.028","","0.057","","0.039","","","1.518","","","1.15","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7010249","9.7019","0.0003","14.5445","0.0004","16.3041","0.0004","86.957","0.002","76.013","0.002","87.492","0.002","2228.16","0.11","200","","200","","","","","","","","","6","P -1","-P 1","2","","","","- C45 H40 Au Cl2 F6 P5 -","- C45 H39.676 Au Cl2 F6 P5 -","- C90 H79.352 Au2 Cl4 F12 P10 -","2","1","","Chatterjee, Swarup; Moore, Felicity K. E.; Salem, Geoffrey; Waring, Paul; Willis, Anthony C.","Mononuclear gold(I) complex of a chiral tetra(tertiary phosphine). Crystal and molecular structure of [T-4-(RP*,RP*)]-(±)-1,2-bis[(2-diphenylphosphinophenyl)methylphosphino]benzene-P,P',P″,P‴gold(I) hexafluorophosphate","Journal of the Chemical Society, Dalton Transactions","2000","","24","4487","","10.1039/b007363f","","","0.7107","MoKα","","0.0691","0.0381","","0.0478","","0.0392","","","0.818","","","0.813","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7010250","8.565","0.002","17.591","0.003","20.285","0.004","90","","99.87","0.02","90","","3011","1.1","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C29 H34 Cl Fe O3 Sb Si -","- C29 H34 Cl Fe O3 Sb Si -","- C116 H136 Cl4 Fe4 O12 Sb4 Si4 -","4","1","","Weber, Lothar; Pumpenmeier, Lars; Stammler, Hans-Georg; Neumann, Beate","Synthesis, structure and reactivity of highly functionalized η1-stibaallyliron complexes [(OC)2(η5-C5Me5)Fe‒Sb(Cl)C(OSiMe3)CPhR] (R = Ph, Me or c-C6H11)","Journal of the Chemical Society, Dalton Transactions","2000","","23","4379","","10.1039/b007366k","","","0.71073","MoKα","","0.0807","0.0465","","","0.082","0.0929","","","","","","1.017","","","","has coordinates","179806","2020-10-21","18:00:00",""
"7010253","18.088","","26.151","","19.245","","90","","90","","90","","9103.26","","213","2","213","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C44 H62 N2 O10 Rh2 -","- C44 H62 N2 O10 Rh2 -","- C352 H496 N16 O80 Rh16 -","8","1","","Bonar-Law, Richard P.; McGrath, Thomas D.; Singh, Nirmal; Bickley, Jamie F.; Femoni, Cristina; Steiner, Alexander","Dirhodium(II) carboxylates as building blocks. Synthesis and structures of cis-chelate complexes","Journal of the Chemical Society, Dalton Transactions","2000","","23","4343","","10.1039/b007428o","","","0.71073","MoKα","","0.1593","0.0894","","","0.1951","0.2177","","","","","","0.998","","","","has coordinates,has disorder","179806","2020-10-21","18:00:00",""
"7010254","13.854","0.002","14.0285","0.0019","14.7149","0.0019","69.171","0.015","79.073","0.016","63.86","0.015","2397.7","0.7","213","2","213","2","","","","","","","","5","P -1","-P 1","2","","","","- C46 H58 N2 O12 Rh2 -","- C46 H58 N2 O12 Rh2 -","- C92 H116 N4 O24 Rh4 -","2","1","","Bonar-Law, Richard P.; McGrath, Thomas D.; Singh, Nirmal; Bickley, Jamie F.; Femoni, Cristina; Steiner, Alexander","Dirhodium(II) carboxylates as building blocks. Synthesis and structures of cis-chelate complexes","Journal of the Chemical Society, Dalton Transactions","2000","","23","4343","","10.1039/b007428o","","","0.71073","MoKα","","0.0948","0.0382","","","0.0582","0.0672","","","","","","0.708","","","","has coordinates,has disorder","179806","2020-10-21","18:00:00",""
"7010255","11.869","0.003","13.9267","0.0017","20.613","0.004","90","","103.78","0.02","90","","3309.2","1.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H30 Br2 N2 O10 Rh2 -","- C28 H30 Br2 N2 O10 Rh2 -","- C112 H120 Br8 N8 O40 Rh8 -","4","1","","Bonar-Law, Richard P.; McGrath, Thomas D.; Singh, Nirmal; Bickley, Jamie F.; Femoni, Cristina; Steiner, Alexander","Dirhodium(II) carboxylates as building blocks. Synthesis and structures of cis-chelate complexes","Journal of the Chemical Society, Dalton Transactions","2000","","23","4343","","10.1039/b007428o","","","0.71073","MoKα","","0.0693","0.0378","","","0.0685","0.0741","","","","","","0.814","","","","has coordinates","179806","2020-10-21","18:00:00",""
"7010256","15.1607","0.0018","9.3522","0.0009","19.047","0.002","90","","98.727","0.014","90","","2669.3","0.5","213","2","213","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C46 H54 Br4 N2 O12 Rh2 -","- C46 H54 Br4 N2 O12 Rh2 -","- C92 H108 Br8 N4 O24 Rh4 -","2","0.5","","Bonar-Law, Richard P.; McGrath, Thomas D.; Singh, Nirmal; Bickley, Jamie F.; Femoni, Cristina; Steiner, Alexander","Dirhodium(II) carboxylates as building blocks. Synthesis and structures of cis-chelate complexes","Journal of the Chemical Society, Dalton Transactions","2000","","23","4343","","10.1039/b007428o","","","0.71073","MoKα","","0.0829","0.0668","","","0.1609","0.1683","","","","","","0.957","","","","has coordinates","179806","2020-10-21","18:00:00",""
"7010257","9.2589","0.0007","18.9042","0.0016","27.476","0.002","90","","97.132","0.01","90","","4772","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C44 H64 N2 O10 Rh2 -","- C44 H64 N2 O10 Rh2 -","- C176 H256 N8 O40 Rh8 -","4","1","","Bonar-Law, Richard P.; McGrath, Thomas D.; Singh, Nirmal; Bickley, Jamie F.; Femoni, Cristina; Steiner, Alexander","Dirhodium(II) carboxylates as building blocks. Synthesis and structures of cis-chelate complexes","Journal of the Chemical Society, Dalton Transactions","2000","","23","4343","","10.1039/b007428o","","","0.71073","MoKα","","0.0621","0.0466","","","0.1131","0.1191","","","","","","0.96","","","","has coordinates,has disorder","179806","2020-10-21","18:00:00",""
"7010258","17.918","0.003","9.4795","0.0007","36.978","0.004","90","","90.107","0.016","90","","6280.8","1.3","213","2","213","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C54 H77 Cl6 N O12 Rh2 -","- C54 H77 Cl6 N O12 Rh2 -","- C216 H308 Cl24 N4 O48 Rh8 -","4","1","","Bonar-Law, Richard P.; McGrath, Thomas D.; Singh, Nirmal; Bickley, Jamie F.; Femoni, Cristina; Steiner, Alexander","Dirhodium(II) carboxylates as building blocks. Synthesis and structures of cis-chelate complexes","Journal of the Chemical Society, Dalton Transactions","2000","","23","4343","","10.1039/b007428o","","","0.71073","MoKα","","0.116","0.0536","","","0.133","0.1547","","","","","","0.748","","","","has coordinates,has disorder","179806","2020-10-21","18:00:00",""
"7010259","31.6","0.004","31.6","0.004","12.7","0.003","90","","90","","120","","10983","3","293","2","293","2","","","","","","","","5","R 3 :H","R 3","146","","","","- C36 H48 N2 O10 Rh2 -","- C36 H48 N2 O10 Rh2 -","- C324 H432 N18 O90 Rh18 -","9","1","","Bonar-Law, Richard P.; McGrath, Thomas D.; Singh, Nirmal; Bickley, Jamie F.; Femoni, Cristina; Steiner, Alexander","Dirhodium(II) carboxylates as building blocks. Synthesis and structures of cis-chelate complexes","Journal of the Chemical Society, Dalton Transactions","2000","","23","4343","","10.1039/b007428o","","","0.71073","MoKα","","0.0615","0.0469","","","0.1239","0.1422","","","","","","1.129","","","","has coordinates","179806","2020-10-21","18:00:00",""
"7010262","10.13","0.01","13.486","0.006","13.396","0.007","90","","101.49","0.05","90","","1793","2","150","0.1","150","0.1","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C10 H24 Cl2 O Ru S Se3 -","- C10 H24 Cl2 O Ru S Se3 -","- C40 H96 Cl8 O4 Ru4 S4 Se12 -","4","1","","Levason, William; Orchard, Simon D.; Reid, Gillian","Synthesis, characterisation and reactions of ruthenium(II) complexes based upon [RuL3]2+ (L3 = tripodal triseleno- or tritelluro-ether) fragments. Structures of [RuCl2(PPh3){MeC(CH2SeMe)3}] and [RuCl2(dmso){MeC(CH2SeMe)3}]","Journal of the Chemical Society, Dalton Transactions","2000","","24","4550","","10.1039/b007487j","","","0.7107","MoKα","","","0.0402","","","","0.0538","","","","","","1.489","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7010263","16.001","0.007","22.237","0.007","15.686","0.005","90","","90","","90","","5581","3","150.2","","150.2","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C26 H33 Cl2 P Ru Se3 -","- C26 H33 Cl2 P Ru Se3 -","- C208 H264 Cl16 P8 Ru8 Se24 -","8","1","","Levason, William; Orchard, Simon D.; Reid, Gillian","Synthesis, characterisation and reactions of ruthenium(II) complexes based upon [RuL3]2+ (L3 = tripodal triseleno- or tritelluro-ether) fragments. Structures of [RuCl2(PPh3){MeC(CH2SeMe)3}] and [RuCl2(dmso){MeC(CH2SeMe)3}]","Journal of the Chemical Society, Dalton Transactions","2000","","24","4550","","10.1039/b007487j","","","0.7107","MoKα","","","0.0357","","","","0.0372","","","","","","1.263","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7010264","9.7752","0.0013","16.867","0.003","10.909","0.002","90","","95.115","0.012","90","","1791.5","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","00skl024","3-mesityl-1-(2-picolyl)-imidazol-2-ylidene silver bromide","","- C18 H19 Ag Br N3 -","- C18 H19 Ag Br N3 -","- C72 H76 Ag4 Br4 N12 -","4","1","","Tulloch, Arran A. D.; Danopoulos, Andreas A.; Winston, Scott; Kleinhenz, Sven; Eastham, Graham","N-Functionalised heterocyclic carbene complexes of silver","Journal of the Chemical Society, Dalton Transactions","2000","","24","4499","","10.1039/b007504n","","","0.71073","MoKα","","0.2842","0.2056","","","0.4992","0.5351","","","","","","1.586","","","","has coordinates","179806","2020-10-21","18:00:00",""
"7010265","12.7737","0.0001","16.553","0.0001","20.1344","0.0002","90","","90","","90","","4257.28","0.06","150","2","150","2","","","","","","","","5","P 21 n b","P -2bc 2a","33","00skl020","3-(2,6-di-isopropylphenyl)-1-(2-picolyl)-imidazol-2-ylidene silver bromide","","- C42 H50 Ag2 Br2 N6 -","- C42 H50 Ag2 Br2 N6 -","- C168 H200 Ag8 Br8 N24 -","4","1","","Tulloch, Arran A. D.; Danopoulos, Andreas A.; Winston, Scott; Kleinhenz, Sven; Eastham, Graham","N-Functionalised heterocyclic carbene complexes of silver","Journal of the Chemical Society, Dalton Transactions","2000","","24","4499","","10.1039/b007504n","","","0.71073","MoKα","","0.0504","0.0386","","","0.0897","0.0998","","","","","","1.057","","","","has coordinates","179806","2020-10-21","18:00:00",""
"7010266","10.8837","0.0004","16.4154","0.0006","11.4127","0.0004","90","","103.155","0.002","90","0.002","1985.49","0.13","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Compound X","3-(2,6-di-isopropylphenyl)-1-(2-pyridyl)-imidazol-2-ylidene silver bromide","","- C20 H23 Ag Br N3 -","- C20 H23 Ag Br N3 -","- C80 H92 Ag4 Br4 N12 -","4","1","","Tulloch, Arran A. D.; Danopoulos, Andreas A.; Winston, Scott; Kleinhenz, Sven; Eastham, Graham","N-Functionalised heterocyclic carbene complexes of silver","Journal of the Chemical Society, Dalton Transactions","2000","","24","4499","","10.1039/b007504n","","","0.71073","MoKα","","0.0519","0.0454","","","0.1304","0.1391","","","","","","1.114","","","","has coordinates","179806","2020-10-21","18:00:00",""
"7010267","26.5398","0.0002","10.4489","0.0001","16.8853","0.0002","90","","125.9","0.001","90","","3793.01","0.08","150","2","150","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","00skl035","3-mesityl-1-(N,N-diethylacetamido) imidazol-2-ylidene silver bromide","","- C18 H25 Ag Br0.08 Cl0.92 N3 O -","- C18 H25 Ag Br0.081 Cl0.919 N3 O -","- C144 H200 Ag8 Br0.648 Cl7.352 N24 O8 -","8","1","","Tulloch, Arran A. D.; Danopoulos, Andreas A.; Winston, Scott; Kleinhenz, Sven; Eastham, Graham","N-Functionalised heterocyclic carbene complexes of silver","Journal of the Chemical Society, Dalton Transactions","2000","","24","4499","","10.1039/b007504n","","","0.71073","MoKα","","0.0678","0.0542","","","0.1574","0.169","","","","","","1.111","","","","has coordinates","179806","2020-10-21","18:00:00",""
"7010268","9.6884","0.0002","11.4709","0.0002","13.775","0.0002","71.937","0.001","85.779","0.001","76.949","0.001","1417.83","0.04","150","2","150","2","","","","","","","","5","P -1","-P 1","2","00skl033","3-tert-butyl-1-(4,6-di-tertbutyl-o-toluidyl-phenylimine)- imidazol-2-ylidene silver bromide","","- C29 H39 Ag Cl N3 -","- C29 H39 Ag Cl N3 -","- C58 H78 Ag2 Cl2 N6 -","2","1","","Tulloch, Arran A. D.; Danopoulos, Andreas A.; Winston, Scott; Kleinhenz, Sven; Eastham, Graham","N-Functionalised heterocyclic carbene complexes of silver","Journal of the Chemical Society, Dalton Transactions","2000","","24","4499","","10.1039/b007504n","","","0.71073","MoKα","","0.0626","0.0403","","","0.102","0.1194","","","","","","1.024","","","","has coordinates","179806","2020-10-21","18:00:00",""
"7010269","17.2853","0.0003","12.7079","0.0003","18.5879","0.0004","90","","117.407","0.001","90","0.001","3624.73","0.14","150","2","150","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","00skl036","a,a'-bis(3-mesityl-imidazol-2-ylidene)-o-xylene bis (silver bromide)","","- C32.5 H35 Ag2 Cl3 N4 -","- C32 H34 Ag2 Cl2 N4 -","- C128 H136 Ag8 Cl8 N16 -","4","1","","Tulloch, Arran A. D.; Danopoulos, Andreas A.; Winston, Scott; Kleinhenz, Sven; Eastham, Graham","N-Functionalised heterocyclic carbene complexes of silver","Journal of the Chemical Society, Dalton Transactions","2000","","24","4499","","10.1039/b007504n","","","0.71073","MoKα","","0.1598","0.0734","","","0.2093","0.236","","","","","","0.98","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7010270","34.337","0.005","34.337","0.005","11.335","0.002","90","","90","","90","","13364","4","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C35 H38 Cl Fe N Pd -","- C35 H34 Cl Fe N Pd -","- C560 H544 Cl16 Fe16 N16 Pd16 -","16","1","","Benito, Mónica; López, Concepción; Morvan, Xavier; Solans, Xavier; Font-Bardía, Mercè","A comparative study of the reactivity of the σ(Pd‒Csp2, ferrocene) and σ(Pd‒Csp2, biphenyl) bonds in cyclopalladated complexes derived from [Fe(η5-C5H5)(η5-C5H4CHNC6H4C6H5-2)]","Journal of the Chemical Society, Dalton Transactions","2000","","23","4470","","10.1039/b007537j","","","0.71069","MoKα","","0.1134","0.0365","","0.1397","0.078","","","","0.958","1.044","1.044","","","","","has coordinates","179806","2020-10-21","18:00:00",""
"7010271","8.889","0.001","13.207","0.001","16.911","0.001","90","","100.51","0.01","90","","1952","0.3","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","N,N-diethyl-N'-(-)-(1R)-menthyloxycarbonylthiourea","","- C16 H30 N2 O2 S -","- C16 H30 N2 O2 S -","- C64 H120 N8 O8 S4 -","4","2","","Sacht, Cheryl; Datt, Michael S.; Otto, Stefanus; Roodt, Andreas","Synthesis, characterisation and coordination chemistry of novel chiral N,N-dialkyl-N '-menthyloxycarbonylthioureas. Crystal and molecular structures of N,N-diethyl-N '-(−)-(3R)-menthyloxycarbonylthiourea and cis-(S,S)-[Pt(L)Cl(DMSO)] [where HL = N-(+)-(3R)-menthyloxycarbonyl-N'-morpholinothiourea or N-benzoyl-N',N'-diethylthiourea]","Journal of the Chemical Society, Dalton Transactions","2000","","24","4579","","10.1039/b007589m","","","0.71073","MoKα","","0.0393","0.0385","","","0.0925","0.0938","","","","","","1.058","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7010272","9.8964","0.0006","13.2721","0.0008","18.0016","0.0011","90","","90","","90","","2364.4","0.2","293","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","Chlorodimethylsulfoxide(N-morpholino-N'-(+)-(1R)-menthyloxycarbonylthioureato) platinum(II)","","- C18 H33 Cl N2 O4 Pt S2 -","- C18 H33 Cl N2 O4 Pt S2 -","- C72 H132 Cl4 N8 O16 Pt4 S8 -","4","1","","Sacht, Cheryl; Datt, Michael S.; Otto, Stefanus; Roodt, Andreas","Synthesis, characterisation and coordination chemistry of novel chiral N,N-dialkyl-N '-menthyloxycarbonylthioureas. Crystal and molecular structures of N,N-diethyl-N '-(−)-(3R)-menthyloxycarbonylthiourea and cis-(S,S)-[Pt(L)Cl(DMSO)] [where HL = N-(+)-(3R)-menthyloxycarbonyl-N'-morpholinothiourea or N-benzoyl-N',N'-diethylthiourea]","Journal of the Chemical Society, Dalton Transactions","2000","","24","4579","","10.1039/b007589m","","","0.71073","MoKα","","0.0393","0.0296","","","0.0535","0.0565","","","","","","1.04","","","","has coordinates","179806","2020-10-21","18:00:00",""
"7010273","8.7436","0.0004","10.0717","0.0005","11.5723","0.0006","76.263","0.001","89.207","0.001","68.205","0.001","916.05","0.08","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","Chlorodimethylsulfoxide(N,N-diethyl-N'-benzoylthioureato)platinum(II)","","- C14 H21 Cl N2 O2 Pt S2 -","- C14 H21 Cl N2 O2 Pt S2 -","- C28 H42 Cl2 N4 O4 Pt2 S4 -","2","1","","Sacht, Cheryl; Datt, Michael S.; Otto, Stefanus; Roodt, Andreas","Synthesis, characterisation and coordination chemistry of novel chiral N,N-dialkyl-N '-menthyloxycarbonylthioureas. Crystal and molecular structures of N,N-diethyl-N '-(−)-(3R)-menthyloxycarbonylthiourea and cis-(S,S)-[Pt(L)Cl(DMSO)] [where HL = N-(+)-(3R)-menthyloxycarbonyl-N'-morpholinothiourea or N-benzoyl-N',N'-diethylthiourea]","Journal of the Chemical Society, Dalton Transactions","2000","","24","4579","","10.1039/b007589m","","","0.71073","MoKα","","0.0343","0.0299","","","0.0725","0.0751","","","","","","1.072","","","","has coordinates","179806","2020-10-21","18:00:00",""
"7010274","14.36","0.004","24.341","0.004","19.477","0.005","90","","99.01","0.03","90","","6724","3","213","2","213","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C124 H164 O26 Rh4 -","- C124 H164 O26 Rh4 -","- C248 H328 O52 Rh8 -","2","0.5","","Bonar-Law, Richard P.; Bickley, Jamie F.; Femoni, Cristina; Steiner, Alexander","Dirhodium(II) carboxylates as building blocks. Macrocyclic dimers with vertically stacked Rh24+ units","Journal of the Chemical Society, Dalton Transactions","2000","","23","4244","","10.1039/b007625m","","","0.71073","MoKα","","0.1179","0.0674","","","0.1782","0.209","","","","","","0.974","","","","has coordinates,has disorder","179806","2020-10-21","18:00:00",""
"7010275","12.983","0.003","14.179","0.003","14.632","0.004","86.1","0.03","89.83","0.03","66.06","0.03","2455.2","1.2","213","2","213","2","","","","","","","","4","P 1","P 1","1","","","","- C95 H124 O23 Rh4 -","- C95 H124 O23 Rh4 -","- C95 H124 O23 Rh4 -","1","1","","Bonar-Law, Richard P.; Bickley, Jamie F.; Femoni, Cristina; Steiner, Alexander","Dirhodium(II) carboxylates as building blocks. Macrocyclic dimers with vertically stacked Rh24+ units","Journal of the Chemical Society, Dalton Transactions","2000","","23","4244","","10.1039/b007625m","","","0.71073","MoKα","","0.0579","0.0406","","","0.1034","0.109","","","","","","0.932","","","","has coordinates,has disorder","179806","2020-10-21","18:00:00",""
"7010276","14.9184","0.0013","13.0142","0.0011","28.84","0.002","90","","97.463","0.001","90","","5551.9","0.8","193","2","193","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C18 B3 F15 N18 -","- C18 B3 F15 N18 -","- C144 B24 F120 N144 -","8","1","","Fraenk, Wolfgang; Klapötke, Thomas M.; Krumm, Burkhard; Nöth, Heinrich; Suter, Max; Warchhold, Marcus","Oligomeric pentafluorophenylboron azides","Journal of the Chemical Society, Dalton Transactions","2000","","24","4635","","10.1039/b007626k","","","0.71073","MoKα","","0.0596","0.0395","","","0.0958","0.1051","","","","","","1.032","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7010277","7.5637","0.0006","13.0402","0.001","13.4308","0.0009","90","","90","","90","","1324.71","0.17","193","2","193","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C11 H5 B F5 N7 -","- C11 H5 B F5 N7 -","- C44 H20 B4 F20 N28 -","4","1","","Fraenk, Wolfgang; Klapötke, Thomas M.; Krumm, Burkhard; Nöth, Heinrich; Suter, Max; Warchhold, Marcus","Oligomeric pentafluorophenylboron azides","Journal of the Chemical Society, Dalton Transactions","2000","","24","4635","","10.1039/b007626k","","","0.71073","MoKα","","0.0546","0.038","","","0.0885","0.0945","","","","","","1.01","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7010294","13.019","0.003","27.297","0.008","11.095","0.003","90","","90","","90","","3942.9","1.8","295.2","","295.2","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C21 H21 Cr F6 P -","- C21 H21 Cr F6 P -","- C168 H168 Cr8 F48 P8 -","8","1","","Beddoes, Roy L.; Elwell, Mark S.; Mabbs, Frank E.; McInnes, Eric J. L.; Roberts, Andrew; Sarwar, M. Fahad; Whiteley, Mark W.","Synthesis, redox chemistry and EPR spectroscopy of the mixed-sandwich complexes (η-arene)(η-cycloheptatrienyl)metal(z+) (M = Cr or Mo; z = 1 or 2): crystal structures of the redox pair [Cr(η-C6H5Me)(η-C7H6C6H4Me-4)][PF6]n (n = 1 or 2)","Journal of the Chemical Society, Dalton Transactions","2000","","24","4669","","10.1039/b007830l","","","0.7107","MoKα","","0.1062","0.0622","","0.0471","0.045","","","","2.762","3.402","3.402","","","","","has coordinates","209484","2020-10-21","18:00:00",""
"7010295","12.747","0.005","12.697","0.004","14.317","0.005","90","","93.22","0.03","90","","2313.5","1.4","296.2","","296.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C21 H21 Cr F12 P2 -","- C21 H21 Cr F12 P2 -","- C84 H84 Cr4 F48 P8 -","4","1","","Beddoes, Roy L.; Elwell, Mark S.; Mabbs, Frank E.; McInnes, Eric J. L.; Roberts, Andrew; Sarwar, M. Fahad; Whiteley, Mark W.","Synthesis, redox chemistry and EPR spectroscopy of the mixed-sandwich complexes (η-arene)(η-cycloheptatrienyl)metal(z+) (M = Cr or Mo; z = 1 or 2): crystal structures of the redox pair [Cr(η-C6H5Me)(η-C7H6C6H4Me-4)][PF6]n (n = 1 or 2)","Journal of the Chemical Society, Dalton Transactions","2000","","24","4669","","10.1039/b007830l","","","0.7107","MoKα","","0.0691","0.0455","","0.0444","0.0426","","","","2.322","2.593","2.593","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7010308","9.984","0.001","10.0007","0.001","17.7216","0.0016","80.44","0.002","78.784","0.002","67.801","0.002","1598.6","0.3","238","2","238","2","","","","","","","","6","P -1","-P 1","2","","","","- C33 H27 B N6 S4 Zn -","- C33 H27 B N6 S4 Zn -","- C66 H54 B2 N12 S8 Zn2 -","2","1","","Bridgewater, Brian M.; Fillebeen, Tauqir; Friesner, Richard A.; Parkin, Gerard","A zinc thiolate species which mimics aspects of the chemistry of the Ada repair protein and matrix metalloproteinases: the synthesis, structure and reactivity of the tris(2-mercapto-1-phenylimidazolyl)hydroborato complex [TmPh]ZnSPh †","Journal of the Chemical Society, Dalton Transactions","2000","","24","4494","","10.1039/b007886g","","","0.71073","MoKα","","0.1365","0.0524","","","0.0663","0.0781","","","","","","1.004","","","","has coordinates","179807","2020-10-21","18:00:00",""
"7010318","28.749","0.002","8.5745","0.0007","40.222","0.003","90","","131.477","0.002","90","","7428.6","1","150","2","150","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C114 H156 O62 Rh8 -","- C114 H142 O62 Rh8 -","- C228 H284 O124 Rh16 -","2","0.5","","Bickley, Jamie F.; Bonar-Law, Richard P.; Femoni, Cristina; MacLean, Elizabeth J.; Steiner, Alexander; Teat, Simon J.","Dirhodium(II) carboxylate complexes as building blocks. Synthesis and structures of square boxes with tilted walls †","Journal of the Chemical Society, Dalton Transactions","2000","","22","4025","","10.1039/b008060h","","","0.6885","","","0.1841","0.1514","","","0.2936","0.304","","","","","","1.349","","","","has coordinates","179807","2020-10-21","18:00:00",""
"7010319","35.1613","0.001","18.1227","0.0005","21.5984","0.0006","90","","98.216","0.001","90","","13621.6","0.7","213","2","213","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C120 H154 O57 Rh8 -","- C120 H152 O57 Rh8 -","- C480 H608 O228 Rh32 -","4","0.5","","Bickley, Jamie F.; Bonar-Law, Richard P.; Femoni, Cristina; MacLean, Elizabeth J.; Steiner, Alexander; Teat, Simon J.","Dirhodium(II) carboxylate complexes as building blocks. Synthesis and structures of square boxes with tilted walls †","Journal of the Chemical Society, Dalton Transactions","2000","","22","4025","","10.1039/b008060h","","","0.6855","","","0.1445","0.0959","","","0.2502","0.2637","","","","","","1.083","","","","has coordinates","179807","2020-10-21","18:00:00",""
"7010320","28.7103","0.0012","8.6546","0.0004","30.3073","0.0013","90","","93.412","0.001","90","","7517.3","0.6","150","2","150","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C116 H138 Cl16 O54 Rh8 -","- C116 H138 Cl16 O54 Rh8 -","- C232 H276 Cl32 O108 Rh16 -","2","0.5","","Bickley, Jamie F.; Bonar-Law, Richard P.; Femoni, Cristina; MacLean, Elizabeth J.; Steiner, Alexander; Teat, Simon J.","Dirhodium(II) carboxylate complexes as building blocks. Synthesis and structures of square boxes with tilted walls †","Journal of the Chemical Society, Dalton Transactions","2000","","22","4025","","10.1039/b008060h","","","0.6885","","","0.083","0.0573","","","0.1389","0.1463","","","","","","1.04","","","","has coordinates,has disorder","179807","2020-10-21","18:00:00",""
"7010321","9.5595","0.0012","20.254","0.003","20.399","0.003","95.337","0.017","101.8","0.015","94.735","0.017","3828.4","1","213","2","213","2","","","","","","","","4","P -1","-P 1","2","","","","- C118 H156 O65 Rh8 -","- C118 H154 O65 Rh8 -","- C118 H154 O65 Rh8 -","1","0.5","","Bickley, Jamie F.; Bonar-Law, Richard P.; Femoni, Cristina; MacLean, Elizabeth J.; Steiner, Alexander; Teat, Simon J.","Dirhodium(II) carboxylate complexes as building blocks. Synthesis and structures of square boxes with tilted walls †","Journal of the Chemical Society, Dalton Transactions","2000","","22","4025","","10.1039/b008060h","","","0.71073","MoKα","","0.1219","0.0628","","","0.163","0.1822","","","","","","0.848","","","","has coordinates,has disorder","179807","2020-10-21","18:00:00",""
"7010416","10.6595","0.0013","9.7366","0.001","20.783","0.002","90","","103.099","0.014","90","","2100.9","0.4","160","2","160","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H31 Cl2 N3 V -","- C16 H31 Cl2 N3 V -","- C64 H124 Cl8 N12 V4 -","4","1","","Lorber, Christian; Donnadieu, Bruno; Choukroun, Robert","Synthesis and X-ray characterization of a monomeric Cp-free d1-imido‒vanadium(IV) complex","Journal of the Chemical Society, Dalton Transactions","2000","","24","4497","","10.1039/b008761k","","","0.71073","MoK\?","","0.1117","0.0912","","","0.1504","0.169","","","","","","1.061","","","","has coordinates","179808","2020-10-21","18:00:00",""
"7027862","12.059","0.002","24.484","0.001","14.417","0.0004","90","","103.797","0.003","90","","4133.8","0.7","100","","100","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C23 H33 Cl7 O20 Sn6 -","- C23 H26 Cl7 O20 Sn6 -","- C92 H104 Cl28 O80 Sn24 -","4","1","","Zobel, Bernhard; Costin, Jason; Vincent, Beverly R.; Tiekink, Edward R. T.; Dakternieks, Dainis","A new “Sn12” oxo-cluster—how to flatten the football","Journal of the Chemical Society, Dalton Transactions","2000","","22","4021","","10.1039/b007896o","","","0.7107","MoKα","","","0.047","","","","0.049","","","","","","1.71","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7035626","14.2502","","14.2502","","14.2502","","90","","90","","90","","2893.76","","","","","","","","","","","","","4","P a -3","-P 2ac 2ab 3","205","","Na Mg (P O3)3","","- Mg Na O9 P3 -","- Mg Na O9 P3 -","- Mg16 Na16 O144 P48 -","16","0.666667","","Abrahams, I.; Ahmed, A.; Groombridge, C. J.; Hawkes, G. E.; Nunes, T. G.","Cation distribution in cubic Na M (P O3)3 (M = Mg or Zn) using X-ray powder diffraction and solid state NMR","Journal of the Chemical Society. Dalton Transactions (2000- )","2000","2000","","155","160","10.1039/A906413C","","","","","","","","","","","","","","","","","","","","","has coordinates","186066","2020-10-21","18:00:00",""
"7035627","14.2581","","14.2581","","14.2581","","90","","90","","90","","2898.58","","","","","","","","","","","","","4","P a -3","-P 2ac 2ab 3","205","","Na Zn (P O3)3","","- Na O9 P3 Zn -","- Na O9 P3 Zn -","- Na16 O144 P48 Zn16 -","16","0.666667","","Abrahams, I.; Ahmed, A.; Groombridge, C. J.; Hawkes, G. E.; Nunes, T. G.","Cation distribution in cubic Na M (P O3)3 (M = Mg or Zn) using X-ray powder diffraction and solid state NMR","Journal of the Chemical Society. Dalton Transactions (2000- )","2000","2000","","155","160","10.1039/A906413C","","","","","","","","","","","","","","","","","","","","","has coordinates","186066","2020-10-21","18:00:00",""
"7035628","8.8798","","6.937","","4.6535","","90","","90","","90","","286.652","","","","","","","","","","","","","3","P m n 21","P 2ac -2","31","","Te2 O3 (S O4)","","- O7 S Te2 -","- O7 S Te2 -","- O14 S2 Te4 -","2","0.5","","Ahmed, M.A.K.; Kjekshus, A.; Fjellvag, H.","Synthesis, structure and thermal stability of tellurium oxides and oxide sulfate formed from reactions in refluxing sulfuric acid","Journal of the Chemical Society. Dalton Transactions (2000- )","2000","2000","","4542","4549","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7035629","5.1947","","5.1947","","5.1947","","56.38","","56.38","","56.38","","90.823","","","","","","","","","","","","","2","R -3 c :R","-P 3* 2n","167","","Te O3","","- O3 Te -","- O3 Te -","- O6 Te2 -","2","0.166667","","Ahmed, M.A.K.; Fjellvag, H.; Kjekshus, A.","Synthesis, structure and thermal stability of tellurium oxides and oxide sulfate formed from reactions in refluxing sulfuric acid","Journal of the Chemical Society. Dalton Transactions (2000- )","2000","2000","","4542","4549","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7035666","24.34","","12.49","","17.33","","82.57","","101.15","","122.96","","4335.18","","","","","","","","","","","","","5","P -1","-P 1","2","","Na2.5 K9 H0.5 (H6 W20 O66) (H2 O)22","","- H50.5 K9 Na2.5 O88 W20 -","- K9 Na2.5 O88 W20 -","- K18 Na5 O176 W40 -","2","1","","Dickman, M.H.; Ozeki, T.; Evans, H.T.jr.; Jameson, G.B.; Rong, C.-Y.; Pope, M.T.","Polyoxometalates from heteropoly ""brown"" precursors. A new structural class of mixed valence heteropolytungstates, ((X O4) W(IV)3 W(VI)17 O62 Hx)(n-)","Journal of the Chemical Society. Dalton Transactions (2000- )","2000","2000","","149","154","","","","","","","","","","","","","","","","","","","","","","has coordinates","140631","2020-10-21","18:00:00",""
"7035667","18.42805","","5.47254","","9.28972","","90","","90.365","","90","","936.833","","","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","Cs (Co P O4)","","- Co Cs O4 P -","- Co Cs O4 P -","- Co8 Cs8 O32 P8 -","8","2","","Henry, P.F.; Weller, M.T.; Hughes, E.M.","Synthesis and structural characterisation of Cs Co P O4 - ABW","Journal of the Chemical Society. Dalton Transactions (2000- )","2000","2000","","555","558","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7051231","11.064","0.003","18.385","0.006","11.155","0.003","90","","110.465","0.015","90","","2125.8","1.1","105","","105","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C42 H70 B K N4 O3 -","- C42 H50 B K N4 O3 -","- C84 H100 B2 K2 N8 O6 -","2","1","","Chisholm, Malcolm H.; Iyer, Suri S.; Streib, William E.","Chiral C2 and C1 symmetric (cyclooctane-1,5-diyl)bis(2-pyrazolyl)borate complexes of potassium and thallium. Preparation, structures and solution behavior","New Journal of Chemistry","2000","24","6","393","398","10.1039/a906582b","","","0.71069","MoKα","","","0.094","","","","0.0904","","","","","","1.6176","","","","has coordinates,has disorder","210743","2020-10-21","18:00:00",""
"7051232","19.4597","0.0019","21.273","0.002","10.8452","0.0011","90","","90","","90","","4489.6","0.8","107","","107.15","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C46 H80 B K N4 O4 -","- C46 H80 B K N4 O4 -","- C184 H320 B4 K4 N16 O16 -","4","1","","Chisholm, Malcolm H.; Iyer, Suri S.; Streib, William E.","Chiral C2 and C1 symmetric (cyclooctane-1,5-diyl)bis(2-pyrazolyl)borate complexes of potassium and thallium. Preparation, structures and solution behavior","New Journal of Chemistry","2000","24","6","393","398","10.1039/a906582b","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","210743","2020-10-21","18:00:00",""
"7051233","12.445","0.005","17.492","0.007","11.194","0.004","93.05","0.02","115.304","0.019","69.3","0.02","2046.9","1.5","103","","103","","","","","","","","","6","P -1","-P 1","2","","","","- C42 H68 B K N4 O3 -","- C42 H68 B K N4 O3 -","- C84 H136 B2 K2 N8 O6 -","2","1","","Chisholm, Malcolm H.; Iyer, Suri S.; Streib, William E.","Chiral C2 and C1 symmetric (cyclooctane-1,5-diyl)bis(2-pyrazolyl)borate complexes of potassium and thallium. Preparation, structures and solution behavior","New Journal of Chemistry","2000","24","6","393","398","10.1039/a906582b","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","210743","2020-10-21","18:00:00",""
"7051234","13.662","0.002","33.992","0.005","13.985","0.002","90","","119.107","0.007","90","","5674.1","1.6","109","","109","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C30 H44 B N4 Tl -","- C30 H44 B N4 Tl -","- C240 H352 B8 N32 Tl8 -","8","4","","Chisholm, Malcolm H.; Iyer, Suri S.; Streib, William E.","Chiral C2 and C1 symmetric (cyclooctane-1,5-diyl)bis(2-pyrazolyl)borate complexes of potassium and thallium. Preparation, structures and solution behavior","New Journal of Chemistry","2000","24","6","393","398","10.1039/a906582b","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","210743","2020-10-21","18:00:00",""
"7051235","17.7939","0.0009","14.3421","0.0009","11.9338","0.0005","90","","129.008","0.002","90","","2366.6","0.2","173","0.2","173","0.2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C22 H28 Cl N3 O10 -","- C22 H28 Cl N3 O10 -","- C88 H112 Cl4 N12 O40 -","4","1","","Kiviniemi, Sari; Nissinen, Maija; Lämsä, Markku T.; Jalonen, Jorma; Rissanen, Kari; Pursiainen, Jouni","Complexation of planar, organic, five-membered cations with crown ethers","New Journal of Chemistry","2000","24","1","47","52","10.1039/a907608e","","","","","","","","","","","","","","","","","","","","","has coordinates","210947","2020-10-21","18:00:00",""
"7051236","17.84","0.001","14.251","0.001","12.3267","0.0006","90","","129.535","0.003","90","","2417","0.2","173","0.2","173","0.2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C23 H28 Cl N O10 S -","- C23 H28 Cl N O10 S -","- C92 H112 Cl4 N4 O40 S4 -","4","1","","Kiviniemi, Sari; Nissinen, Maija; Lämsä, Markku T.; Jalonen, Jorma; Rissanen, Kari; Pursiainen, Jouni","Complexation of planar, organic, five-membered cations with crown ethers","New Journal of Chemistry","2000","24","1","47","52","10.1039/a907608e","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","210947","2020-10-21","18:00:00",""
"7051237","9.799","0.0002","37.641","0.001","12.3724","0.0003","90","","93.016","0.001","90","","4557.17","0.19","173","0.2","173","0.2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H29 Cl N2 O10 -","- C19 H29 Cl N2 O10 -","- C152 H232 Cl8 N16 O80 -","8","2","","Kiviniemi, Sari; Nissinen, Maija; Lämsä, Markku T.; Jalonen, Jorma; Rissanen, Kari; Pursiainen, Jouni","Complexation of planar, organic, five-membered cations with crown ethers","New Journal of Chemistry","2000","24","1","47","52","10.1039/a907608e","","","","","","","","","","","","","","","","","","","","","has coordinates","210947","2020-10-21","18:00:00",""
"7051238","15.8297","0.0003","10.8577","0.0003","16.0071","0.0005","90","","93.859","0.002","90","","2744.97","0.13","173","0.2","173","0.2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H34 Cl2 N4 O14 -","- C18 H34 Cl2 N4 O14 -","- C72 H136 Cl8 N16 O56 -","4","1","","Kiviniemi, Sari; Nissinen, Maija; Lämsä, Markku T.; Jalonen, Jorma; Rissanen, Kari; Pursiainen, Jouni","Complexation of planar, organic, five-membered cations with crown ethers","New Journal of Chemistry","2000","24","1","47","52","10.1039/a907608e","","","","","","","","","","","","","","","","","","","","","has coordinates","210947","2020-10-21","18:00:00",""
"7051239","8.392","0.001","12.611","0.002","25.993","0.005","90","","90","","90","","2750.9","0.8","173","0.2","173","0.2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C25 H33 Cl N2 O11 -","- C25 H33 Cl N2 O11 -","- C100 H132 Cl4 N8 O44 -","4","1","","Kiviniemi, Sari; Nissinen, Maija; Lämsä, Markku T.; Jalonen, Jorma; Rissanen, Kari; Pursiainen, Jouni","Complexation of planar, organic, five-membered cations with crown ethers","New Journal of Chemistry","2000","24","1","47","52","10.1039/a907608e","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","210947","2020-10-21","18:00:00",""
"7051240","22.0361","0.0001","22.0361","0.0001","17.0005","0.0002","90","","90","","90","","8255.27","0.11","293","2","293","2","","","","","","","","5","P 4/n c c :2","-P 4a 2ac","130","","","","- C85.5 H126.5 Cl N4.5 O12 -","- C85.526 H124 Cl0.948 N4.526 O12 -","- C342.104 H496 Cl3.792 N18.104 O48 -","4","0.25","","Schmidt, Christian; Paulus, Erich F.; Böhmer, Volker; Vogt, Walter","Selective derivatisation of resorcarenes. Part 5. Acylation of tetrabenzoxazine derivatives","New Journal of Chemistry","2000","24","3","123","","10.1039/a907622k","","","0.71073","MoKα","","0.0931","0.0787","","","0.2197","0.2349","","","","","","1.049","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7051241","7.9985","0.001","8.9047","0.0011","16.614","0.002","90","","92.18","0.01","90","","1182.5","0.3","100","","100","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H43 Cl N2 P2 Ru -","- C18 H42 Cl N2 P2 Ru -","- C36 H84 Cl2 N4 P4 Ru2 -","2","0.5","","Coalter, III, Joseph N.; Bollinger, John C.; Huffman, John C.; Werner‒Zwanziger, Ulrike; Caulton, Kenneth G.; Davidson, Ernest R.; Gérard, Hélène; Clot, Eric; Eisenstein, Odile","Coordinated carbenes from electron-rich olefins on RuHCl(PPr3i)2","New Journal of Chemistry","2000","24","1","9","26","10.1039/a907624g","","","0.71073","MoKα","","0.0625","0.0346","","0.0778","0.0675","","","","0.918","0.955","0.955","","","","","has coordinates,has disorder","210948","2020-10-21","18:00:00",""
"7051242","16.124","0.006","11.289","0.004","16.313","0.006","90","","100.297","0.019","90","","2921.6","1.8","102","","102","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C24 H52 Cl N O P2 Ru -","- C24 H52 Cl N O P2 Ru -","- C96 H208 Cl4 N4 O4 P8 Ru4 -","4","1","","Coalter, III, Joseph N.; Bollinger, John C.; Huffman, John C.; Werner‒Zwanziger, Ulrike; Caulton, Kenneth G.; Davidson, Ernest R.; Gérard, Hélène; Clot, Eric; Eisenstein, Odile","Coordinated carbenes from electron-rich olefins on RuHCl(PPr3i)2","New Journal of Chemistry","2000","24","1","9","26","10.1039/a907624g","","","0.71069","MoKα","","","0.046","","","","0.0349","","","","","","1.229","","","","has coordinates,has disorder","210948","2020-10-21","18:00:00",""
"7051243","27.512","0.004","27.5123","","25.092","0.003","90","","90","","120","","16448","3","296.2","","296.2","","","","","","","","","6","R -3 :H","-R 3","148","","","","- C38 H33.5 N6 Ni O4.75 S2 -","- C38 H32 N6 Ni O4.5695 S2 -","- C684 H576 N108 Ni18 O82.251 S36 -","18","1","","Bermejo, Manuel R.; Sousa, Antonio; Fondo, Matilde; Helliwell, Madeleine","Rearrangement and co-ordination of 1-[(4-methylphenyl)- sulfonamido]-2-[1-(2-pyridylmethylidene)amino]benzene","New Journal of Chemistry","2000","24","1","33","","10.1039/a907731f","","","1.5418","CuKα","","0.1707","0.0699","","0.0559","0.0489","","","","1.619","2.012","2.012","","","","","has coordinates","209482","2020-10-21","18:00:00",""
"7051244","9.9076","0.0001","14.6999","0.0002","19.0506","0.0002","90","","101.7","","90","","2716.9","0.05","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C27 H26 Cl2 N2 O P2 Pd -","- C27 H26 Cl2 N2 O P2 Pd -","- C108 H104 Cl8 N8 O4 P8 Pd4 -","4","1","","Slawin, Alexandra M. Z.; Wainwright, Matthew; Derek Woollins, J.","Phosphino-urea chemistry: preparation and structure of chelate and P‒N bond cleavage complexes","New Journal of Chemistry","2000","24","2","69","","10.1039/a908153d","","","0.71073","MoKα","","0.039","0.0263","","0.069","0.0576","","","","0.964","0.985","0.985","","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051245","11.4044","0.0005","11.5628","0.0005","11.9275","0.0005","69.23","","71.929","0.001","74.871","0.001","1377.76","0.1","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C18 H23 Cl5 N2 O P Pt S2 -","- C18 H23 Cl5 N2 O P Pt S2 -","- C36 H46 Cl10 N4 O2 P2 Pt2 S4 -","2","1","","Slawin, Alexandra M. Z.; Wainwright, Matthew; Derek Woollins, J.","Phosphino-urea chemistry: preparation and structure of chelate and P‒N bond cleavage complexes","New Journal of Chemistry","2000","24","2","69","","10.1039/a908153d","","","0.71073","MoKα","","0.1161","0.0503","","0.3141","0.1149","","","","0.622","0.654","0.654","","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051246","11.6946","0.0003","15.4866","0.0004","18.5407","0.0003","76.184","0.001","71.834","0.001","72.806","0.001","3007.91","0.12","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C56 H58 Cl4 N4 O5 P4 Pd2 -","- C56 H58 Cl4 N4 O5 P4 Pd2 -","- C112 H116 Cl8 N8 O10 P8 Pd4 -","2","1","","Slawin, Alexandra M. Z.; Wainwright, Matthew; Derek Woollins, J.","Phosphino-urea chemistry: preparation and structure of chelate and P‒N bond cleavage complexes","New Journal of Chemistry","2000","24","2","69","","10.1039/a908153d","","","0.71073","MoKα","","0.0666","0.043","","0.1503","0.113","","","","1.022","1.072","1.072","","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051247","8.8316","0.0002","5.9003","0.0001","15.6123","0.0004","90","","90","","90","","813.54","0.03","150","","150","","","","","","","","","3","P b c a","-P 2ac 2ab","61","trans-1,4-Diethynyl-1,4-dihydroxy-2,5-cyclohexadiene","trans-1,4-Diethynyl-1,4-dihydroxy-2,5-cyclohexadiene","","- C10 H8 O2 -","- C10 H8 O2 -","- C40 H32 O8 -","4","0.5","","Laxmi Madhavi, N. N.; Bilton, Clair; Howard, Judith A. K.; Allen, Frank H.; Nangia, Ashwini; Desiraju, Gautam R.","Seeking structural repetitivity in systems with interaction interference: crystal engineering in the gem-alkynol family","New Journal of Chemistry","2000","24","1","1","","10.1039/a908233f","","","0.71073","MoKα","","0.041","0.0358","","","0.088","0.0947","","","","","","1.097","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051248","8.7684","0.0018","8.9558","0.0018","10.315","0.002","113.78","0.03","102.06","0.03","102.59","0.03","682.3","0.4","150","","150","","","","","","","","","3","P -1","-P 1","2","trans-9,10-Diethynyl-9,10-dihydroxy-9,10-dihydroanthracene","trans-9,10-Diethynyl-9,10-dihydroxy-9,10-dihydroanthracene","","- C18 H12 O2 -","- C18 H12 O2 -","- C36 H24 O4 -","2","1","","Laxmi Madhavi, N. N.; Bilton, Clair; Howard, Judith A. K.; Allen, Frank H.; Nangia, Ashwini; Desiraju, Gautam R.","Seeking structural repetitivity in systems with interaction interference: crystal engineering in the gem-alkynol family","New Journal of Chemistry","2000","24","1","1","","10.1039/a908233f","","","0.71073","MoKα","","0.0973","0.054","","","0.1084","0.133","","","","","","1.05","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051249","10.8247","0.0003","22.6384","0.0008","10.4783","0.0003","90","","118.185","0.001","90","","2263.28","0.12","150","","150","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","trans-1,4-Diethynyl-1,4-dihydroxy-1,4-dihydronaphthalene","trans-1,4-Diethynyl-1,4-dihydroxy-1,4-dihydronaphthalene","","- C14 H10 O2 -","- C14 H10 O2 -","- C112 H80 O16 -","8","2","","Laxmi Madhavi, N. N.; Bilton, Clair; Howard, Judith A. K.; Allen, Frank H.; Nangia, Ashwini; Desiraju, Gautam R.","Seeking structural repetitivity in systems with interaction interference: crystal engineering in the gem-alkynol family","New Journal of Chemistry","2000","24","1","1","","10.1039/a908233f","","","0.71073","MoKα","","0.1083","0.0596","","","0.1401","0.1597","","","","","","0.983","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051250","16.5","0.001","28.983","0.003","17.292","0.002","90","","109.52","0.01","90","","7794.1","1.4","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C86 H105 B Na O13 -","- C86 H102.346 B Na O13 -","- C344 H409.384 B4 Na4 O52 -","4","1","","Wickens, Joanna; Dryfe, Robert A. W.; Mair, Francis S.; Pritchard, Robin G.; Hayes, Roy; Arrigan, Damien W. M.","Calixarene-facilitated transfer of alkali metal ions across the polarised liquid‒liquid interface","New Journal of Chemistry","2000","24","3","149","","10.1039/a908257c","","","0.71073","MoKα","","0.202","0.0799","","","0.1277","0.1631","","","","","","0.935","","","","has coordinates,has disorder","180066","2020-10-21","18:00:00",""
"7051251","14.274","0.0008","14.214","0.0006","15.104","0.0006","90","","90","","90","","3064.5","0.2","293","2","293","2","","","","","","","","4","P 4/m n c","-P 4 2n","128","","","","- Cl8 Gd6 H72 O73 -","- Cl8 Gd6 O73 -","- Cl16 Gd12 O146 -","2","0.125","","Zhang, Da-Shun; Ma, Bao-Qing; Jin, Tian-Zhu; Gao, Song; Yan, Chun-Hua; Mak, Thomas C. W.","Oxo-centered regular octahedral lanthanide clusters","New Journal of Chemistry","2000","24","2","61","","10.1039/a908471a","","","0.71073","MoKα","","0.0793","0.0702","","","0.1726","0.1746","","","","","","1.194","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051252","14.5147","0.0007","14.5079","0.0007","15.2546","0.0008","90","","90","","90","","3212.3","0.3","293","2","293","2","","","","","","","","4","P 4/m n c","-P 4 2n","128","","","","- Cl8 H72 Nd6 O73 -","- Cl8 Nd6 O73 -","- Cl16 Nd12 O146 -","2","0.125","","Zhang, Da-Shun; Ma, Bao-Qing; Jin, Tian-Zhu; Gao, Song; Yan, Chun-Hua; Mak, Thomas C. W.","Oxo-centered regular octahedral lanthanide clusters","New Journal of Chemistry","2000","24","2","61","","10.1039/a908471a","","","0.71073","MoKα","","0.0445","0.0322","","","0.0827","0.0889","","","","","","0.977","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051253","18.628","0.019","11.548","0.013","19.43","0.02","90","","93.1","0.01","90","","4174","8","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C43 H35 Cl4 N O3 P2 Pd -","- C43 H35 Cl4 N O3 P2 Pd -","- C172 H140 Cl16 N4 O12 P8 Pd4 -","4","1","","Susana M. O. Quintal; Helena I. S. Nogueira; Vitor Félix; Michael G. B. Drew","Coordination modes of 3-hydroxypicolinic acid: synthesis and crystal structures of palladium(II), platinum(II) and rhenium(V) complexes","New J. Chem.","2000","24","7","511","517","10.1039/a908560b","","","0.71073","MoKα","","0.0887","0.0588","","","0.1554","0.1834","","","","","","0.836","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051254","11.002","0.014","12.641","0.014","16.825","0.018","112.24","0.01","93.52","0.01","104.51","0.01","2065","4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C43 H35 Cl4 N O3 P2 Pt -","- C43 H35 Cl4 N O3 P2 Pt -","- C86 H70 Cl8 N2 O6 P4 Pt2 -","2","1","","Susana M. O. Quintal; Helena I. S. Nogueira; Vitor Félix; Michael G. B. Drew","Coordination modes of 3-hydroxypicolinic acid: synthesis and crystal structures of palladium(II), platinum(II) and rhenium(V) complexes","New J. Chem.","2000","24","7","511","517","10.1039/a908560b","","","0.71073","MoKα","","0.0631","0.0438","","","0.0986","0.106","","","","","","1.08","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051255","8.116","0.009","15.241","0.017","21.061","0.024","90","","100.17","0.01","90","","2564","5","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C24 H19 I2 N O4 P Re -","- C24 H19 I2 N O4 P Re -","- C96 H76 I8 N4 O16 P4 Re4 -","4","1","","Susana M. O. Quintal; Helena I. S. Nogueira; Vitor Félix; Michael G. B. Drew","Coordination modes of 3-hydroxypicolinic acid: synthesis and crystal structures of palladium(II), platinum(II) and rhenium(V) complexes","New J. Chem.","2000","24","7","511","517","10.1039/a908560b","","","0.71073","MoKα","","0.0625","0.0431","","","0.1139","0.125","","","","","","1.088","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051256","10.7727","0.0014","7.5924","0.0009","21.775","0.003","90","","90","","90","","1781","0.4","123","2","123","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","5,10-Dihydrophenazine","","","- C12 H10 N2 -","- C12 H10 N2 -","- C96 H80 N16 -","8","1","","Thalladi, Venkat R.; Smolka, Tanja; Gehrke, Annette; Boese, Roland; Sustmann, Reiner","Role of weak hydrogen bonds in the crystal structures of phenazine, 5,10-dihydrophenazine and their 1:1 and 3:1 molecular complexes","New Journal of Chemistry","2000","24","3","143","","10.1039/a908744c","","","0.71073","MoKα","","0.0441","0.0349","","","0.0953","0.1017","","","","","","1.004","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051257","11.6466","0.0003","6.2335","0.0002","12.5573","0.0005","90","","97.612","0.002","90","","903.61","0.05","300","2","300","2","","","","","","","","3","I 1 2/a 1","-I 2ya","15","1:1 molecular complex of phenazine and 5,10-dihydrophenazine","","","- C24 H18 N4 -","- C24 H18 N4 -","- C48 H36 N8 -","2","0.25","","Thalladi, Venkat R.; Smolka, Tanja; Gehrke, Annette; Boese, Roland; Sustmann, Reiner","Role of weak hydrogen bonds in the crystal structures of phenazine, 5,10-dihydrophenazine and their 1:1 and 3:1 molecular complexes","New Journal of Chemistry","2000","24","3","143","","10.1039/a908744c","","","0.71073","MoKα","","0.062","0.0564","","","0.1517","0.1579","","","","","","1.104","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051258","9.0262","0.0015","9.6761","0.0015","11.2416","0.0018","72.522","0.002","80.196","0.003","77.597","0.003","908.7","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","3:1 molecular complex of phenazine and 5,10-dihydrophenazine","","","- C48 H34 N8 -","- C48 H34 N8 -","- C48 H34 N8 -","1","0.5","","Thalladi, Venkat R.; Smolka, Tanja; Gehrke, Annette; Boese, Roland; Sustmann, Reiner","Role of weak hydrogen bonds in the crystal structures of phenazine, 5,10-dihydrophenazine and their 1:1 and 3:1 molecular complexes","New Journal of Chemistry","2000","24","3","143","","10.1039/a908744c","","","0.71073","MoKα","","0.1112","0.0629","","","0.1579","0.2075","","","","","","1.013","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051259","10.8328","0.0012","24.56","0.002","17.0067","0.0015","90","","101.074","0.012","90","","4440.4","0.7","297","2","297","2","","","","","","","see text","6","P 1 21/c 1","-P 2ybc","14","","","","- C44 H40 F6 N P3 Ru -","- C44 H40 F6 N P3 Ru -","- C176 H160 F24 N4 P12 Ru4 -","4","1","","H. Brunner; C. Valério; M. Zabel","Optically active transition metal complexes. Part 123: new chiral half-sandwich ruthenium complexes, in which the arene ligand is tethered to a PN ligand","New J. Chem.","2000","24","5","275","279","10.1039/a909262e","","","0.71073","MoKα","","0.1849","0.0573","","","0.1154","0.1536","","","","","","0.843","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051260","10.9743","0.0011","12.4718","0.0014","21.493","0.003","92.052","0.014","94.429","0.014","91.384","0.013","2930","0.6","297","2","297","2","","","","","","","see text","7","P -1","-P 1","2","","","","- C58 H55 F6 N O P4 Ru -","- C58 H55 F6 N O P4 Ru -","- C116 H110 F12 N2 O2 P8 Ru2 -","2","1","","H. Brunner; C. Valério; M. Zabel","Optically active transition metal complexes. Part 123: new chiral half-sandwich ruthenium complexes, in which the arene ligand is tethered to a PN ligand","New J. Chem.","2000","24","5","275","279","10.1039/a909262e","","","0.71073","MoKα","","0.16","0.0847","","","0.1836","0.2124","","","","","","0.846","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051261","11.931","0.007","11.105","0.011","8.929","0.005","90","","90.96","0.04","90","","1182.9","1.5","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C5 H8 B N O -","- C5 H8 B N O -","- C40 H64 B8 N8 O8 -","8","1","","Gerald Lesley, M. J.; Norman, Nicholas C.; Guy Orpen, A.; Starbuck, Jonathan","Synthetic routes to cyclic and unsymmetric diborane(4) compounds","New Journal of Chemistry","2000","24","3","115","","10.1039/a909645k","","","0.71073","MoKα","","0.0659","0.0402","","","0.092","0.1063","","","","","","1.001","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051262","13.3492","0.0007","25.9398","0.0013","13.5326","0.0008","90","","118.966","0.0015","90","","4099.8","0.4","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C30 H99 Cl5 Gd4 N6 O52 -","- C30 H47 Cl5 Gd4 N6 O52 -","- C60 H94 Cl10 Gd8 N12 O104 -","2","1","","Ma, Bao-Qing; Zhang, Da-Shun; Gao, Song; Jin, Tian-Zhu; Yan, Chun-Hua","The formation of Gd4O4 cubane cluster controlled by L-valine","New Journal of Chemistry","2000","24","5","251","","10.1039/a910181k","","","0.71073","MoKα","","0.1156","0.0769","","","0.1873","0.2174","","","","","","1.065","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051263","12.8116","0.0002","12.1494","0.0002","18.2432","0.0002","90","","107.197","0.001","90","","2712.67","0.07","213","2","213","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C29 H21 N3 O10 S -","- C29 H21 N3 O10 S -","- C116 H84 N12 O40 S4 -","4","1","","Christopher Pigge, F.; Zheng, Zhanmiao; Rath, Nigam P.","1,3,5-Triaroylbenzenes as versatile inclusion hosts via C‒H···O hydrogen bonding","New Journal of Chemistry","2000","24","4","183","","10.1039/a910190j","","","0.71073","MoKα","","0.0629","0.038","","","0.0845","0.0929","","","","","","1.025","","","","has coordinates,has disorder","180066","2020-10-21","18:00:00",""
"7051264","9.7093","0.0001","10.3943","0.0002","14.4467","0.0002","83.177","0.001","84.037","0.001","73.265","0.001","1382.62","0.04","213","2","213","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H17 Cl2 N3 O9 -","- C28 H17 Cl2 N3 O9 -","- C56 H34 Cl4 N6 O18 -","2","1","","Christopher Pigge, F.; Zheng, Zhanmiao; Rath, Nigam P.","1,3,5-Triaroylbenzenes as versatile inclusion hosts via C‒H···O hydrogen bonding","New Journal of Chemistry","2000","24","4","183","","10.1039/a910190j","","","0.71073","MoKα","","0.103","0.0665","","","0.1956","0.2276","","","","","","1.024","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051265","17.788","0.004","10.706","0.002","18.56","0.004","90","","113.37","0.03","90","","3244.6","1.4","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C6 H0 Cl4 Eu2 N2 O34 P2 -","- C6 Cl4 Eu2 N2 O34 P2 -","- C24 Cl16 Eu8 N8 O136 P8 -","4","1","","Gałdecka, Ewa; Gałdecki, Zdzislaw; Gawryszewska, Paula; Legendziewicz, Janina","Structure of a novel polynuclear europium compound with N-phosphonomethylglycine: heptaaquaperchloratodi-μ4-N-phosphonomethylglycine-dieuropium(III) triperchlorate monohydrate, [Eu2(HO3PCH2NH2CH2CO2)2(H2O)7(ClO4)]·3ClO4·H2O","New Journal of Chemistry","2000","24","6","387","","10.1039/b000230p","","","0.71073","MoKα","","0.1239","0.0656","","","0.1614","0.2104","","","","","","0.959","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051266","6.6655","0.0002","16.4067","0.0005","12.7938","0.0001","90","","94.307","0.002","90","","1395.16","0.06","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C15 H14 N2 O3 -","- C15 H14 N2 O3 -","- C60 H56 N8 O12 -","4","1","","Bermejo, Manuel R.; González, Ana M.; Fondo, Matilde; García-Deibe, Ana; Maneiro, Marcelino; Sanmartín, Jesús; Hoyos, Olga L.; Watkinson, Michael","A direct route to obtain manganese(III) complexes with a new class of asymmetrical Schiff base ligands","New Journal of Chemistry","2000","24","4","235","","10.1039/b000235f","","","0.71073","MoKα","","0.1253","0.0584","","0.159","0.1288","","","","0.959","1.114","1.114","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051267","14.056","0.005","17.494","0.003","14.397","0.004","90","","109.49","0.02","90","","3337.3","1.7","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","[Cu(Ph-protach)(SO4)(0.5CH3OH)], (1)","cis,cis-1,3,5-(E,E)-tri(phenyl-propenylideneamino)cyclohexane copper sulfate, (1) {tri(phenyl-propenylideneamino)cyclohexane = (Ph-protach)}","","- C34.5 H39 Cu N3 O5.5 S -","- C34.5 H39 Cu N3 O5.5 S -","- C138 H156 Cu4 N12 O22 S4 -","4","1","","Greener, Bryan; Foxon, Simon P.; Walton, Paul H.","Syntheses and structures of a range of metal complexes with the ligand cis,cis-1,3,5-(E,E)-tris(phenylpropenylideneamino)cyclohexane","New Journal of Chemistry","2000","24","5","269","","10.1039/b000441n","","x-ray","0.71069","MoKα","","0.1043","0.0493","","","0.1207","0.1487","","","","","","1.023","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7051268","15.579","0.003","16.549","0.003","19.916","0.002","90","","109.335","0.01","90","","4845.1","1.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[Ni(Ph-protach)(Cl)]BPh4, (2)","cis,cis-1,3,5-(E,E)-tri(phenyl-propenylideneamino)cyclohexane nickel(II) chloride tetraphenylborate, (2) {tri(phenyl-propenylideneamino)cyclohexane = (Ph-protach)}","","- C57 H53 B Cl N3 Ni -","- C57 H53 B Cl N3 Ni -","- C228 H212 B4 Cl4 N12 Ni4 -","4","1","","Greener, Bryan; Foxon, Simon P.; Walton, Paul H.","Syntheses and structures of a range of metal complexes with the ligand cis,cis-1,3,5-(E,E)-tris(phenylpropenylideneamino)cyclohexane","New Journal of Chemistry","2000","24","5","269","","10.1039/b000441n","","x-ray","0.71069","MoKα","","0.1229","0.0504","","","0.1328","0.1934","","","","","","1.026","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051269","15.222","0.01","19.097","0.009","10.784","0.01","99.61","0.06","103.87","0.07","76.73","0.04","2941","4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","[Zn(Ph-protach)(Cl)]BPh4, (3)","cis,cis-1,3,5-(E,E)-tri(phenyl-propenylideneamino)cyclohexane zinc(II) chloride tetraphenylborate, (3) {tri(phenyl-propenylideneamino)cyclohexane = (Ph-protach)}","","- C60 H59 B Cl7 N3 Zn -","- C60 H59 B Cl7 N3 Zn -","- C120 H118 B2 Cl14 N6 Zn2 -","2","1","","Greener, Bryan; Foxon, Simon P.; Walton, Paul H.","Syntheses and structures of a range of metal complexes with the ligand cis,cis-1,3,5-(E,E)-tris(phenylpropenylideneamino)cyclohexane","New Journal of Chemistry","2000","24","5","269","","10.1039/b000441n","","x-ray","0.71069","MoKα","","0.1414","0.0733","","","0.1853","0.2276","","","","","","0.986","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051270","15.642","0.003","17.746","0.004","10.348","0.003","99.861","0.019","105.154","0.017","76.486","0.015","2677.1","1.1","296","2","296","2","","","","","","","","6","P -1","-P 1","2","[Cd(Ph-protach)(NO3)(CH3OH)]BPh4, (4)","cis,cis-1,3,5-(E,E)-tri(phenyl-propenylideneamino)cyclohexane cadmium(II) nitrate tetraphenylborate, (4) {tri(phenyl-propenylideneamino)cyclohexane = (Ph-protach)}","","- C59 H61 B Cd N4 O5 -","- C59 H61 B Cd N4 O5 -","- C118 H122 B2 Cd2 N8 O10 -","2","1","","Greener, Bryan; Foxon, Simon P.; Walton, Paul H.","Syntheses and structures of a range of metal complexes with the ligand cis,cis-1,3,5-(E,E)-tris(phenylpropenylideneamino)cyclohexane","New Journal of Chemistry","2000","24","5","269","","10.1039/b000441n","","x-ray","0.7107","MoKα","","0.0533","0.0323","","","0.0806","0.0965","","","","","","1.079","","","","has coordinates,has disorder","180066","2020-10-21","18:00:00",""
"7051271","15.835","0.002","17.762","0.002","14.503","0.002","113.53","0.01","103.169","0.01","88.58","0.01","3631.6","0.9","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","","","- C83 H105 N4 O P Zn -","- C83 H105 N4 O P Zn -","- C166 H210 N8 O2 P2 Zn2 -","2","1","","Darling, Scott L.; Stulz, Eugen; Feeder, Neil; Bampos, Nick; Sanders, Jeremy K. M.","Phosphine-substituted porphyrins as supramolecular building blocks","New Journal of Chemistry","2000","24","5","261","","10.1039/b000482k","","","0.71073","MoKα","","0.1553","0.104","","","0.2676","0.3015","","","","","","1.082","","","","has coordinates,has disorder","180066","2020-10-21","18:00:00",""
"7051272","7.4376","0.0003","8.9729","0.0004","11.9365","0.0005","73.754","0.002","83.435","0.002","66.728","0.002","702.56","0.05","100","1","100","1","","","","","","","","5","P -1","-P 1","2","","","","- C16 H16 B Fe P -","- C16 H16 B Fe P -","- C32 H32 B2 Fe2 P2 -","2","1","","Evans, Chris E. B.; Lough, Alan J.; Grondey, Hiltrud; Manners, Ian","Synthesis, structure and polymerization behaviour of borane adducts of a phosphorus-bridged [1]ferrocenophane, [(η-C5H4)2FePPh]","New Journal of Chemistry","2000","24","6","447","","10.1039/b000935k","","","0.71073","MoKα","","0.0328","0.0282","","","0.0731","0.0764","","","","","","1.1","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051273","21.7419","0.0003","16.3501","0.0004","24.7136","0.0005","90","","90","","90","","8785.2","0.3","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C36 H90 P4 Ru2 -","- C36 H90 P4 Ru2 -","- C288 H720 P32 Ru16 -","8","1","","Evans, Chris E. B.; Lough, Alan J.; Grondey, Hiltrud; Manners, Ian","Synthesis, structure and polymerization behaviour of borane adducts of a phosphorus-bridged [1]ferrocenophane, [(η-C5H4)2FePPh]","New Journal of Chemistry","2000","24","6","447","","10.1039/b000935k","","","0.71073","MoKα","","0.0736","0.0391","","","0.085","0.0936","","","","","","1.024","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051274","10.778","0.002","11.882","0.002","13.83","0.002","81.079","0.013","89.136","0.014","64.835","0.014","1581.1","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H28 N4 Ni O2 S4 -","- C32 H28 N4 Ni O2 S4 -","- C64 H56 N8 Ni2 O4 S8 -","2","1","","Zhu, Xu-Hui; Chen, Xiao-Feng; Zhang, Yong; You, Xiao-Zeng; Tan, Wei-Lian; Ji, Wei; Vittal, Jaganese J.; Tan, Goek-Kheng; Kennard, Colin H. L.","Crystal structures, molecular packing and picosecond optical limiting properties of quadridentate Schiff base divalent metal complexes derived from S-benzyl dithiocarbazate","New Journal of Chemistry","2000","24","6","419","","10.1039/b000960l","","","0.71073","MoKα","","0.0639","0.052","","0.1596","0.1477","","","","1.071","1.101","1.101","","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051275","10.7838","0.0006","11.1477","0.0006","14.6503","0.0008","81.72","0.001","84.405","0.001","66.35","0.001","1594.91","0.15","293","2","293","2","","","","","","","see text","6","P -1","-P 1","2","","","","- C32 H28 N4 O2 Pd S4 -","- C32 H28 N4 O2 Pd S4 -","- C64 H56 N8 O4 Pd2 S8 -","2","1","","Zhu, Xu-Hui; Chen, Xiao-Feng; Zhang, Yong; You, Xiao-Zeng; Tan, Wei-Lian; Ji, Wei; Vittal, Jaganese J.; Tan, Goek-Kheng; Kennard, Colin H. L.","Crystal structures, molecular packing and picosecond optical limiting properties of quadridentate Schiff base divalent metal complexes derived from S-benzyl dithiocarbazate","New Journal of Chemistry","2000","24","6","419","","10.1039/b000960l","","","0.71073","MoKα","","0.0458","0.0354","","0.0861","0.0806","","","","1.037","1.059","1.059","","","","","has coordinates,has disorder","180066","2020-10-21","18:00:00",""
"7051276","12.054","0.003","24.13","0.003","12.213","0.003","90","","92.25","0.02","90","","3549.6","1.3","294","","294","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C40 H34 I O2 P2 Rh -","- C40 H34 I O2 P2 Rh -","- C160 H136 I4 O8 P8 Rh4 -","4","1","","Pierre Braunstein; Yves Chauvin; Jean Fischer; Hélène Olivier; Carsten Strohmann; Dawn V. Toronto","Oxidative addition of iodine, iodomethane and iodobenzene to the rhodium phosphino enolate complex[Rh{Ph2PCHC(O)Ph}(CO)(PPh3)] and carbon monoxide insertion into the resulting Rh‒carbon bond of [Rh{Ph2PCHC(O)Ph}Me(I)(CO)(PPh3)]","New J. Chem.","2000","24","6","437","445","10.1039/b000961j","","","0.71073","Mo-Kα","","0.091","0.039","","0.149","","0.055","","","2.97","","","1.088","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051277","17.887","0.005","18.538","0.005","11.515","0.003","90","","90","","90","","3818.2","1.8","294","","294","","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C45 H36 I O2 P2 Rh -","- C45 H36 I O2 P2 Rh -","- C180 H144 I4 O8 P8 Rh4 -","4","1","","Pierre Braunstein; Yves Chauvin; Jean Fischer; Hélène Olivier; Carsten Strohmann; Dawn V. Toronto","Oxidative addition of iodine, iodomethane and iodobenzene to the rhodium phosphino enolate complex[Rh{Ph2PCHC(O)Ph}(CO)(PPh3)] and carbon monoxide insertion into the resulting Rh‒carbon bond of [Rh{Ph2PCHC(O)Ph}Me(I)(CO)(PPh3)]","New J. Chem.","2000","24","6","437","445","10.1039/b000961j","","","0.71073","Mo-Kα","","0.038","0.022","","0.037","","0.027","","","1.408","","","1.065","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7051278","13.864","0.003","8.859","0.002","29.696","0.006","90","","101.27","0.03","90","","3577","1.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C41 H36 O2.5 P2 Rh -","- C41 H36 O2.5 P2 Rh -","- C164 H144 O10 P8 Rh4 -","4","1","","Pierre Braunstein; Yves Chauvin; Jean Fischer; Hélène Olivier; Carsten Strohmann; Dawn V. Toronto","Oxidative addition of iodine, iodomethane and iodobenzene to the rhodium phosphino enolate complex[Rh{Ph2PCHC(O)Ph}(CO)(PPh3)] and carbon monoxide insertion into the resulting Rh‒carbon bond of [Rh{Ph2PCHC(O)Ph}Me(I)(CO)(PPh3)]","New J. Chem.","2000","24","6","437","445","10.1039/b000961j","","","0.71073","MoKα","","0.0453","0.0365","","0.1066","0.0916","","","","1.053","1.077","1.077","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051279","15.197","0.001","5.808","0.002","19.5635","0.0009","90","","95.321","0.005","90","","1719.3","0.6","296.2","","296.2","","","","","","","","preparation","4","P 1 21/c 1","-P 2ybc","14","4f","","","- C19 H17 N O5 -","- C20 H17 N O5 -","- C80 H68 N4 O20 -","4","1","","Itoh, Kuniaki; Kishimoto, Shigehisa","The reaction of β-nitrostyrenes with 2-methoxyfuran: a novel formation of isoxazoline N-oxide together with Michael adducts","New Journal of Chemistry","2000","24","6","347","","10.1039/b001049i","","","0.7107","MoKα","","","0.0553","","","0.0453","","","","","1.479","1.479","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051280","12.064","0.003","12.797","0.002","9.794","0.003","102.99","0.02","97.17","0.02","68.7","0.02","1371.1","0.6","20","","20","","","","","","","","","3","P -1","-P 1","2","","","","?","- C72 H60 N4 -","- C72 H60 N4 -","","","","Yao, Min-Liang; Deng, Min-Zhi","A practical approach to stereodefined cyclopropyl-substituted heteroarenes using a Suzuki-type reaction","New Journal of Chemistry","2000","24","6","425","","10.1039/b001051k","","","0.7107","MoKalpha","","","0.041","","","0.045","","","","","1.39","1.39","","","","","has coordinates","288156","2023-12-07","18:40:59",""
"7051281","7.994","0.001","21.67","0.003","14.741","0.003","90","","101.91","0.01","90","","2498.6","0.7","294","","294","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N'-bis(3,5-dinitrophenyl)-3,6,9-trioxaundecanedicarboxamide","","- C20 H22 N6 O14 -","- C20 H22 N6 O14 -","- C80 H88 N24 O56 -","4","1","","Sylvie Meyer; Rémy Louis; Bernard Metz; Yvette Agnus; Alexandre Varnek; Maurice Gross","Unprecedented role of water in self-assembly of potential molecular tweezers","New J. Chem.","2000","24","6","371","376","10.1039/b001127o","","","1.54056","Cu-Kα","","0.094","0.049","","","","0.045","","","","","","0.947","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051282","11.318","0.002","24.444","0.005","11.069","0.001","96.17","0.01","101.24","0.01","77.23","0.02","2922.6","0.9","294","","294","","","","","","","","","4","P -1","-P 1","2","","N,N'-bis(3,5-dimethylisophtalate)-3,6,9-trioxaundecanedicarboxamide","","- C56 H66 N4 O27 -","- C56 H66 N4 O27 -","- C112 H132 N8 O54 -","2","1","","Sylvie Meyer; Rémy Louis; Bernard Metz; Yvette Agnus; Alexandre Varnek; Maurice Gross","Unprecedented role of water in self-assembly of potential molecular tweezers","New J. Chem.","2000","24","6","371","376","10.1039/b001127o","","","1.54056","Cu-Kα","","0.109","0.052","","","","0.059","","","","","","0.999","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051283","13.43","0.001","13.748","0.001","18.444","0.001","88.31","0.003","70.157","0.003","62.542","0.003","2809.3","0.3","20","2","20","2","","","","","","","","4","P -1","-P 1","2","","","","- C37 H31 O P -","- C37 H31 O P -","- C148 H124 O4 P4 -","4","2","","Matthew G. Davidson; Andrés E. Goeta; Judith A. K. Howard; Sarah Lamb; Sax A. Mason","The shortest C‒H···O hydrogen bonds yet determined by single crystal neutron diffraction: a structural study of two phosphonium aryloxides","New J. Chem.","2000","24","7","477","479","10.1039/b001433h","","neutron","1.3137","neutron","","0.0486","0.044","","0.1319","0.1264","","","","1.133","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051284","18.57","0.001","17.22","0.001","19.03","0.001","90","","90","","90","","6085.3","0.6","20","2","20","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C35 H43 O P -","- C35 H43 O P -","- C280 H344 O8 P8 -","8","1","","Matthew G. Davidson; Andrés E. Goeta; Judith A. K. Howard; Sarah Lamb; Sax A. Mason","The shortest C‒H···O hydrogen bonds yet determined by single crystal neutron diffraction: a structural study of two phosphonium aryloxides","New J. Chem.","2000","24","7","477","479","10.1039/b001433h","","neutron","1.3137","neutron","","0.0443","0.0357","","0.0738","0.0713","","","","","","","1.171","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051285","15.7749","0.0003","18.8326","0.0003","19.4901","0.0004","90","","90","","90","","5790.17","0.19","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C31 H27 N O P2 Se2 -","- C31 H27 N O P2 Se2 -","- C248 H216 N8 O8 P16 Se16 -","8","1","","Gaw, Kirsty G.; Smith, Martin B.; Slawin, Alexandra M. Z.","Molybdenum(0), ruthenium(II), palladium(II), platinum(II), copper(I) and gold(I) complexes of a new methoxy functionalised bis(phosphino)amine: synthesis and structure","New Journal of Chemistry","2000","24","6","429","","10.1039/b001458n","","","0.71073","MoKα","","0.0915","0.0336","","0.0786","0.0611","","","","0.83","0.951","0.951","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051286","11.8731","0.0003","14.3704","0.0003","21.5491","0.0005","90","","98.502","0.001","90","","3636.33","0.15","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C32 H28.5 Cl4.5 N O P2 Pd -","- C32 H27.5 Cl4.5 N O P2 Pd -","- C128 H110 Cl18 N4 O4 P8 Pd4 -","4","1","","Gaw, Kirsty G.; Smith, Martin B.; Slawin, Alexandra M. Z.","Molybdenum(0), ruthenium(II), palladium(II), platinum(II), copper(I) and gold(I) complexes of a new methoxy functionalised bis(phosphino)amine: synthesis and structure","New Journal of Chemistry","2000","24","6","429","","10.1039/b001458n","","","0.71073","MoKα","","0.1063","0.0559","","0.2341","0.1564","","","","0.849","0.84","0.84","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051287","15.0814","0.0006","9.2086","0.0004","25.0051","0.0009","90","","98.384","0.001","90","","3435.6","0.2","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C31.5 H27.5 Cl3.5 N O P2 Pt S -","- C31.5 H27.5 Cl3.5 N O P2 Pt S -","- C126 H110 Cl14 N4 O4 P8 Pt4 S4 -","4","1","","Gaw, Kirsty G.; Smith, Martin B.; Slawin, Alexandra M. Z.","Molybdenum(0), ruthenium(II), palladium(II), platinum(II), copper(I) and gold(I) complexes of a new methoxy functionalised bis(phosphino)amine: synthesis and structure","New Journal of Chemistry","2000","24","6","429","","10.1039/b001458n","","","0.71073","MoKα","","0.0364","0.0261","","0.1131","0.0752","","","","0.787","0.806","0.806","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051288","9.0732","0.0001","18.9395","0.0002","19.2823","0.0001","90","","96.862","0.001","90","","3289.77","0.05","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C35 H27 Mo N O5 P2 -","- C35 H27 Mo N O5 P2 -","- C140 H108 Mo4 N4 O20 P8 -","4","1","","Gaw, Kirsty G.; Smith, Martin B.; Slawin, Alexandra M. Z.","Molybdenum(0), ruthenium(II), palladium(II), platinum(II), copper(I) and gold(I) complexes of a new methoxy functionalised bis(phosphino)amine: synthesis and structure","New Journal of Chemistry","2000","24","6","429","","10.1039/b001458n","","","0.71073","MoKα","","0.0289","0.0209","","0.0736","0.0563","","","","0.943","0.966","0.966","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"7051289","11.15","0.0002","30.8735","0.0004","17.2571","0.0003","90","","94.393","0.001","90","","5923.12","0.17","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C62 H54 Cu F6 N2 O2 P5 -","- C62 H54 Cu F6 N2 O2 P5 -","- C248 H216 Cu4 F24 N8 O8 P20 -","4","1","","Gaw, Kirsty G.; Smith, Martin B.; Slawin, Alexandra M. Z.","Molybdenum(0), ruthenium(II), palladium(II), platinum(II), copper(I) and gold(I) complexes of a new methoxy functionalised bis(phosphino)amine: synthesis and structure","New Journal of Chemistry","2000","24","6","429","","10.1039/b001458n","","","0.71073","MoKα","","0.1745","0.0578","","0.2015","0.1269","","","","0.963","1.01","1.01","","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051290","9.535","0.002","12.52","0.003","17.012","0.003","71.89","0.03","81.55","0.03","68.9","0.03","1799.4","0.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H48 Ho N13 O15 -","- C21 H42 Ho N13 O15 -","- C42 H84 Ho2 N26 O30 -","2","1","","Mondry, Anna; Starynowicz, Przemysław","Structure and optical spectroscopy of holmium(III) triethylenetetraaminehexaacetate in single crystal and in solution","New Journal of Chemistry","2000","24","8","603","","10.1039/b001480j","","","0.71073","MoKα","","0.0388","0.0351","","","0.1021","0.1022","","","","","","5.609","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051291","11.818","0.002","23.435","0.005","21.975","0.004","90","","96.92","0.03","90","","6042","2","299","1","299","1","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C58 H67 Cl Li4 N4 O10 Zn -","- C58 H67 Cl Li4 N4 O10 Zn -","- C232 H268 Cl4 Li16 N16 O40 Zn4 -","4","1","","Sobota, Piotr; Klimowicz, Maria; Utko, Józef; Jerzykiewicz, Lucjan B.","Syntheses and crystal structure of [Li4Zn(μ3,η2-ddbfo)2(μ,η2-ddbfo)3Cl(CH3CN)2]·2CH3CN, [Na4(μ,η2-ddbfo)4(CH3CN)4] and [Zn2(μ,η1-ddbfo)2Cl2(py)2] aggregates","New Journal of Chemistry","2000","24","7","523","","10.1039/b001832p","","","0.71073","MoKα","","0.0736","0.0387","","","0.1057","0.117","","","","","","1.084","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051292","9.988","0.002","18.643","0.004","28.848","0.006","84.29","0.03","84.32","0.03","76","0.03","5171","2","298","1","298","1","","","","","","","","5","P -1","-P 1","2","","","","- C96 H112 N8 Na8 O16 -","- C96 H112 N8 Na8 O16 -","- C192 H224 N16 Na16 O32 -","2","1","","Sobota, Piotr; Klimowicz, Maria; Utko, Józef; Jerzykiewicz, Lucjan B.","Syntheses and crystal structure of [Li4Zn(μ3,η2-ddbfo)2(μ,η2-ddbfo)3Cl(CH3CN)2]·2CH3CN, [Na4(μ,η2-ddbfo)4(CH3CN)4] and [Zn2(μ,η1-ddbfo)2Cl2(py)2] aggregates","New Journal of Chemistry","2000","24","7","523","","10.1039/b001832p","","","0.71073","MoKα","","0.0621","0.0395","","","0.1069","0.1183","","","","","","1.101","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051293","9.855","0.004","8.836","0.005","18.068","0.006","90","","99.99","0.04","90","","1549.5","1.2","299","1","299","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C15 H16 Cl N O2 Zn -","- C15 H16 Cl N O2 Zn -","- C60 H64 Cl4 N4 O8 Zn4 -","4","1","","Sobota, Piotr; Klimowicz, Maria; Utko, Józef; Jerzykiewicz, Lucjan B.","Syntheses and crystal structure of [Li4Zn(μ3,η2-ddbfo)2(μ,η2-ddbfo)3Cl(CH3CN)2]·2CH3CN, [Na4(μ,η2-ddbfo)4(CH3CN)4] and [Zn2(μ,η1-ddbfo)2Cl2(py)2] aggregates","New Journal of Chemistry","2000","24","7","523","","10.1039/b001832p","","","0.71073","MoKα","","0.0472","0.0261","","","0.0755","0.0809","","","","","","1.064","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051294","11.494","0.003","25.328","0.003","6.1281","0.0005","90","","90","","90","","1784","0.5","288.2","","288.2","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H27 N2 O3 -","- C18 H27 N2 O3 -","- C72 H108 N8 O12 -","4","1","","Kumagai, Hitoshi; Hosokoshi, Yuko; Markosyan, Ashot S.; Inoue, Katsuya","Synthesis and magnetic properties of a new complex made up of Mn(hfac)2 and a radical with a triplet ground state","New Journal of Chemistry","2000","24","7","537","","10.1039/b001840f","","","0.7107","MoKα","","0.0764","0.0669","","0.0855","0.083","","","","2.047","1.986","1.986","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051295","14.081","0.001","15.94","0.0011","16.0751","0.001","90","","90","","90","","3608.1","0.4","298","","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C28 H29 F12 Mn N2 O7 -","- C28 H29 F12 Mn N2 O7 -","- C112 H116 F48 Mn4 N8 O28 -","4","1","","Kumagai, Hitoshi; Hosokoshi, Yuko; Markosyan, Ashot S.; Inoue, Katsuya","Synthesis and magnetic properties of a new complex made up of Mn(hfac)2 and a radical with a triplet ground state","New Journal of Chemistry","2000","24","7","537","","10.1039/b001840f","","","0.71073","MoKα","","0.1584","0.069","","","0.1692","0.21","","","","","","0.859","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051296","13.7248","0.0019","13.7248","0.0019","10.859","0.002","90","","90","","90","","2045.4","0.6","123","2","123","2","","","","","","","","3","I -4","I -4","82","Methylpyrazine","","","- C5 H6 N2 -","- C5 H6 N2 -","- C80 H96 N32 -","16","2","","","","New Journal of Chemistry","2000","","","","","10.1039/b001843k","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051297","7.8108","0.0014","6.5509","0.0014","12.164","0.003","90","","108.613","0.014","90","","589.9","0.2","183","2","183","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","2,3-Dimethylpyrazine","","","- C6 H8 N2 -","- C6 H8 N2 -","- C24 H32 N8 -","4","1","","","","New Journal of Chemistry","2000","","","","","10.1039/b001843k","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051298","5.7021","0.001","5.048","0.002","10.664","0.0016","90","","104.549","0.015","90","","297.12","0.14","183","2","183","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","2,5-Dimethylpyrazine","","","- C6 H8 N2 -","- C6 H8 N2 -","- C12 H16 N4 -","2","0.5","","","","New Journal of Chemistry","2000","","","","","10.1039/b001843k","","","","","","","","","","","","","","","","","","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051299","7.5568","0.0001","10.8552","0.0001","7.4451","0.0001","90","","90.525","0.001","90","","610.7","0.013","183","2","183","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","2,6-Dimethylpyrazine","","","- C6 H8 N2 -","- C6 H8 N2 -","- C24 H32 N8 -","4","1","","","","New Journal of Chemistry","2000","","","","","10.1039/b001843k","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051300","9.1439","0.0017","10.243","0.002","15.212","0.003","90","","95.546","0.014","90","","1418.1","0.4","183","2","183","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Trimethylpyrazine","","","- C7 H10 N2 -","- C7 H10 N2 -","- C56 H80 N16 -","8","2","","","","New Journal of Chemistry","2000","","","","","10.1039/b001843k","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","180067","2020-10-21","18:00:00",""
"7051301","7.696","0.0001","7.781","0.0004","25.554","0.001","90","","90.239","0.001","90","","1530.2","0.2","294","","294","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H34 Fe2 N4 O8 -","- C32 H32 Fe2 N4 O8 -","- C64 H64 Fe4 N8 O16 -","2","0.5","","Dupont Karl","","New Journal of Chemistry","2000","","","","","10.1039/b002061n","","","","","","","","","","","","","","","","","","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051302","17.345","0.0004","13.816","0.0003","10.513","0.0003","90","","90","","90","","2519.3","0.2","294","","294","","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C24 H36 Fe N4 O6 -","- C24 H24 Fe0.5 N4 O6 -","- C96 H96 Fe2 N16 O24 -","4","0.5","","","","New Journal of Chemistry","2000","","","","","10.1039/b002061n","","","","","","","","","","","","","","","","","","","","","has coordinates","277873","2022-09-15","11:31:04",""
"7051303","5.799","0.008","9.962","0.007","11.54","0.02","102.12","0.08","104","0.1","103.66","0.08","602.8","1.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H30 Fe N4 O7 -","- C22 H28 Fe N4 O7 -","- C22 H28 Fe N4 O7 -","1","0.5","","","","New Journal of Chemistry","2000","","","","","10.1039/b002061n","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051304","11.91","0.01","10.623","0.005","13.516","0.009","90","","107.96","0.08","90","","1626.7","1.9","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H38 Fe2 N4 O8 -","- C34 H38 Fe2 N4 O8 -","- C68 H76 Fe4 N8 O16 -","2","0.5","","","","New Journal of Chemistry","2000","","","","","10.1039/b002061n","","","","","","","","","","","","","","","","","","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051305","5.768","0.0006","10.553","0.001","11.536","0.001","109.374","0.001","94.184","0.001","90.998","0.001","660","0.2","173","","173","","","","","","","","","5","P -1","-P 1","2","","","","- C22 H36 Fe N4 O10 -","- C22 H26 Fe0.5 N4 O10 -","- C22 H26 Fe0.5 N4 O10 -","1","0.5","","","","New Journal of Chemistry","2000","","","","","10.1039/b002061n","","","","","","","","","","","","","","","","","","","","","has coordinates","277873","2022-09-15","11:31:04",""
"7051306","13.559","0.002","14.745","0.003","16.186","0.001","90","","111.93","0.02","90","","3001.9","0.9","293","2","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C33 H29 Mn N3 O8 -","- C33 H29 Mn N3 O8 -","- C132 H116 Mn4 N12 O32 -","4","1","","Liliana Strinna Erre; Giovanni Micera; Eugenio Garribba; Attila Cs. Bényei","Molecular structure and spectral properties of bis(2,6-dimethoxybenzoato)(2,2':6',2″-terpyridine)manganese(II): a five-coordinate Mn(II) complex","New J. Chem.","2000","24","9","725","728","10.1039/b002119i","","","0.71073","MoKα","","","0.0588","","","0.1085","0.1475","","","","1.112","1.112","1.015","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051307","31.169","0.0013","5.462","0.0002","19.627","0.0008","90","","102.81","","90","","3258.2","0.2","293","2","293","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","1,7,10,16-Tetraoxa-4,13-diazacyclo-octadecane 1,8-diiodoperfluorooctane","","- C20 H26 F16 I2 N2 O4 -","- C20 H26 F16 I2 N2 O4 -","- C80 H104 F64 I8 N8 O16 -","4","0.5","","Navarrini, Walter; Metrangolo, Pierangelo; Pilati, Tullio; Resnati, Giuseppe","Crown ethers as pre-organised exo-receptors in the divergent recognition of α,ω-diiodoperfluoroalkanes","New Journal of Chemistry","2000","24","10","777","","10.1039/b002247k","","","0.71069","MoKα","","0.0572","0.0413","","","0.1153","0.1242","","","","","","1.06","","","","has coordinates,has disorder","180067","2020-10-21","18:00:00",""
"7051308","11.972","0.002","11.775","0.001","13.022","0.002","90","","100.92","0.01","90","","1802.5","0.4","296.2","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H14 Cu N4 O7 -","- C18 H14 Cu N4 O7 -","- C72 H56 Cu4 N16 O28 -","4","1","","Ezuhara, Takayoshi; Endo, Ken; Matsuda, Kenji; Aoyama, Yasuhiro","One-dimensional chains consisting of copper(II) ions and an orthogonal anthracene-pyrimidine derivative: hierarchical formation of high-dimensional networks and their magnetic properties","New Journal of Chemistry","2000","24","8","609","","10.1039/b002315i","","","0.7107","MoKα","","","0.043","","","","0.0567","","","","","","1.043","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051309","13.734","0.004","7.248","0.003","22.423","0.003","90","","95.75","0.02","90","","2220.8","1.2","296.2","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H24 Cu N4 O8 -","- C22 H24 Cu N4 O8 -","- C88 H96 Cu4 N16 O32 -","4","1","","Ezuhara, Takayoshi; Endo, Ken; Matsuda, Kenji; Aoyama, Yasuhiro","One-dimensional chains consisting of copper(II) ions and an orthogonal anthracene-pyrimidine derivative: hierarchical formation of high-dimensional networks and their magnetic properties","New Journal of Chemistry","2000","24","8","609","","10.1039/b002315i","","","0.7107","MoKα","","","0.045","","","","0.0789","","","","","","1.514","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051310","13.1","0.2","25.4","0.2","12","0.2","90","","90","","90","","3993","10","296.2","","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C19 H18 Cu N4 O8 -","- C19 H18 Cu N4 O8 -","- C152 H144 Cu8 N32 O64 -","8","1","","Ezuhara, Takayoshi; Endo, Ken; Matsuda, Kenji; Aoyama, Yasuhiro","One-dimensional chains consisting of copper(II) ions and an orthogonal anthracene-pyrimidine derivative: hierarchical formation of high-dimensional networks and their magnetic properties","New Journal of Chemistry","2000","24","8","609","","10.1039/b002315i","","","0.7107","MoKα","","","0.046","","","","0.0685","","","","","","1.147","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051311","9.284","0.0006","19.097","0.002","12.781","0.0007","90","","99.091","0.004","90","","2237.6","0.3","170","","170","","","","","","","","H2L-1 + [Ti(NBu-t)Cl2(py(3] in benzene","8","P 1 21/n 1","-P 2yn","14","","[Ti{i-Pr2(CH2CH2CH2N)[9]aneN3}Cl(OTf)]","","- C16 H32 Cl F3 N4 O3 S Ti -","- C16 H32 Cl F3 N4 O3 S Ti -","- C64 H128 Cl4 F12 N16 O12 S4 Ti4 -","4","1","","Male, Nigel A. H.; Skinner, Michael E. G.; Wilson, Paul J.; Mountford, Philip; Schröder, Martin","ansa-Linked titanium macrocycle–imido complexes","New Journal of Chemistry","2000","24","8","575","","10.1039/b002341h","","","0.71069","MoKα","","","0.0526","","","0.0359","","","","","1.17","1.17","","","","","has coordinates","288252","2023-12-12","14:26:25",""
"7051312","25.504","0.004","20.498","0.003","19.688","0.003","90","","118.61","0.01","90","","9036","3","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C49 H45 Ag N7 O5 P -","- C49 H43 Ag N7 O5 P -","- C392 H344 Ag8 N56 O40 P8 -","8","1","","Sun, Wei-Yin; Xie, Jin; Mei, Yu-Hua; Yu, Kai-Bei","Synthesis and crystal structure of three-coordinated silver(I) and copper(I) complexes with N2P binding set containing a novel tripodal ligand: 1,3,5-tris(benzimidazol-2-ylmethyl)benzene","New Journal of Chemistry","2000","24","7","519","","10.1039/b002450n","","","0.71073","MoKα","","0.0762","0.0409","","0.1022","0.0898","","","","0.859","1.038","1.038","","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051313","29.293","0.004","29.293","0.004","18.476","0.004","90","","90","","120","","13730","4","293","2","293","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C28 H34.33 Fe2 N6 Ni O1.17 S2 -","- C28 H34.34 Fe2 N6 Ni O1.16667 S2 -","- C504 H618.12 Fe36 N108 Ni18 O21 S36 -","18","1","","Fang Chen-jie; Duan Chun-ying; He Cheng; Han Gang; Meng Qing-jin","A supramolecular analog of cyclohexane sustained by aromatic C‒H···π interactions between ferrocene moieties: molecular packing of ferrocene-containing thiosemicarbazato metal complexes","New J. Chem.","2000","24","9","697","701","10.1039/b002590i","","","0.71073","MoKα","","0.1224","0.0683","","","0.1676","0.1994","","","","","","1.009","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051314","29.171","0.003","29.171","0.003","19.702","0.003","90","","90","","120","","14519","3","293","2","293","2","","","","","","","","7","R -3 c :H","-R 3 2""c","167","","","","- C28 H34 Fe2 N6 O S2 Zn -","- C28 H34 Fe2 N6 O S2 Zn -","- C504 H612 Fe36 N108 O18 S36 Zn18 -","18","0.5","","Fang Chen-jie; Duan Chun-ying; He Cheng; Han Gang; Meng Qing-jin","A supramolecular analog of cyclohexane sustained by aromatic C‒H···π interactions between ferrocene moieties: molecular packing of ferrocene-containing thiosemicarbazato metal complexes","New J. Chem.","2000","24","9","697","701","10.1039/b002590i","","","0.71073","MoKα","","0.1339","0.0707","","","0.1622","0.1933","","","","","","1.042","","","","has coordinates,has disorder","180067","2020-10-21","18:00:00",""
"7051315","14.2714","0.0008","15.7335","0.0009","17.2879","0.0009","113.553","0.001","104.959","0.001","97.734","0.001","3311.7","0.3","203","2","203","2","","","","","","","","6","P -1","-P 1","2","","","","- C72 H48 B F24 O3 P -","- C72 H48 B F24 O3 P -","- C144 H96 B2 F48 O6 P2 -","2","1","","Fang, Xinggao; Scott, Brian L.; John, Kevin D.; Kubas, Gregory J.; Watkin, John G.","Triphenylmethyl tris(p-methoxyphenyl)phosphonium cation: a structurally characterized phosphonium analog of hexaphenylethane","New Journal of Chemistry","2000","24","10","831","","10.1039/b003233f","","","0.71073","MoKα","","0.0835","0.064","","","0.1693","0.1793","","","","","","1.54","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051316","14.1573","0.0007","25.79","0.002","17.873","0.001","90","","108.646","0.001","90","","6183.2","0.7","203","2","203","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C58 H40 B Cl4 F24 O3 P -","- C58 H38 B Cl4 F24 O3 P -","- C232 H152 B4 Cl16 F96 O12 P4 -","4","1","","Fang, Xinggao; Scott, Brian L.; John, Kevin D.; Kubas, Gregory J.; Watkin, John G.","Triphenylmethyl tris(p-methoxyphenyl)phosphonium cation: a structurally characterized phosphonium analog of hexaphenylethane","New Journal of Chemistry","2000","24","10","831","","10.1039/b003233f","","","0.71073","MoKα","","0.0854","0.0685","","","0.2022","0.2149","","","","","","1.513","","","","has coordinates,has disorder","180067","2020-10-21","18:00:00",""
"7051317","14.13","0.01","28.39","0.01","13.816","0.005","90","","116","3","90.08","","4981","13","294","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C56 H43 B2 Cu2 F8 N8 O4 -","- C50 H40 B2 Cu2 F10 N9 O4 -","- C200 H160 B8 Cu8 F40 N36 O16 -","4","1","","Raymond Ziessel; Anthony Harriman; Abdelkrim El-ghayoury; Laurent Douce; Emmanuelle Leize; Hélène Nierengarten; Alain Van Dorsselaer","First assembly of copper(I) naphthyridine-based helicates","New J. Chem.","2000","24","10","729","732","10.1039/b003342l","","","0.71073","Mo-Kα","","","0.106","","","0.111","","","","","7.175","7.175","","","","","has coordinates","288182","2023-12-08","13:20:12",""
"7051318","8.14","0.001","16.191","0.001","14.008","0.002","90","","105.9","0.02","90","","1775.5","0.4","298.2","","298.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H18 Au2 N8 Ni -","- C10 H18 Au2 N8 Ni -","- C40 H72 Au8 N32 Ni4 -","4","1","","Chu, Ivan K.; Shek, Iris P. Y.; Michael Siu, K. W.; Wong, Wing-Tak; Zuo, Jing-Lin; Lau, Tai-Chu","Synthesis, crystal structure and electrospray ionisation mass spectrometry of a novel one-dimensional cyano-bridged Ni(II)‒Au(I) polymer","New Journal of Chemistry","2000","24","10","765","","10.1039/b003673k","","","0.7107","MoKalpha","","","0.0569","","","0.0666","","","","","2.315","2.315","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051319","8.992","0.002","13.718","0.001","14.13","0.003","90","","103.87","0.02","90","","1692.1","0.6","293","2","293","2","","","","","","","aqueous synthesis","5","P 1 21/c 1","-P 2ybc","14","","catena-[(mu!2$-pyridin-3-onato-N,0)-{aqua-(pyridin-3-onato) (3-hydroxypyridine)-copper(II)}-water(1/2)]","","- C15 H19 Cu N3 O6 -","- C15 H19 Cu N3 O6 -","- C60 H76 Cu4 N12 O24 -","4","1","","Castillo, Oscar; Luque, Antonio; Iglesias, Sonia; Vitoria, Pablo; Román, Pascual","Synthesis, crystal structure, thermal behaviour and magnetic properties of a novel one-dimensional copper(II) complex containing neutral and deprotonated 3-hydroxypyridine ligands","New Journal of Chemistry","2000","24","10","771","","10.1039/b004072j","","","0.71069","MoKα","","0.0716","0.0373","","","0.0909","0.0972","","","","","","1.007","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051320","7.3724","0.001","14.696","0.003","15.93","0.002","90","","92.334","0.008","90","","1724.5","0.5","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H9 N3 O6 -","- C18 H9 N3 O6 -","- C72 H36 N12 O24 -","4","1","","Robinson, James M. A.; Philp, Douglas; Harris, Kenneth D. M.; Kariuki, Benson M.","Weak interactions in crystal engineering—understanding the recognition properties of the nitro group","New Journal of Chemistry","2000","24","10","799","","10.1039/b004086j","","","1.5406","","","0.0673","0.0599","","0.1695","0.1602","","","","1.106","1.109","1.109","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051321","9.646","0.002","6.904","0.002","16.131","0.004","90","","124.43","0.02","90","","886.1","0.4","50","1","50","1","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","1,8-dimethylnaphthalene","1,8-dimethylnaphthalene","","- C12 H12 -","- C12 H12 -","- C48 H48 -","4","1","","Wilson, Chick C.; Nowell, Harriott","Methyl group librations in sterically hindered dimethylnaphthalene molecules: neutron diffraction studies of 1,8-dimethylnaphthalene between 50 and 200 K","New Journal of Chemistry","2000","24","12","1063","","10.1039/b004123h","","neutron","","neutron","","0.0743","0.0743","","","0.1823","0.1823","","","","","","1.097","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051322","9.725","0.002","6.938","0.002","16.147","0.004","90","","124.4","0.02","90","","898.9","0.4","150","1","150","1","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","1,8-dimethylnaphthalene","1,8-dimethylnaphthalene","","- C12 H12 -","- C12 H12 -","- C48 H48 -","4","1","","Wilson, Chick C.; Nowell, Harriott","Methyl group librations in sterically hindered dimethylnaphthalene molecules: neutron diffraction studies of 1,8-dimethylnaphthalene between 50 and 200 K","New Journal of Chemistry","2000","24","12","1063","","10.1039/b004123h","","neutron","","neutron","","0.0736","0.0736","","","0.1793","0.1793","","","","","","1.074","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051323","9.773","0.002","6.955","0.002","16.158","0.005","90","","124.36","0.02","90","","906.6","0.5","200","1","200","1","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","1,8-dimethylnaphthalene","1,8-dimethylnaphthalene","","- C12 H12 -","- C12 H12 -","- C48 H48 -","4","1","","Wilson, Chick C.; Nowell, Harriott","Methyl group librations in sterically hindered dimethylnaphthalene molecules: neutron diffraction studies of 1,8-dimethylnaphthalene between 50 and 200 K","New Journal of Chemistry","2000","24","12","1063","","10.1039/b004123h","","neutron","","neutron","","0.0766","0.0766","","","0.1885","0.1885","","","","","","1.132","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051324","9.678","0.002","6.917","0.002","16.141","0.004","90","","124.39","0.02","90","","891.7","0.4","100","1","100","1","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","1,8-dimethylnaphthalene","1,8-dimethylnaphthalene","","- C12 H12 -","- C12 H12 -","- C48 H48 -","4","1","","Wilson, Chick C.; Nowell, Harriott","Methyl group librations in sterically hindered dimethylnaphthalene molecules: neutron diffraction studies of 1,8-dimethylnaphthalene between 50 and 200 K","New Journal of Chemistry","2000","24","12","1063","","10.1039/b004123h","","neutron","","neutron","","0.0933","0.0933","","","0.2226","0.2226","","","","","","1.19","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051325","6.3087","0.0011","11.7069","0.0019","13.559","0.002","103.736","0.019","100.89","0.02","104.556","0.019","908","0.3","140","2","140","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H18 N3 O9 Tb -","- C15 H18 N3 O9 Tb -","- C30 H36 N6 O18 Tb2 -","2","1","","Christine Tedeschi; Claude Picard; Joëlle Azéma; Bruno Donnadieu; Pierre Tisnès","First crystal structure of a Tb3+ complex derived from an aromatic hydroxamate ligand: sensitized luminescence properties","New J. Chem.","2000","24","10","735","737","10.1039/b004288i","","","","MoK","","0.0251","0.0225","","","0.0518","0.0525","","","","","","1.065","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051326","8.833","0.0002","11.5202","0.0003","16.055","0.0004","103.698","","99.4508","0.0012","98.8901","0.0012","1533.49","0.07","113","","113","","","","","","","","","6","P -1","-P 1","2","","","","- C26 H58 N2 O Os P2 -","- C26 H58 N2 O Os P2 -","- C52 H116 N4 O2 Os2 P4 -","2","1","","Yandulov, Dmitry V.; Huffman, John C.; Caulton, Kenneth G.","An osmium hydrido methyl species via an unconventional methyl transfer","New Journal of Chemistry","2000","24","9","649","650","10.1039/b004484i","","","0.71073","MoKα","","","0.0159","","","","0.0134","","","","","","0.5487","","","","has coordinates,has disorder","210967","2020-10-21","18:00:00",""
"7051327","7.307","0.003","9.337","0.002","14.654","0.004","101.79","0.02","97.75","0.02","103.75","0.03","932.8","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","[Cu(CH3COO)2(NITpPy)]2","","","- C16 H22 Cu N3 O6 -","- C16 H22 Cu N3 O6 -","- C32 H44 Cu2 N6 O12 -","2","1","","Iwayan Dasna; Stéphane Golhen; Lahcène Ouahab; Octavio Peña; Nathalie Daro","A dimeric Cu(II) acetate complex containing axially coordinated p-pyridyl nitronyl nitroxide radicals: [CuII(CH3COO)2(NITpPy)]2","New J. Chem.","2000","24","11","903","906","10.1039/b004491l","","","0.71073","MoKα","","0.0787","0.0369","","","0.0835","0.0962","","","","","","0.989","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051328","11.809","0.002","11.809","0.002","13.108","0.002","90","","90","","90","","1827.9","0.5","293","2","293","2","","","","","","","","6","I 4 2 2","I 4 2","97","Fe2[Mo(CN)8].8H20","","","- C8 H16 Fe2 Mo N8 O8 -","- C8 Fe2 Mo N8 O8 -","- C32 Fe8 Mo4 N32 O32 -","4","0.25","","Amandeep K. Sra; Guillaume Rombaut; Frédéric Lahitête; Stéphane Golhen; Lahcène Ouahab; Corine Mathonière; J. V. Yakhmi; (the late) Olivier Kahn","Hepta/octa cyanomolybdates with Fe2+: influence of the valence state of Mo on the magnetic behavior","New J. Chem.","2000","24","11","871","876","10.1039/b004566g","","","0.71073","MoKα","","0.0782","0.0555","","","0.1414","0.1482","","","","","","1.288","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051329","8.6698","0.0004","8.6698","0.0004","5.2977","0.0003","90","","90","","90","","398.2","0.03","100","2","100","2","","","","","","","","4","P -4 21 m","P -4 2ab","113","","","","- C4 H14 Br N3 -","- C4 H14 Br N3 -","- C8 H28 Br2 N6 -","2","0.25","","","","New Journal of Chemistry","2000","","","","","10.1039/b004641h","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051330","8.6597","0.0006","8.7948","0.0004","11.9359","0.0008","90","","90","","90","","909.04","0.1","100","2","100","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C4 H15 Cl2 N3 -","- C4 H15 Cl2 N3 -","- C16 H60 Cl8 N12 -","4","0.5","","","","New Journal of Chemistry","2000","","","","","10.1039/b004641h","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051331","11.6664","0.001","9.1552","0.0005","17.5536","0.0018","90","","90","","90","","1874.9","0.3","100","2","100","2","","","","","","","","4","P c a b","-P 2bc 2ac","61","","","","- C4 H15 Br2 N3 -","- C4 H15 Br2 N3 -","- C32 H120 Br16 N24 -","8","1","","","","New Journal of Chemistry","2000","","","","","10.1039/b004641h","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051332","12.035","0.002","9.7006","0.0019","18.374","0.004","90","","90","","90","","2145.1","0.7","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C4 H15 I2 N3 -","- C4 H15 I2 N3 -","- C32 H120 I16 N24 -","8","1","","","","New Journal of Chemistry","2000","","","","","10.1039/b004641h","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051333","5.1016","0.0007","21.343","0.003","4.744","0.0005","90","","90","","90","","516.54","0.12","100","2","100","2","","","","","","","","4","P m m n :2","-P 2ab 2a","59","","","","- C4 H16 Cl3 N3 -","- C4 H16 Cl3 N3 -","- C8 H32 Cl6 N6 -","2","0.25","","","","New Journal of Chemistry","2000","","","","","10.1039/b004641h","","","","","","","","","","","","","","","","","","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051334","6.2094","0.0012","19.674","0.004","9.0026","0.0018","90","","93.39","0.03","90","","1097.9","0.4","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C4 H16 Br3 N3 -","- C4 H16 Br3 N3 -","- C16 H64 Br12 N12 -","4","1","","","","New Journal of Chemistry","2000","","","","","10.1039/b004641h","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051335","4.8037","0.001","11.005","0.002","10.871","0.002","90","","95.63","0.03","90","","571.9","0.2","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C5 H19 Br2 N3 O -","- C5 H18 Br2 N3 O -","- C10 H36 Br4 N6 O2 -","2","1","","","","New Journal of Chemistry","2000","","","","","10.1039/b004641h","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051336","4.7197","0.0009","10.658","0.002","13.046","0.003","90","","93.25","0.03","90","","655.2","0.2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C3 H12 Cl N2 O -","- C3 H12 Cl N2 O -","- C12 H48 Cl4 N8 O4 -","4","1","","","","New Journal of Chemistry","2000","","","","","10.1039/b004641h","","","","","","","","","","","","","","","","","","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051337","4.7413","0.0009","10.935","0.002","13.315","0.003","90","","91.77","0.03","90","","690","0.2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C3 H12 Br N2 O -","- C3 H12 Br N2 O -","- C12 H48 Br4 N8 O4 -","4","1","","","","New Journal of Chemistry","2000","","","","","10.1039/b004641h","","","","","","","","","","","","","","","","","","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051338","4.8139","0.001","11.418","0.002","13.689","0.003","90","","90.48","0.03","90","","752.4","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C3 H12 I N2 O -","- C3 H12 I N2 O -","- C12 H48 I4 N8 O4 -","4","1","","","","New Journal of Chemistry","2000","","","","","10.1039/b004641h","","","","","","","","","","","","","","","","","","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051339","14.286","0.003","16.187","0.003","14.162","0.003","90","","90","","90","","3274.9","1.1","100","2","100","2","","","","","","","","5","A b a 2","A 2 -2ab","41","","","","- C6 H24 Br4 N4 O -","- C6 H23 Br4 N4 O -","- C48 H184 Br32 N32 O8 -","8","","","","","New Journal of Chemistry","2000","","","","","10.1039/b004641h","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051340","15.091","0.003","16.774","0.003","15.06","0.003","90","","90","","90","","3812.2","1.3","100","2","100","2","","","","","","","","5","A b a 2","A 2 -2ab","41","","","","- C6 H24 I4 N4 O -","- C6 H23 I4 N4 O -","- C48 H184 I32 N32 O8 -","8","","","","","New Journal of Chemistry","2000","","","","","10.1039/b004641h","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051341","5.5047","0.0011","11.895","0.002","10.41","0.002","90","","90.67","0.03","90","","681.6","0.2","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C4 H12 Cl N2 -","- C4 H12 Cl N2 -","- C16 H48 Cl4 N8 -","4","1","","","","New Journal of Chemistry","2000","","","","","10.1039/b004641h","","","","","","","","","","","","","","","","","","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051342","5.9645","0.0012","12.573","0.003","9.4371","0.0019","90","","100.24","0.03","90","","696.4","0.2","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C4 H12 Br N2 -","- C4 H12 Br N2 -","- C16 H48 Br4 N8 -","4","1","","","","New Journal of Chemistry","2000","","","","","10.1039/b004641h","","","","","","","","","","","","","","","","","","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051343","8.6143","0.0017","8.7903","0.0018","13.772","0.003","90","","95.5","0.03","90","","1038.1","0.4","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C6 H19 Br N4 -","- C6 H19 Br N4 -","- C24 H76 Br4 N16 -","4","1","","","","New Journal of Chemistry","2000","","","","","10.1039/b004641h","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051344","8.5019","0.0017","9.6112","0.0019","14.84","0.003","90","","91.08","0.03","90","","1212.4","0.4","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C6 H21 I N4 O -","- C6 H21 I N4 O -","- C24 H84 I4 N16 O4 -","4","1","","","","New Journal of Chemistry","2000","","","","","10.1039/b004641h","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051345","10.875","0.0013","10.875","0.0013","10.875","0.0013","90","","90","","90","","1286.1","0.3","100","2","100","2","","","","","","","","4","P 21 3","P 2ac 2ab 3","198","","","","- C6 H21 Cl3 N4 -","- C6 H21 Cl3 N4 -","- C24 H84 Cl12 N16 -","4","0.333333","","","","New Journal of Chemistry","2000","","","","","10.1039/b004641h","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051346","16.501","0.002","16.501","0.002","9.5919","0.0019","90","","90","","120","","2261.8","0.6","100","2","100","2","","","","","","","","4","R 3 c :H","R 3 -2""c","161","","","","- C6 H21 I3 N4 -","- C6 H21 I3 N4 -","- C36 H126 I18 N24 -","6","0.333333","","","","New Journal of Chemistry","2000","","","","","10.1039/b004641h","","","","","","","","","","","","","","","","","","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051347","14.889","0.003","10.685","0.002","20.754","0.004","90","","105.92","0.03","90","","3175.2","1.1","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H46 Br8 N8 O2 -","- C12 H46 Br8 N8 O2 -","- C48 H184 Br32 N32 O8 -","4","1","","","","New Journal of Chemistry","2000","","","","","10.1039/b004641h","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051348","15.29","0.003","9.609","0.002","16.956","0.003","90","","97.93","0.03","90","","2467.4","0.8","293","2","293","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C18 H28 Co0.5 N5 O8 -","- C18 H18 Co0.5 N5 O8 -","- C72 H72 Co2 N20 O32 -","4","1","","Ma, Jian-Fang; Liu, Jing-Fu; Liu, Ying-Chun; Xing, Yan; Jia, Heng-Qing; Lin, Yong-Hua","Two new coordination polymers of Co(II) with 1,1'-(1,4-butanediyl)bis(benzimidazole)","New Journal of Chemistry","2000","24","10","759","","10.1039/b004787m","","","0.71073","MoKα","","0.1428","0.0637","","0.2438","","0.1458","","","0.85","","","1.096","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051349","9.603","0.002","15.914","0.003","15.723","0.003","90","","97.17","0.03","90","","2384","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H30 Co N4 O7 -","- C22 H24 Co N4 O7 -","- C88 H96 Co4 N16 O28 -","4","1","","Ma, Jian-Fang; Liu, Jing-Fu; Liu, Ying-Chun; Xing, Yan; Jia, Heng-Qing; Lin, Yong-Hua","Two new coordination polymers of Co(II) with 1,1'-(1,4-butanediyl)bis(benzimidazole)","New Journal of Chemistry","2000","24","10","759","","10.1039/b004787m","","","0.71073","MoKα","","0.0745","0.0488","","0.1452","0.1374","","","","0.999","1.164","1.164","","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051350","10.469","0.002","15.8692","0.0009","17.2811","0.0014","90","","90","","90","","2871","0.6","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C32 H23 F3 O4 P2 Pd -","- C32 H23 F3 O4 P2 Pd -","- C128 H92 F12 O16 P8 Pd4 -","4","1","","Bedford, Robin B.; Draper, Sylvia M.; Noelle Scully, P.; Welch, Samantha L.","Palladium bis(phosphinite) 'PCP'-pincer complexes and their application as catalysts in the Suzuki reaction","New Journal of Chemistry","2000","24","10","745","","10.1039/b004793g","","","0.71073","MoKα","","0.1203","0.0863","","","0.2743","0.3108","","","","","","1.199","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051351","10.696","0.004","10.696","0.004","19.748","0.006","90","","90","","120","","1956.6","1.2","291","2","291","2","","","","","","","","6","P 32 1 2","P 32 2 (0 0 2)","153","","bis(4,5-diazafluorene thiosemicarbazato)nickel trihydrate","","- C24 H22 N10 Ni O3 S2 -","- C24 H22 N10 Ni O3 S2 -","- C72 H66 N30 Ni3 O9 S6 -","3","0.5","","Liu Ze-hua; Duan Chun-ying; Li Ji-hui; Liu Yong-jiang; Mei Yu-hua; You Xiao-zeng","Structural dependence of π‒π interactions in dithiocarbazato and thiosemicarbazato nickel complexes","New J. Chem.","2000","24","12","1057","1062","10.1039/b004846l","","","0.71073","MoKα","","0.0413","0.037","","","0.088","0.0912","","","","","","1.109","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051352","12.2943","0.0014","14.67","0.002","15.508","0.002","91.439","0.014","99.301","0.012","106.954","0.012","2632.5","0.6","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","bis(fluorene-9-one thiosemicarbazato)nickel monohydrate","","- C28 H22 N6 Ni O S2 -","- C28 H22 N6 Ni O S2 -","- C112 H88 N24 Ni4 O4 S8 -","4","2","","Liu Ze-hua; Duan Chun-ying; Li Ji-hui; Liu Yong-jiang; Mei Yu-hua; You Xiao-zeng","Structural dependence of π‒π interactions in dithiocarbazato and thiosemicarbazato nickel complexes","New J. Chem.","2000","24","12","1057","1062","10.1039/b004846l","","","0.71073","MoKα","","0.0552","0.042","","0.1225","0.1108","","","","1.007","1.027","1.027","","","","","has coordinates,has disorder","180067","2020-10-21","18:00:00",""
"7051353","8.9236","0.0011","21.696","0.003","18.933","0.002","90","","100.772","0.012","90","","3601","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","bis(fluorene-9-one S-phenyl-dithiocarbazato)nickel","","- C42 H30 N4 Ni S4 -","- C42 H28 N4 Ni S4 -","- C168 H112 N16 Ni4 S16 -","4","1","","Liu Ze-hua; Duan Chun-ying; Li Ji-hui; Liu Yong-jiang; Mei Yu-hua; You Xiao-zeng","Structural dependence of π‒π interactions in dithiocarbazato and thiosemicarbazato nickel complexes","New J. Chem.","2000","24","12","1057","1062","10.1039/b004846l","","","0.71073","MoKα","","0.0858","0.049","","0.1571","0.1103","","","","1.074","1.083","1.083","","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051354","10.594","0.003","8.5","0.004","38.598","0.007","90","","96.79","0.02","90","","3451","2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","bis(4,5-diazafluorene-9-one S-phenyl-dithiocarbazato)nickel","","- C38 H26 N8 Ni S4 -","- C38 H26 N8 Ni S4 -","- C152 H104 N32 Ni4 S16 -","4","1","","Liu Ze-hua; Duan Chun-ying; Li Ji-hui; Liu Yong-jiang; Mei Yu-hua; You Xiao-zeng","Structural dependence of π‒π interactions in dithiocarbazato and thiosemicarbazato nickel complexes","New J. Chem.","2000","24","12","1057","1062","10.1039/b004846l","","","0.71073","MoKα","","0.1588","0.0714","","","0.1519","0.183","","","","","","1.01","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051355","15.9302","0.001","10.8486","0.0007","11.3797","0.0007","90","","90","","90","","1966.6","0.2","293","2","293","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C12 H18 Ag2 N8 Ni O -","- C12 H16 Ag2 N8 Ni O -","- C48 H64 Ag8 N32 Ni4 O4 -","4","1","","Shek, Iris P. Y.; Wong, Wai-Yeung; Lau, Tai-Chu","A novel heterobimetallic Ni(II)‒Ag(I) cyano-bridged coordination polymer incorporating Ag···Ag interactions: {[Ni(cyclen)][Ag(CN)2]}[Ag(CN)2]","New Journal of Chemistry","2000","24","10","733","","10.1039/b004939p","","","0.71073","MoKα","","0.0233","0.0228","","","0.0637","0.0641","","","","","","1.035","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051356","13.683","0.003","22.229","0.005","10.367","0.004","90","","90.485","0.014","90","","3153.1","1.6","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C8 H36 B22 Cl2 N2 S4 -","- C8 H36 B22 Cl2 N2 S4 -","- C32 H144 B88 Cl8 N8 S16 -","4","1","","Norman, Nicholas C.; Guy Orpen, A.; Quayle, Michael J.; Rice, Craig R.","Diborane(4) compounds incorporating thio- and seleno-carboranyl groups","New Journal of Chemistry","2000","24","11","837","","10.1039/b004942p","","","0.71073","MoKα","","0.1481","0.079","","0.2195","0.1895","","","","0.875","1.097","1.097","","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051357","11.209","0.004","8.974","0.004","19.784","0.009","90","","94.14","0.04","90","","1984.9","1.5","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 H29 B10 N3 S2 -","- C8 H29 B10 N3 S2 -","- C32 H116 B40 N12 S8 -","4","1","","Norman, Nicholas C.; Guy Orpen, A.; Quayle, Michael J.; Rice, Craig R.","Diborane(4) compounds incorporating thio- and seleno-carboranyl groups","New Journal of Chemistry","2000","24","11","837","","10.1039/b004942p","","","0.71073","MoKα","","0.2283","0.0931","","0.1908","0.1406","","","","1.009","1.146","1.146","","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051358","19.521","0.006","21.945","0.005","11.965","0.002","90","","103.803","0.014","90","","4978","2","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H62 B32 Cl2 N4 Se6 -","- C14 H62 B32 Cl2 N4 Se6 -","- C56 H248 B128 Cl8 N16 Se24 -","4","1","","Norman, Nicholas C.; Guy Orpen, A.; Quayle, Michael J.; Rice, Craig R.","Diborane(4) compounds incorporating thio- and seleno-carboranyl groups","New Journal of Chemistry","2000","24","11","837","","10.1039/b004942p","","","0.71073","MoKα","","0.1433","0.0674","","0.1829","0.144","","","","1.019","1.135","1.135","","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051359","7.559","0.002","4.997","0.002","10.293","0.002","116.96","0.03","91.55","0.03","100.31","0.03","338.3","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C10 H24 N4 O4 -","- C10 H22 N4 O4 -","- C10 H22 N4 O4 -","1","0.5","","Laurent Frémond; Enrique Espinosa; Michel Meyer; Franck Denat; Roger Guilard; Volker Huch; Michael Veith","Synthesis, characterization and X-ray crystal structures of cyclam derivatives. Part IV. 1,4,8,11-Tetraazacyclotetradecane-5,12-dione and its diprotonated forms","New J. Chem.","2000","24","12","959","966","10.1039/b005052k","","","0.71073","MoKα","","0.0362","0.0328","","","0.0924","0.0956","","","","","","1.087","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051360","5.2851","0.0002","8.0718","0.0004","9.5424","0.0005","109.126","0.003","104.189","0.003","97.989","0.003","362.03","0.03","112","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C10 H22 Br2 N4 O2 -","- C10 H22 Br2 N4 O2 -","- C10 H22 Br2 N4 O2 -","1","0.5","","Laurent Frémond; Enrique Espinosa; Michel Meyer; Franck Denat; Roger Guilard; Volker Huch; Michael Veith","Synthesis, characterization and X-ray crystal structures of cyclam derivatives. Part IV. 1,4,8,11-Tetraazacyclotetradecane-5,12-dione and its diprotonated forms","New J. Chem.","2000","24","12","959","966","10.1039/b005052k","","","0.71073","MoKα","","0.0271","0.0255","","","0.067","0.0682","","","","","","1.114","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051361","10.27","0.0002","16.169","0.0004","10.8995","0.0002","90","","106.9","0.001","90","","1731.76","0.06","112","2","112","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C10 H22 Cl2 N4 O10 -","- C10 H22 Cl2 N4 O10 -","- C40 H88 Cl8 N16 O40 -","4","1","","Laurent Frémond; Enrique Espinosa; Michel Meyer; Franck Denat; Roger Guilard; Volker Huch; Michael Veith","Synthesis, characterization and X-ray crystal structures of cyclam derivatives. Part IV. 1,4,8,11-Tetraazacyclotetradecane-5,12-dione and its diprotonated forms","New J. Chem.","2000","24","12","959","966","10.1039/b005052k","","","0.71073","MoKα","","0.0352","0.0316","","","0.0812","0.0835","","","","","","1.054","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051362","9.791","0.001","11.806","0.001","10.532","0.001","90","","112.779","0.007","90","","1122.4","0.2","296.2","","296.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H30 Cl2 Ru2 S2 -","- C20 H30 Cl2 Ru2 S2 -","- C40 H60 Cl4 Ru4 S4 -","2","0.5","","Seino, Hidetake; Mizobe, Yasushi; Hidai, Masanobu","Preparation of hydrosulfido- and hydroselenido-bridged diruthenium complexes with π-arene co-ligands and their conversion into new cubane-type sulfido or selenido clusters","New Journal of Chemistry","2000","24","11","907","911","10.1039/b005454m","","","","","","","","","","","","","","","","","","","","","has coordinates","218967","2020-10-21","18:00:00",""
"7051363","9.9109","0.0007","11.9264","0.0008","10.5135","0.0005","90","","112.183","0.004","90","","1150.7","0.1","296.2","","296.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H30 Cl2 Ru2 Se2 -","- C20 H30 Cl2 Ru2 Se2 -","- C40 H60 Cl4 Ru4 Se4 -","2","0.5","","Seino, Hidetake; Mizobe, Yasushi; Hidai, Masanobu","Preparation of hydrosulfido- and hydroselenido-bridged diruthenium complexes with π-arene co-ligands and their conversion into new cubane-type sulfido or selenido clusters","New Journal of Chemistry","2000","24","11","907","911","10.1039/b005454m","","","","","","","","","","","","","","","","","","","","","has coordinates","218967","2020-10-21","18:00:00",""
"7051364","18.022","0.001","16.351","0.001","18.111","0.002","90","","118.101","0.005","90","","4708","0.7","296.2","","296.2","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C47 H64 Ru4 S4 -","- C47 H56 Ru4 S4 -","- C188 H224 Ru16 S16 -","4","1","","Seino, Hidetake; Mizobe, Yasushi; Hidai, Masanobu","Preparation of hydrosulfido- and hydroselenido-bridged diruthenium complexes with π-arene co-ligands and their conversion into new cubane-type sulfido or selenido clusters","New Journal of Chemistry","2000","24","11","907","911","10.1039/b005454m","","","","","","","","","","","","","","","","","","","","","has coordinates","218967","2020-10-21","18:00:00",""
"7051365","18.001","0.003","16.653","0.003","18.315","0.003","90","","118.661","0.01","90","","4817","1","296.2","","296.2","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C47 H64 Ru4 Se4 -","- C47 H56 Ru4 Se4 -","- C188 H224 Ru16 Se16 -","4","1","","Seino, Hidetake; Mizobe, Yasushi; Hidai, Masanobu","Preparation of hydrosulfido- and hydroselenido-bridged diruthenium complexes with π-arene co-ligands and their conversion into new cubane-type sulfido or selenido clusters","New Journal of Chemistry","2000","24","11","907","911","10.1039/b005454m","","","","","","","","","","","","","","","","","","","","","has coordinates","218967","2020-10-21","18:00:00",""
"7051366","23.808","0.009","14.984","0.006","18.715","0.007","90","","94.265","0.005","90","","6658","4","163","2","163","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C60 H84 Cu4 I4 N6 -","- C60 H84 Cu4 I4 N6 -","- C240 H336 Cu16 I16 N24 -","4","1","","Fitchett, Christopher M.; Steel, Peter J.","Chiral heterocyclic ligands. Part 9. Homoconfigurational coordination polymers based on a C2-symmetric, linear-bridging ligand","New Journal of Chemistry","2000","24","12","945","","10.1039/b005881p","","","0.71073","MoKα","","0.0439","0.0414","","","0.1043","0.1057","","","","","","1.041","","","","has coordinates,has disorder","180067","2020-10-21","18:00:00",""
"7051367","13.614","0.005","28.871","0.01","11.523","0.005","90","","90","","90","","4529","3","163","2","163","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C20.75 H32 Ag N3 O4.25 -","- C20.75 H32 Ag N3 O4.25 -","- C166 H256 Ag8 N24 O34 -","8","2","","Fitchett, Christopher M.; Steel, Peter J.","Chiral heterocyclic ligands. Part 9. Homoconfigurational coordination polymers based on a C2-symmetric, linear-bridging ligand","New Journal of Chemistry","2000","24","12","945","","10.1039/b005881p","","","0.71073","MoKα","","0.0674","0.036","","","0.0714","0.0771","","","","","","0.89","","","","has coordinates,has disorder","180067","2020-10-21","18:00:00",""
"7051368","10.752","0.006","11.359","0.006","7.382","0.004","90","","90","","90","","901.6","0.8","163","2","163","2","","","","","","","","3","P 21 21 2","P 2 2ab","18","","","","- C20 H28 N2 -","- C20 H28 N2 -","- C40 H56 N4 -","2","0.5","","Fitchett, Christopher M.; Steel, Peter J.","Chiral heterocyclic ligands. Part 9. Homoconfigurational coordination polymers based on a C2-symmetric, linear-bridging ligand","New Journal of Chemistry","2000","24","12","945","","10.1039/b005881p","","","0.71073","MoKα","","0.0589","0.0439","","","0.1085","0.1148","","","","","","1.053","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051369","10.404","0.014","18.94","0.02","11.673","0.014","90","","105.8","0.01","90","","2213","5","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C26 H20 N6 -","- C26 H20 N6 -","- C104 H80 N24 -","4","1","","Pal, Pankaj K.; Chowdhury, Shubhamoy; Drew, Michael G. B.; Datta, Dipankar","Metal-assisted electrocyclic reaction in a CN‒NC‒CN system","New Journal of Chemistry","2000","24","12","931","","10.1039/b006547l","","","0.71073","MoKα","","0.1218","0.0695","","","0.1867","0.2214","","","","","","1.035","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051370","13.785","0.015","16.86","0.019","20.91","0.02","90","","102.037","0.01","90","","4753","9","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C44 H32 F12 N8 O P2 Ru -","- C44 H30 F12 N8 O P2 Ru -","- C176 H120 F48 N32 O4 P8 Ru4 -","4","1","","Pal, Pankaj K.; Chowdhury, Shubhamoy; Drew, Michael G. B.; Datta, Dipankar","Metal-assisted electrocyclic reaction in a CN‒NC‒CN system","New Journal of Chemistry","2000","24","12","931","","10.1039/b006547l","","","0.71073","MoKα","","0.2252","0.1137","","","0.2809","0.3301","","","","","","1.073","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051371","16.9221","0.0007","11.4251","0.0004","8.6147","0.0003","90","","90","","90","","1665.54","0.11","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C14 H8 Co N8 -","- C14 H8 Co N8 -","- C56 H32 Co4 N32 -","4","0.5","","Sun, Bai-Wang; Gao, Song; Ma, Bao-Qing; Wang, Zhe-Ming","A two-fold interpenetrated three-dimensional cobalt(II) complex with dual dicyanamide and 4,4'-bipyridine bridges","New Journal of Chemistry","2000","24","12","953","","10.1039/b006602h","","","0.71073","MoKα","","0.097","0.0772","","","0.2543","0.2644","","","","","","1.179","","","","has coordinates,has disorder","180067","2020-10-21","18:00:00",""
"7051372","33.672","0.002","12.308","0.0011","16.5","0.0013","90","","111.932","0.004","90","","6343.3","0.9","110","2","110","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C34 H58 Sm -","- C34 H58 Sm -","- C272 H464 Sm8 -","8","1","","Visseaux, Marc; Barbier-Baudry, Denise; Blacque, Olivier; Hafid, Abderrafia; Richard, Philippe; Weber, Frank","New base-free metallocenes of samarium and neodymium, an approach of the stereoelectronic control in organolanthanide chemistry","New Journal of Chemistry","2000","24","12","939","942","10.1039/B006834I","","","","","","","","","","","","","","","","","","","","","has coordinates","187703","2020-10-21","18:00:00",""
"7051373","8.498","0.002","28.893","0.005","10.265","0.001","90","","112.641","0.01","90","","2326.2","0.7","296","2","296","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C25 H37 Sm -","- C25 H37 Sm -","- C100 H148 Sm4 -","4","1","","Visseaux, Marc; Barbier-Baudry, Denise; Blacque, Olivier; Hafid, Abderrafia; Richard, Philippe; Weber, Frank","New base-free metallocenes of samarium and neodymium, an approach of the stereoelectronic control in organolanthanide chemistry","New Journal of Chemistry","2000","24","12","939","942","10.1039/B006834I","","","","","","","","","","","","","","","","","","","","","has coordinates","187703","2020-10-21","18:00:00",""
"7051374","19.021","0.003","8.377","0.003","29.023","0.003","90","","91.718","0.012","90","","4622.4","1.9","293","2","296","2","","","","","","","","3","P 1 21/a 1","-P 2yab","14","compound3","","","- C25 H37 Nd -","- C25 H37 Nd -","- C200 H296 Nd8 -","8","2","","Visseaux, Marc; Barbier-Baudry, Denise; Blacque, Olivier; Hafid, Abderrafia; Richard, Philippe; Weber, Frank","New base-free metallocenes of samarium and neodymium, an approach of the stereoelectronic control in organolanthanide chemistry","New Journal of Chemistry","2000","24","12","939","942","10.1039/B006834I","","","","","","","","","","","","","","","","","","","","","has coordinates","187703","2020-10-21","18:00:00",""
"7051375","8.884","0.003","11.352","0.004","16.041","0.006","93.353","0.008","92.003","0.008","97.681","0.011","1599","1","111","2","111","2","","","","","","","","5","P -1","-P 1","2","","","","- C31 H52 O P2 Ru -","- C31 H52 O P2 Ru -","- C62 H104 O2 P4 Ru2 -","2","1","","Coalter, Joseph N.; Bollinger, John C.; Eisenstein, Odile; Caulton, Kenneth G.","R-Group reversal of isomer stability for RuH(X)L2(CCHR) vs. Ru(X)L2(CCH2R): access to four-coordinate ruthenium carbenes and carbynes","New Journal of Chemistry","2000","24","12","925","","10.1039/b006971j","","","0.71073","MoKα","","0.0912","0.0553","","","0.1326","0.1401","","","","","","0.911","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051376","10.993","0.001","10.993","0.001","21.554","0.002","90","","90","","120","","2255.8","0.4","298.2","","298.2","","","","","","","","","5","P 3 c 1","P 3 -2""c","158","","","","- C35 H45 N8 Nd O18 -","- C35 H42 N8 Nd O18 -","- C70 H84 N16 Nd2 O36 -","2","0.333333","","Po-Wan Lai, Winnie; Wong, Wing-Tak","Trinitrato[N,N',N″-tris(2,3-dimethoxybenzamido)triethylamine]- neodymium(III). Synthesis, crystal structure and luminescence of a Nd complex containing tripodal amide ligands","New Journal of Chemistry","2000","24","12","943","","10.1039/b006976k","","","0.7107","MoKalpha","","","0.0422","","","0.0435","","","","","1.242","1.242","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051377","11.45","0.002","14.76","0.001","17.806","0.003","90","","96.54","0.02","90","","2989.7","0.8","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H34 Co2 N5 O8 -","- C30 H34 Co2 N5 O8 -","- C120 H136 Co8 N20 O32 -","4","1","","Hemmert, Catherine; Gornitzka, Heinz; Meunier, Bernard","Unprecedented amido-bridged dinuclear mixed-valence cobalt complexes: first structure of a dinuclear μ-OMe Co(II)/Co(III) complex","New Journal of Chemistry","2000","24","12","949","","10.1039/b007907n","","","0.71073","MoKα","","0.0618","0.0418","","","0.096","0.1039","","","","","","1.016","","","","has coordinates,has disorder","180067","2020-10-21","18:00:00",""
"7051378","9.808","0.001","16.784","0.002","17.036","0.002","90","","102.02","0.01","90","","2742.9","0.5","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H29 Cl3 Co2 N5 O2 -","- C26 H29 Cl3 Co2 N5 O2 -","- C104 H116 Cl12 Co8 N20 O8 -","4","1","","Hemmert, Catherine; Gornitzka, Heinz; Meunier, Bernard","Unprecedented amido-bridged dinuclear mixed-valence cobalt complexes: first structure of a dinuclear μ-OMe Co(II)/Co(III) complex","New Journal of Chemistry","2000","24","12","949","","10.1039/b007907n","","","0.71073","MoKα","","0.0432","0.0312","","","0.0699","0.0742","","","","","","1.033","","","","has coordinates,has disorder","180067","2020-10-21","18:00:00",""
"7051379","11.427","0.003","12.785","0.003","12.989","0.003","66.8","0.03","89.43","0.03","70.24","0.03","1624.7","0.9","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H40 Co N5 O10 -","- C30 H40 Co N5 O10 -","- C60 H80 Co2 N10 O20 -","2","1","","Hemmert, Catherine; Gornitzka, Heinz; Meunier, Bernard","Unprecedented amido-bridged dinuclear mixed-valence cobalt complexes: first structure of a dinuclear μ-OMe Co(II)/Co(III) complex","New Journal of Chemistry","2000","24","12","949","","10.1039/b007907n","","","0.71073","MoKα","","0.0939","0.0622","","","0.162","0.1817","","","","","","0.97","","","","has coordinates,has disorder","180067","2020-10-21","18:00:00",""
"7051380","25.101","0.006","14.916","0.003","17.108","0.004","90","","107.11","0.02","90","","6122","2","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C46 H61 Cl13 N6 Ti2 -","- C46 H61 Cl13 N6 Ti2 -","- C184 H244 Cl52 N24 Ti8 -","4","0.5","","Carmalt, Claire J.; Mileham, John D.; White, Andrew J. P.; Williams, David J.","Synthesis and characterisation of a bridging nitrido complex of titanium","New Journal of Chemistry","2000","24","12","929","","10.1039/b008211m","","","1.54178","CuKα","","0.0827","0.0664","","0.1897","0.1702","","","","1.048","1.084","1.084","","","","","has coordinates,has disorder","180067","2020-10-21","18:00:00",""
"7052466","11.726","0.003","8.518","0.003","20.943","0.006","90","","91.31","0.02","90","","2091.3","1.1","173","","173","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N'-diphenyl-3,6,9-trioxaundecanedicarboxamide","","- C20 H28 N2 O7 -","- C20 H28 N2 O7 -","- C80 H112 N8 O28 -","4","1","","Sylvie Meyer; Rémy Louis; Bernard Metz; Yvette Agnus; Alexandre Varnek; Maurice Gross","Unprecedented role of water in self-assembly of potential molecular tweezers","New J. Chem.","2000","24","6","371","376","10.1039/b001127o","","","1.54184","Cu-Kα","","0.034","0.034","","0.047","","0.047","","","1.439","","","1.485","","","","has coordinates","180078","2020-10-21","18:00:00",""
"7052467","12.587","0.006","14.127","0.005","11.423","0.006","92.14","0.04","112.82","0.04","111.2","0.03","1707.8","1.6","293.2","","293.2","","","","","","","","-","7","P -1","-P 1","2","","","","- C65 H58 Cl10 N2 O2 P4 Ru -","- C65 H56 Cl10 N2 O2 P4 Ru0.5 -","- C65 H56 Cl10 N2 O2 P4 Ru0.5 -","1","0.5","","Gaw, Kirsty G.; Smith, Martin B.; Slawin, Alexandra M. Z.","Molybdenum(0), ruthenium(II), palladium(II), platinum(II), copper(I) and gold(I) complexes of a new methoxy functionalised bis(phosphino)amine: synthesis and structure","New Journal of Chemistry","2000","24","6","429","","10.1039/b001458n","","","0.7107","MoKα","","0.0874","0.0874","","0.1186","","0.1186","","","6.086","","","6.086","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052513","17.802","0.004","14.255","0.004","12.199","0.003","90","","129.34","0.01","90","","2394.2","1.1","173","0.1","173","0.1","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C23 H29 Cl N2 O10 -","- C23 H29 Cl N2 O10 -","- C92 H116 Cl4 N8 O40 -","4","1","","Kiviniemi, Sari; Nissinen, Maija; Lämsä, Markku T.; Jalonen, Jorma; Rissanen, Kari; Pursiainen, Jouni","Complexation of planar, organic, five-membered cations with crown ethers","New Journal of Chemistry","2000","24","1","47","52","10.1039/a907608e","","","0.71073","MoKα","","0.0582","0.042","","","0.115","0.1208","","","","","","1.182","","","","has coordinates","210947","2020-10-21","18:00:00",""
"7052514","17.804","0.001","14.131","0.001","12.317","0.001","90","","129.003","0.003","90","","2408.1","0.3","173","0.1","173","0.1","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C23 H29 Cl N2 O10 -","- C23 H29 Cl N2 O10 -","- C92 H116 Cl4 N8 O40 -","4","1","","Kiviniemi, Sari; Nissinen, Maija; Lämsä, Markku T.; Jalonen, Jorma; Rissanen, Kari; Pursiainen, Jouni","Complexation of planar, organic, five-membered cations with crown ethers","New Journal of Chemistry","2000","24","1","47","52","10.1039/a907608e","","","0.71073","MoKα","","0.1318","0.0887","","","0.2289","0.2535","","","","","","1.124","","","","has coordinates","210947","2020-10-21","18:00:00",""
"7108002","7.0528","0.0002","8.4912","0.0002","11.6004","0.0003","107.295","0.002","101.786","0.002","90.439","0.002","647.58","0.03","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C3 H18 F Ga N2 O4 P2 -","- C3 F Ga N2 O10 P2 -","- C6 F2 Ga2 N4 O20 P4 -","2","1","","Walton, R I; Millange, F; Le Bail, A; Loiseau, T; Serre, C; O Hare, D; Ferey, G","The room-temperature crystallisation of a one-dimensional gallium fluorophosphate, Ga(HPO4)2F.H3N(CH2)3NH3.2H2O, a precursor to three-dimensional microporous gallium fluorophosphates","Chemical Communications","2000","2000","","203","204","","","","1.30041","","","","","","","","","","","","","","","","","","has coordinates","180184","2020-10-21","18:00:00",""
"7109248","6.1737","","6.1737","","8.4219","","90","","90","","90","","320.997","","","","","","","","","","","","","3","P 43 21 2","P 4nw 2abw","96","","Ag2 (Hg O2)","","- Ag2 Hg O2 -","- Ag2 Hg O2 -","- Ag8 Hg4 O8 -","4","0.5","","Deibele, Stephan; Curda, Jan; Peters, Eva-Maria; Jansen, Martin","Ag~2~HgO~2~: the first silver mercurate","Chemical Communications (Cambridge, United Kingdom)","2000","","8","679","680","10.1039/b000400f","","","","","","","","","","","","","","","","","","","","","has coordinates","210984","2020-10-21","18:00:00",""
"7110749","13.599","0.004","14.369","0.002","15.169","0.003","111.02","0.01","100.02","0.02","99.02","0.02","2646","1.1","291","2","291","2","","","","","","","","5","P 1","P 1","1","sulphonatocalix-4-arene:l-lysine complex","","","- C80 H139 N8 O57.5 S8 -","- C80 H82 N8 O57.5 S8 -","- C80 H82 N8 O57.5 S8 -","1","1","","Selkti, Mohamed; Tomas, Alain; Coleman, Anthony W.; Douteau-Guével, Nathalie; Nicolis, Ioannis; Villain, Françoise; de Rango, Colette","The first example of a substrate spanning the calix[4]arene bilayer: the solid state complex of p-sulfonatocalix[4]arene with l-lysine","Chemical Communications","2000","","2","161","","10.1039/a906546f","","","0.71073","MoKα","","0.1003","0.0863","","","0.2356","0.2553","","","","","","1.047","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110750","3.573","0.0007","18.623","0.004","23.081","0.005","90","","90","","90","","1535.8","0.6","293","2","293","2","","","","","","","","3","I m m m","-I 2 2","71","","","","- Hf27 P8 Si8 -","- Hf27 P16 -","- Hf54 P32 -","2","0.125","","Huang, Chang-Cang; Neuhausen, Jörg; Tremel, Wolfgang","Hf27Si6P10, a novel metal-rich compound with P2 groups","Chemical Communications","2000","","1","17","","10.1039/a906873b","","","0.71073","MoKα","","0.0456","0.0354","","","0.0951","0.0976","","","","","","1.008","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110751","26.975","0.003","26.975","0.003","26.975","0.003","90","","90","","90","","19628","4","200","2","200","2","","","","","","","","6","P a -3","-P 2ac 2ab 3","205","","Tetrakis(tris(trimethylsilyl)germyltetragallan_0.5 Hexakis(trimethyl- silyl)digermoxan","","- C48.5 H139 Ga4 Ge5 O0.5 Si15 -","- C46.5 H81 Ga4 Ge5 O0.51 Si15 -","- C372 H648 Ga32 Ge40 O4.08 Si120 -","8","0.333333","","Linti, Gerald; Rodig, Alexander","Facile synthesis and crystal structure of a Ga22R8 cluster","Chemical Communications","2000","","2","127","","10.1039/a907039g","","","0.71073","MoKα","","0.227","0.1081","","","0.2891","0.3309","","","","","","0.91","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"7110752","24.012","0.003","24.615","0.002","16.059","0.0012","90","","90","","90","","9491.8","1.6","199","2","199","2","","","","","","","","5","P m m n :2","-P 2ab 2a","59","","Ga22hypergermyl)8","","- C72 H216 Ga22 Ge8.25 Si24 -","- C72 H160 Ga22 Ge8.25 Si24 -","- C144 H320 Ga44 Ge16.5 Si48 -","2","0.25","","Linti, Gerald; Rodig, Alexander","Facile synthesis and crystal structure of a Ga22R8 cluster","Chemical Communications","2000","","2","127","","10.1039/a907039g","","","0.71073","MoKα","","0.1801","0.0878","","","0.1989","0.2444","","","","","","1.112","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"7110753","18.328","0.009","18.328","0.009","48.798","0.02","90","","90","","120","","14196","11","293","2","293","2","","","","","","","","7","R -3 c :H","-R 3 2""c","167","","[C66 H48 F36 Fe2 Mn3 N20 O12]n","","- C66 H48 F36 Fe2 Mn3 N20 O12 -","- C66 H48 F36 Fe2 Mn3 N20 O12 -","- C396 H288 F216 Fe12 Mn18 N120 O72 -","6","0.166667","","Lambert, François; Renault, Jean-Philippe; Policar, Clotilde; Morgenstern-Badarau, Irène; Cesario, Michèle","A polymeric, layered bimetallic Mn(ii)Fe(iii) imidazolate network; crystal structure and magnetic properties","Chemical Communications","2000","","1","35","","10.1039/a907068k","","","0.71073","MoKα","","0.1089","0.0624","","0.1823","","0.1514","","","0.93","","","1.061","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110754","7.536","0.0008","14.466","0.0014","14.0832","0.0012","90","","101.951","0.008","90","","1502","0.3","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H8 Au2 Br2 Cl2 N2 -","- C10 H8 Au2 Br2 Cl2 N2 -","- C40 H32 Au8 Br8 Cl8 N8 -","4","1","","Freytag, Matthias; Jones, Peter G.","Hydrogen bonds C‒H‥Cl as a structure-determining factor in the gold(i) complex bis(3-bromopyridine)gold(i) dichloroaurate(i)","Chemical Communications","2000","","4","277","","10.1039/a907523b","","","0.71073","MoKα","","0.0548","0.0371","","","0.0832","0.0868","","","","","","0.908","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110755","11.2881","0.0002","13.4782","0.0003","15.8181","0.0004","90","","90","","90","","2406.62","0.09","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C24 H26 Cl2 P2 Pt -","- C24 H26 Cl2 P2 Pt -","- C96 H104 Cl8 P8 Pt4 -","4","1","","He, Guosen; Qin, Ying; Mok, K. F.; Leung, Pak-Hing","Metal ion effects on the asymmetric dimerization of 1-phenyl-3,4-dimethylphosphole","Chemical Communications","2000","","2","167","","10.1039/a907846k","","","0.71073","MoKα","","0.0228","0.0199","","0.0443","0.0434","","","","0.96","0.972","0.972","","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110756","10.1464","0.0012","13.2964","0.0018","22.618","0.003","90","","90","","90","","3051.4","0.7","190","2","190","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C27 H41 N3 O6 Si -","- C27 H41 N3 O6 Si -","- C108 H164 N12 O24 Si4 -","4","1","","Al-Sehemi, Abdullah G.; Atkinson, Robert S.; Fawcett, John; Russell, David R.","Kinetic resolution of amines by acylation using 3-diacylaminoquinazolin-4(3H)-ones","Chemical Communications","2000","","1","43","","10.1039/a907970j","","","0.71073","MoKα","","0.1218","0.0521","","","0.0919","0.1141","","","","","","1.025","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110757","9.391","0.002","13.554","0.006","23.908","0.013","90","","90","","90","","3043","2","200","2","200","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C27 H41 N3 O6 Si -","- C27 H41 N3 O6 Si -","- C108 H164 N12 O24 Si4 -","4","1","","Al-Sehemi, Abdullah G.; Atkinson, Robert S.; Fawcett, John; Russell, David R.","Kinetic resolution of amines by acylation using 3-diacylaminoquinazolin-4(3H)-ones","Chemical Communications","2000","","1","43","","10.1039/a907970j","","","0.71073","MoKα","","0.2201","0.102","","","0.2351","0.3095","","","","","","1.041","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110758","12.152","0.009","13.17","0.007","18.293","0.009","90","","90","","90","","2928","3","190","2","190","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C27 H41 N3 O6 Si -","- C27 H41 N3 O6 Si -","- C108 H164 N12 O24 Si4 -","4","1","","Al-Sehemi, Abdullah G.; Atkinson, Robert S.; Fawcett, John; Russell, David R.","Kinetic resolution of amines by acylation using 3-diacylaminoquinazolin-4(3H)-ones","Chemical Communications","2000","","1","43","","10.1039/a907970j","","","0.71073","MoKα","","0.063","0.0444","","","0.0909","0.0997","","","","","","1.032","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110759","29.539","0.002","29.539","0.002","12.1044","0.0011","90","","90","","90","","10561.7","1.4","173","2","173","2","","","","","","","","6","I 41/a :2","-I 4ad","88","Compound 2b","","","- C61 H45 Cl3 N4 O3 Zn -","- C61 H42 Cl3 N4 O3 Zn -","- C488 H336 Cl24 N32 O24 Zn8 -","8","0.5","","Harmjanz, Michael; Scott, Michael J.","A convenient synthesis of porphodimethenes and their conversion to trans-porphyrins with two functionalized meso-naphthyl substituents","Chemical Communications","2000","","5","397","","10.1039/a907992k","","","0.71073","MoKα","","0.1111","0.0704","","","0.201","0.243","","","","","","1.029","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110760","25.7995","0.0013","12.7094","0.0007","17.6758","0.0009","90","","115.168","0.001","90","","5245.6","0.5","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Compound 6","","","- C63 H52 Cl2 N4 O4 -","- C63 H48 Cl2 N4 O4 -","- C252 H192 Cl8 N16 O16 -","4","0.5","","Harmjanz, Michael; Scott, Michael J.","A convenient synthesis of porphodimethenes and their conversion to trans-porphyrins with two functionalized meso-naphthyl substituents","Chemical Communications","2000","","5","397","","10.1039/a907992k","","","0.71073","MoKα","","0.0683","0.0611","","","0.1766","0.1884","","","","","","1.047","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110761","20.068","0.002","19.803","0.002","25.31","0.003","90","","92.747","0.002","90","","10046.8","1.9","130","2","130","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C209 H255 O50.5 S10.5 -","- C209 H223 O50.5 S10.5 -","- C418 H446 O101 S21 -","2","0.5","","Gibb, Corinne L. D.; Stevens, Edwin D.; Gibb, Bruce C.","The self-assembly of benzyl alcohol derived deep-cavity cavitands: a new, highly efficient moiety for irreversible assemblies?","Chemical Communications","2000","","5","363","","10.1039/a908144e","","","0.71073","MoKα","","0.253","0.1069","","","0.2697","0.3005","","","","","","0.865","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7110762","9.8722","0.0012","25.466","0.003","24.671","0.003","90","","90.047","0.003","90","","6202.4","1.3","90","2","90","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","2C~60~^.^3CS~2~","","","- C123 S6 -","- C123 S6 -","- C492 S24 -","4","1","","Olmstead, Marilyn M.; Jiang, Feilong; Balch, Alan L.","2C60·3CS2: orientational ordering accompanies the reversible phase transition at 168 K","Chemical Communications","2000","","6","483","","10.1039/a908147j","","","0.71073","MoKα","","0.115","0.0579","","","0.1061","0.1224","","","","","","0.897","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110763","12.726","0.001","13.064","0.001","6.623","0.001","90","","97.35","0.001","90","","1092","0.2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C3 H Ag2 N3 O3 -","- C3 H Ag2 N3 O3 -","- C24 H8 Ag16 N24 O24 -","8","1","","Rao, C. N. R.; Ranganathan, Anupama; Pedireddi, V. R.; Raju, A. R.","A novel hybrid layer compound containing silver sheets and an organic spacer","Chemical Communications","2000","","1","39","","10.1039/a908171b","","","0.71073","MoKα","","0.0363","0.0351","","0.0842","0.0831","","","","1.201","1.226","1.226","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110764","15.267","0.003","15.267","0.003","10.921","0.006","90","","90","","120","","2204.5","1.4","294","2","294","2","","","","","","","","5","P -3","-P 3","147","","1,7,8,11,12,15,16,24,31-Nonaaza-10,14,18-trioxo-8,9,12,13,16,17-hexahydro- 26,28,30-trinitro[6(3)](1,5,9)triphenyleno(1,3,5)cyclophane (1a)","","- C33.5 H42 Cl N12 O12 -","- C33.51 H42 Cl0.99 N12 O12 -","- C67.02 H84 Cl1.98 N24 O24 -","2","0.333333","","Wolff, J. Jens; Seibold, Uwe; Oeser, Thomas","Formation of a benzenetrienoid resonance structure in a cyclophane containing a trinitrotriaminobenzene unit","Chemical Communications","2000","","1","89","","10.1039/a908200j","","","0.71073","MoKα","","0.168","0.067","","","0.187","0.236","","","","","","0.98","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110765","19.849","0.003","19.849","0.003","79.082","0.016","90","","90","","120","","26983","8","180","2","180","2","","","","","","","Crystals were grown by recrystallization from CH3CN","9","R -3 c :H","-R 3 2""c","167","","","","- C178 H224 B3 Cl Fe2 N24 Ni2 O S6 -","- C178 H203.94 B3 Cl Fe2 N24 Ni2 O S6 -","- C1068 H1223.64 B18 Cl6 Fe12 N144 Ni12 O6 S36 -","6","0.166667","","Steinfeld, Gunther; Kersting, Berthold","Characterisation of a triply thiolate-bridged Ni‒Fe amine‒thiolate complex: insights into the electronic structure of the active site of [NiFe] hydrogenase","Chemical Communications","2000","","3","205","","10.1039/a908201h","","","0.71073","MoKα","","0.1744","0.0686","","0.2165","0.1675","","","","0.917","1.13","1.13","","","","","has coordinates,has disorder","180221","2020-10-21","18:00:00",""
"7110766","7.9504","0.0005","15.8566","0.001","16.0012","0.001","118.632","0.001","98.449","0.001","97.355","0.001","1704.97","0.19","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C13 H24 O2 S2 Si -","- C13 H24 O2 S2 Si -","- C52 H96 O8 S8 Si4 -","4","2","","Lee, Albert W. M.; Yeung, Anissa B. W.; Yuen, Mabel S. M.; Zhang, H.; Zhao, X.; Wong, W. Y.","Oligoacetylenic sulfides","Chemical Communications","2000","","1","75","","10.1039/a908220d","","","0.71073","MoKα","","0.0551","0.039","","","0.1061","0.114","","","","","","1.054","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110767","12.106","0.004","14.103","0.006","15.032","0.004","90","","90.68","0.02","90","","2566.2","1.5","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C12 H42 Fe N2 O16 P4 S -","- C12 H42 Fe N2 O16 P4 S -","- C48 H168 Fe4 N8 O64 P16 S4 -","4","0.5","","Jeffery, John C.; Odell, Barbara; Stevens, Nicola; Talbot, Robert E.","Self assembly of a novel water soluble iron(ii) macrocyclic phosphine complex from tetrakis(hydroxymethyl)phosphonium sulfate and iron(ii) ammonium sulfate: single crystal X-ray structure of the complex [Fe(H2O)2{RP(CH2N(CH2PR2)CH2)2PR}]SO4·4H2O (R = CH2OH)","Chemical Communications","2000","","1","101","","10.1039/a908309j","","","0.71073","MoKα","","0.0362","0.0299","","0.0809","0.0756","","","","0.946","1.023","1.023","","","","","has coordinates,has disorder","180221","2020-10-21","18:00:00",""
"7110768","17.79","0.02","19.78","0.01","15.047","0.005","107.32","0.04","96.18","0.03","79.05","0.05","4955","6","120.2","","120.2","","","","","","","","our lab.","4","P -1","-P 1","2","Capsule from Cavitand tetracarboxylic acid + 2-Aminopyrimidine","","","- C112 H96 N12 O28 -","- C112 H95 N12 O28 -","- C224 H190 N24 O56 -","2","1","","Kobayashi, Kenji; Shirasaka, Toshiaki; Horn, Ernst; Furukawa, Naomichi; Yamaguchi, Kentaro; Sakamoto, Shigeru","Molecular capsule constructed by multiple hydrogen bonds: self-assembly of cavitand tetracarboxylic acid with 2-aminopyrimidine","Chemical Communications","2000","","1","41","","10.1039/a908315d","","","0.7107","MoKa","","0.1097","0.1097","","","0.1245","0.1244","","","","","","4.682","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110769","9.1314","0.0002","12.7496","0.0001","14.7479","0.0003","89.48","0.001","86.249","0.001","72.419","0.001","1633.17","0.05","295","","295","","","","","","","","","7","P -1","-P 1","2","","piperazinum manganese gallium phosphate","","- C8 H26 Ga5 Mn2 N4 O33 P8 -","- C8 H26 Ga5 Mn2 N4 O33 P8 -","- C16 H52 Ga10 Mn4 N8 O66 P16 -","2","1","","Hsu, Kuei-Fang; Wang, Sue-Lein","The first mixed-valence MnII,III gallium phosphate: synthesis and structural characterization of (C4H12N2)2Mn2Ga5(H2O)(PO4)8","Chemical Communications","2000","","2","135","","10.1039/a908334k","","","0.71073","MoKα","","0.0873","0.0567","","","0.1386","0.1559","","","","","","0.981","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110770","17.518","0.004","17.524","0.004","27.033","0.005","90","","90","","90","","8299","3","293","2","293","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","{bis(acetonitrile) 1,1'-bis[(S)-(1,1'-binaphthalene-2,2'-dioxy)phosphinoxy)] -3,3',5,5'-tetra-tert-butyl-2,2'-biphenyl}copper(I) triflate","","","- C73 H70 Cu F3 N2 O9 P2 S -","- C73 H67 Cu F3 N2 O9 P2 S -","- C292 H268 Cu4 F12 N8 O36 P8 S4 -","4","1","","Yan, Ming; Zhou, Zhong-Yuan; Chan, Albert S. C.","Conjugate addition of diethylzinc to α,β-unsaturated lactones catalyzed by copper‒phosphite complexes","Chemical Communications","2000","","2","115","","10.1039/a908467c","","","0.71073","MoKα","","0.2114","0.0623","","","0.1684","0.2177","","","","","","0.893","","","","has coordinates,has disorder","180221","2020-10-21","18:00:00",""
"7110771","9.5074","0.0002","9.5074","0.0002","29.7005","0.0004","90","","90","","120","","2324.97","0.08","150","2","150","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C38 H54 F6 N8 O6 S2 Tl2 -","- C38 H54 F6 N8 O6 S2 Tl2 -","- C76 H108 F12 N16 O12 S4 Tl4 -","2","0.166667","","Howarth, Oliver W.; Nelson, Jane; McKee, Vickie","Steric constraint generating large through-space 1H–203,205Tl coupling in a dithallium(I) cryptate","Chemical Communications","2000","","1","21","","10.1039/a908476b","","","0.6885","Synchrotron","","0.0542","0.0357","","","0.0788","0.0835","","","","","","1.06","","","","has coordinates,has disorder","288183","2023-12-08","14:43:00",""
"7110772","16.399","0.005","8.691","0.003","19.809","0.005","90","","91.77","0.02","90","","2821.9","1.5","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Ir(κ^4^(N,N,N,C^Ph2^)-Tp^Ph^)(ethyl)(η^2^-ethene)","(κ^4^(N,N',N'',C^Ph2^)-hydrogen tris(3-phenylpyrazol-1-yl)borato)- (κ^1^-ethyl)-(η^2^-ethene)-iridium","","- C31 H30 B Ir N6 -","- C31 H30 B Ir N6 -","- C124 H120 B4 Ir4 N24 -","4","1","","Slugovc, Christian; Carmona, Ernesto; Mereiter, Kurt; Trofimenko, Swiatoslaw","Unprecedented pentadenticity of the HB(3-Phpz)3 (= TpPh) ligand","Chemical Communications","2000","","2","121","","10.1039/a908478i","","","0.71073","MoKα","","0.036","0.0321","","","0.0623","0.0636","","","","","","1.381","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110773","9.543","0.002","12.043","0.004","13.941","0.004","85.35","0.02","77.78","0.02","78.63","0.02","1533.9","0.8","223","2","223","2","","","","","","","","5","P -1","-P 1","2","Ir(κ^5^(N,N,N,C^Ph2^,C^Ph2^)-Tp^Ph^)(κ^1^(N^1^)-3-phenylpyrazole)","(κ^5^(N,N',N'',C^Ph2^,C'^Ph2^)-hydrogen-tris(3-phenylpyrazol-1-yl)borato)- (κ^1^(N^1^)-3-phenylpyrazole)-iridium","","- C36 H28 B Ir N8 -","- C36 H28 B Ir N8 -","- C72 H56 B2 Ir2 N16 -","2","1","","Slugovc, Christian; Carmona, Ernesto; Mereiter, Kurt; Trofimenko, Swiatoslaw","Unprecedented pentadenticity of the HB(3-Phpz)3 (= TpPh) ligand","Chemical Communications","2000","","2","121","","10.1039/a908478i","","","0.71073","MoKα","","0.0208","0.0176","","","0.0406","0.0423","","","","","","1.071","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110774","14.992","","7.1841","0.0001","15.4819","0.0002","90","","92.427","0.001","90","","1665.97","0.03","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C36 H51 O3 Re -","- C36 H51 O3 Re -","- C72 H102 O6 Re2 -","2","1","","Le Bideau, Franck; Kaloum, El Bachir; Haquette, Pierre; Kernbach, Ulrich; Stephan, Elie; Top, Siden; Vessières, Anne; Jaouen, Gérard; Marrot, Jérôme","New and efficient routes to CpRe(CO)3 substituted steroids","Chemical Communications","2000","","3","211","","10.1039/a908481i","","","0.71073","MoKα","","0.0623","0.0448","","","0.1002","0.1103","","","","","","0.893","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110775","16.981","0.004","13.527","0.004","26.399","0.004","89.99","0.03","98.75","0.01","90.01","0.03","5993","2","273.2","","273.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C68 H52 Au Cl P4 -","- C68 H52 Au Cl2 P4 -","- C272 H208 Au4 Cl8 P16 -","4","1","","Wing-Wah Yam, Vivian; Chan, Chui-Ling; Wing-Kin Choi, Sam; Man-Chung Wong, Keith; Chung-Chin Cheng, Eddie; Yu, Sze-Chit; Ng, Po-King; Chan, Wai-Kin; Cheung, Kung-Kai","Synthesis, photoluminescent and electroluminescent behaviour of four-coordinate tetrahedral gold(i) complexes. X-Ray crystal structure of [Au(dppn)2]Cl","Chemical Communications","2000","","1","53","","10.1039/a908521a","","","0.7107","MoKalpha","","","0.0601","","","0.0878","","","","","2.792","2.792","","","","","has coordinates","288197","2023-12-08","18:09:39",""
"7110776","46.768","0.009","14.34","0.003","25.945","0.005","90","","90.21","0.03","90","","17400","6","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C65 H68 N13 Ni2.5 O41.5 P W12 -","- C65 H52 N13 Ni2.5 O41.5 P W12 -","- C520 H416 N104 Ni20 O332 P8 W96 -","8","1","","Xu, Yan; Zhang, Kou-Lin; Zhang, Yong; You, Xiao-Zeng; Xu, Ji-Qing","Keggin unit supported transition metal complexes: hydrothermal synthesis and characterization of [Ni(2,2′-bipy)3]1.5[PW12O40Ni(2,2′-bipy)2(H2O)]·0.5H2O and [Co(1,10′-phen)3]1.5[PMo12O40Co(1,10′-phen)2(H2O)]·0.5H2O","Chemical Communications","2000","","2","153","","10.1039/a908527k","","","0.71073","MoKα","","0.1067","0.0732","","0.1984","0.1827","","","","1.033","1.216","1.216","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110777","8.1781","0.0013","9.9339","0.0017","11.7055","0.0019","76.183","0.019","84.449","0.019","69.386","0.018","864.2","0.3","160","2","160","2","","","","","","","","4","P 1","P 1","1","","","","- C36 H72 P2 Ru -","- C36 H72 P2 Ru -","- C36 H72 P2 Ru -","1","1","","Borowski, Andrzej F.; Donnadieu, Bruno; Daran, Jean-Claude; Sabo-Etienne, Sylviane; Chaudret, Bruno","X-Ray crystal structure of the bis(dihydrogen) complex RuH2(H2)2(PCy3)2","Chemical Communications","2000","","7","543","","10.1039/a908567j","","","0.71073","MoKα","","0.039","0.0308","","","0.076","0.0798","","","","","","1.029","","","","has coordinates","181910","2020-10-21","18:00:00",""
"7110778","37.705","0.008","10.99","0.002","18.178","0.004","90","","106.48","0.03","90","","7223","3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C38 H29 B F15 Ti -","- C38 H29 B F15 Ti -","- C304 H232 B8 F120 Ti8 -","8","1","","Burlakov, Vladimir V.; Shur, Vladimir B.; Pellny, Paul-Michael; Arndt, Perdita; Baumann, Wolfgang; Spannenberg, Anke; Rosenthal, Uwe","Reactions of permethylmetallocene alkyne complexes of titanium and zirconium with tris(perfluorophenyl)borane","Chemical Communications","2000","","3","241","","10.1039/a908591b","","","0.71073","MoKα","","0.1184","0.0523","","0.1159","0.1027","","","","0.845","1.11","1.11","","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110779","12.827","0.003","18.862","0.004","19.499","0.004","90","","94.26","0.03","90","","4704.6","1.8","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C49 H44 B F15 Si Zr -","- C49 H44 B F15 Si Zr -","- C196 H176 B4 F60 Si4 Zr4 -","4","1","","Burlakov, Vladimir V.; Shur, Vladimir B.; Pellny, Paul-Michael; Arndt, Perdita; Baumann, Wolfgang; Spannenberg, Anke; Rosenthal, Uwe","Reactions of permethylmetallocene alkyne complexes of titanium and zirconium with tris(perfluorophenyl)borane","Chemical Communications","2000","","3","241","","10.1039/a908591b","","","0.71073","MoKα","","0.1292","0.0452","","0.0744","0.0607","","","","0.717","0.936","0.936","","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110780","23.76","0.02","24.07","0.03","15.01","0.01","92","0.1","96.25","0.07","93.7","0.09","8508","14","296.2","","296.2","","","","","","","","","4","P -1","-P 1","2","","","","- C180 H204 O18 Si9 -","- C179.5 H172 O18 Si9 -","- C359 H344 O36 Si18 -","2","1","","Pschirer, Neil G.; Fu, Wei; Adams, Richard D.; Bunz, Uwe H. F.","Ring-closing alkyne metathesis with simple catalyst systems: an access to molecular triangles and rhomboids","Chemical Communications","2000","","1","87","","10.1039/a908638b","","","0.7107","MoKα","","0.0911","0.0911","","0.1261","","0.1261","","","2.316","","","2.316","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110781","13.977","0.008","14.25","0.01","12.144","0.007","106.29","0.05","108.21","0.05","69.68","0.05","2114","2","293.2","","293.2","","","","","","","","","4","P -1","-P 1","2","","","","- C40 H88 O4 Si2 -","- C46 H58 O4 Si2 -","- C92 H116 O8 Si4 -","2","1","","Pschirer, Neil G.; Fu, Wei; Adams, Richard D.; Bunz, Uwe H. F.","Ring-closing alkyne metathesis with simple catalyst systems: an access to molecular triangles and rhomboids","Chemical Communications","2000","","1","87","","10.1039/a908638b","","","0.7107","MoKα","","0.0599","0.0599","","0.0814","","0.0814","","","1.755","","","1.755","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110782","22.306","0.002","9.9944","0.0009","16.0091","0.0015","90","","90","","90","","3569","0.6","173","2","173","2","","","","","","","Prof. Timothy P. Hanusa, Vanderbilt U","6","P n a 21","P 2c -2n","33","99141","","","- C28 H61 B Ca O2 Si3 -","- C28 H61 B Ca O2 Si3 -","- C112 H244 B4 Ca4 O8 Si12 -","4","1","","Harvey, Melanie J.; Hanusa, Timothy P.; Pink, Maren","Unusual stability of the coordinated triethylborohydride anion in an alkaline-earth metal complex: crystallographic characterization of [Ca(HBEt3){1,2,4-C5(SiMe3)3H2}(thf)2]","Chemical Communications","2000","","6","489","","10.1039/a908674i","","","0.71073","MoKα","","0.079","0.049","","0.1316","0.1175","","","","0.963","1.037","1.037","","","","","has coordinates,has disorder","180221","2020-10-21","18:00:00",""
"7110783","7.6","0.001","18.395","0.001","18.566","0.004","90","","90","","90","","2595.6","0.7","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C27 H28 O5 S4 -","- C27 H27.216 O5 S4 -","- C108 H108.864 O20 S16 -","4","1","","Bryce, Martin R.; Batsanov, Andrei S.; Finn, Terry; Hansen, Thomas K.; Howard, Judith A. K.; Kamenjicki, Marta; Lednev, Igor K.; Asher, Sanford A.","Crown-annelated 9,10-bis(1,3-dithiol-2-ylidene)-9,10-dihydroanthracene derivatives: a new efficient transducer in the electrochemical and spectroscopic monitoring of metal complexation","Chemical Communications","2000","","4","295","","10.1039/a908716h","","","0.71073","MoKα","","0.0453","0.0378","","0.0827","0.0743","","","","1.175","1.146","1.146","","","","","has coordinates,has disorder","180221","2020-10-21","18:00:00",""
"7110784","11.891","0.002","12.546","0.001","12.691","0.002","104.928","0.004","97.021","0.005","106.602","0.004","1713.5","0.4","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C33 H36 Cl2 O4 S6 -","- C33 H36 Cl2 O4 S6 -","- C66 H72 Cl4 O8 S12 -","2","1","","Bryce, Martin R.; Batsanov, Andrei S.; Finn, Terry; Hansen, Thomas K.; Howard, Judith A. K.; Kamenjicki, Marta; Lednev, Igor K.; Asher, Sanford A.","Crown-annelated 9,10-bis(1,3-dithiol-2-ylidene)-9,10-dihydroanthracene derivatives: a new efficient transducer in the electrochemical and spectroscopic monitoring of metal complexation","Chemical Communications","2000","","4","295","","10.1039/a908716h","","","0.71073","MoKα","","0.0476","0.037","","0.0889","0.0737","","","","1.176","1.125","1.125","","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110785","7.609","0.0006","11.0873","0.001","10.764","0.0009","90","","91.687","0.007","90","","907.69","0.13","298","2","298","2","","","","","","","","7","P 1 21/m 1","-P 2yb","11","{Cu^II^[14]aneS~4~-OBF~3~}(BF~4~)","[14]aneS~4~-6-oxy(trifluoro)borato-S,S,S,S,-mu-O-copper(II) tetrafluoroborate","","- C10 H19 B2 Cu F7 O S4 -","- C10 H19 B2 Cu F7 O S4 -","- C20 H38 B4 Cu2 F14 O2 S8 -","2","0.5","","Sutton, Liam R.; Blake, Alexander J.; Cooke, Paul A.; Schröder, Martin","A novel alkoxide bridging motif between boron trifluoride and copper(ii) in a crown thioether complex","Chemical Communications","2000","","7","563","","10.1039/a908778h","","","0.71073","MoKα","","0.0586","0.0464","","","0.1182","0.1325","","","","","","1.1","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"7110786","11.039","0.004","12.001","0.004","16.651","0.006","95.81","0.04","91.38","0.04","108.77","0.03","2074.1","1.3","193","2","193","2","","","","","","","","4","P -1","-P 1","2","","","","- C36 H72 N9 P3 -","- C36 H72 N9 P3 -","- C72 H144 N18 P6 -","2","1","","Lawson, Gavin T.; Rivals, Frederic; Tascher, Mathieu; Jacob, Chacko; Bickley, Jamie F.; Steiner, Alexander","cis-Trihydrogen cyclotriphosphazenates—acidic anions in strongly basic media","Chemical Communications","2000","","5","341","","10.1039/a908954c","","","0.71073","MoKα","","0.1726","0.0611","","","0.116","0.1453","","","","","","1.016","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110787","25.993","0.005","17.674","0.004","20.639","0.004","90","","109.81","0.03","90","","8920","4","200","2","200","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C79 H146 Li6 N18 P6 -","- C79 H138 Li6 N18 P6 -","- C316 H552 Li24 N72 P24 -","4","0.5","","Lawson, Gavin T.; Rivals, Frederic; Tascher, Mathieu; Jacob, Chacko; Bickley, Jamie F.; Steiner, Alexander","cis-Trihydrogen cyclotriphosphazenates—acidic anions in strongly basic media","Chemical Communications","2000","","5","341","","10.1039/a908954c","","","0.71073","MoKα","","0.1117","0.0684","","","0.1991","0.2098","","","","","","0.997","","","","has coordinates,has disorder","180221","2020-10-21","18:00:00",""
"7110788","21.62","0.003","21.62","0.003","61.49","0.012","90","","90","","120","","24891","7","200","2","200","2","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","","","- C76 H113 Li3 N9 O10 P3 -","- C75.96 H112.92 Li3 N9 O9.99 P3 -","- C911.52 H1355.04 Li36 N108 O119.88 P36 -","12","0.333333","","Lawson, Gavin T.; Rivals, Frederic; Tascher, Mathieu; Jacob, Chacko; Bickley, Jamie F.; Steiner, Alexander","cis-Trihydrogen cyclotriphosphazenates—acidic anions in strongly basic media","Chemical Communications","2000","","5","341","","10.1039/a908954c","","","0.71073","MoKα","","0.0856","0.0591","","","0.1555","0.1661","","","","","","0.873","","","","has coordinates,has disorder","180221","2020-10-21","18:00:00",""
"7110789","19.409","0.004","9.887","0.002","17.947","0.004","90","","109.98","0.03","90","","3236.7","1.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H18 Mo N2 O12 Ru3 -","- C28 H18 Mo N2 O12 Ru3 -","- C112 H72 Mo4 N8 O48 Ru12 -","4","1","","Ali, Shahbano; Deeming, Antony J.; Hogarth, Graeme; Carty, Arthur J.; Enright, Gary D.","Clusters containing metal‒metal bonds linking high- and low-valent metal centres: synthesis and structure of Ru3(CO)12{Mo(NAr)2}","Chemical Communications","2000","","2","123","","10.1039/a908982i","","","0.71073","MoKα","","0.0244","0.0192","","0.0465","0.0441","","","","1.02","1.045","1.045","","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110790","21.573","0.002","21.075","0.002","30.19","0.005","90","","97.766","0.008","90","","13600","3","296","2","296","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C71 H185 I2 Mo10 N15 O39 S10 -","- C61 I2 Mo10 N12 O36 S10 -","- C244 I8 Mo40 N48 O144 S40 -","4","1","","Cadot, Emmanuel; Salignac, Bernadette; Marrot, Jérôme; Dolbecq, Anne; Sécheresse, Francis","[Mo10S10O10(OH)10(H2O)5]: a novel decameric molecular ring showing supramolecular properties","Chemical Communications","2000","","4","261","","10.1039/a909024j","","","0.71073","MoKα","","0.1938","0.0782","","0.2829","0.179","","","","1.074","1.087","1.087","","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110791","24.2853","0.0005","19.1082","0.0007","11.9631","0.0004","90","","108.051","0.002","90","","5278.2","0.3","173","","173","","","","","","","","","8","C 1 2/m 1","-C 2y","12","","","","- C95 H110 Ag4 Cl6 F24 N8 O4 P4 -","- C89 H76 Ag2 Cl8 F24 N6 P4 -","- C178 H152 Ag4 Cl16 F48 N12 P8 -","2","0.25","","Kleina, Cédric; Graf, Ernest; Hosseini, Mir Wais; De Cian, André; Fischer, Jean","Metallatubulane: synthesis and structural analysis of an infinite tubular coordination network formed by the self-assembly of a tetracyanocyclophane and silver cations","Chemical Communications","2000","","3","239","","10.1039/a909029k","","","0.71073","Mo-Kα","","0.097","0.063","","0.141","","0.083","","","2.527","","","1.521","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110792","17.1243","0.0002","17.1243","0.0002","7.3816","0.0001","90","","90","","90","","2164.59","0.05","123","2","123","2","","","","","","","","4","P 42/m b c","-P 4c 2ab","135","","cobalt bis(dicyanamide) 2-amino-pyrimidine","","- C8 H5 Co N9 -","- C8 H5 Co N9 -","- C64 H40 Co8 N72 -","8","0.5","","Jensen, Paul; Batten, Stuart R.; Moubaraki, Boujemaa; Murray, Keith S.","Infinite molecular tubes: structure and magnetism of M(dca)2(apym) [M = Co, Ni, apym = 2-aminopyrimidine, dca = dicyanamide, N(CN)2−]","Chemical Communications","2000","","9","793","","10.1039/a909067c","","","0.71073","MoKα","","0.0401","0.0279","","","0.0579","0.0626","","","","","","1.099","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110793","17.2018","0.0004","17.2018","0.0004","7.3742","0.0002","90","","90","","90","","2182.04","0.09","295","2","295","2","","","","","","","","4","P 42/m b c","-P 4c 2ab","135","","cobalt bis(dicyanamide) 2-amino-pyrimidine","","- C8 H5 Co N9 -","- C8 H5 Co N9 -","- C64 H40 Co8 N72 -","8","0.5","","Jensen, Paul; Batten, Stuart R.; Moubaraki, Boujemaa; Murray, Keith S.","Infinite molecular tubes: structure and magnetism of M(dca)2(apym) [M = Co, Ni, apym = 2-aminopyrimidine, dca = dicyanamide, N(CN)2−]","Chemical Communications","2000","","9","793","","10.1039/a909067c","","","0.71073","MoKα","","0.1142","0.0706","","","0.0781","0.0847","","","","","","1.198","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110794","17.0863","0.0006","17.0863","0.0006","7.3099","0.0002","90","","90","","90","","2134.06","0.12","297","2","297","2","","","","","","","","4","P 42/m b c","-P 4c 2ab","135","","nickel bis(dicyanamide) 2-amino-pyrimidine","","- C8 H5 N9 Ni -","- C8 H5 N9 Ni -","- C64 H40 N72 Ni8 -","8","0.5","","Jensen, Paul; Batten, Stuart R.; Moubaraki, Boujemaa; Murray, Keith S.","Infinite molecular tubes: structure and magnetism of M(dca)2(apym) [M = Co, Ni, apym = 2-aminopyrimidine, dca = dicyanamide, N(CN)2−]","Chemical Communications","2000","","9","793","","10.1039/a909067c","","","0.71073","MoKα","","0.1013","0.053","","","0.0867","0.101","","","","","","1.092","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110795","9.167","0.001","12.544","0.001","16.019","0.002","73.34","0.02","86.47","0.03","71.06","0.02","1668.2","0.4","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H6 O7 Re2 S -","- C15 H6 O7 Re2 S -","- C60 H24 O28 Re8 S4 -","4","2","","Reynolds, Michael A.; Angelici, Robert J.; Guzei, Ilia A.","Organometallic models of catalytic hydrodesulfurization: Re2(CO)10-promoted cleavage of C‒S bonds in benzothiophene","Chemical Communications","2000","","6","513","","10.1039/a909161k","","","0.71073","MoKα","","0.0484","0.0311","","","0.0796","0.0877","","","","","","1.067","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110796","8.111","0.0004","27.1151","0.0013","12.349","0.0006","90","","102.086","0.001","90","","2655.7","0.2","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H24 O7 P2 Re2 S -","- C21 H24 O7 P2 Re2 S -","- C84 H96 O28 P8 Re8 S4 -","4","1","","Reynolds, Michael A.; Angelici, Robert J.; Guzei, Ilia A.","Organometallic models of catalytic hydrodesulfurization: Re2(CO)10-promoted cleavage of C‒S bonds in benzothiophene","Chemical Communications","2000","","6","513","","10.1039/a909161k","","","0.71073","MoKα","","0.0407","0.0231","","","0.0331","0.0353","","","","","","0.885","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110797","9.69","0.0004","25.4267","0.0012","25.8065","0.0013","90","","90","","90","","6358.3","0.5","173","2","173","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C24 H33 O7 P3 Re2 S -","- C24 H33 O7 P3 Re2 S -","- C192 H264 O56 P24 Re16 S8 -","8","1","","Reynolds, Michael A.; Angelici, Robert J.; Guzei, Ilia A.","Organometallic models of catalytic hydrodesulfurization: Re2(CO)10-promoted cleavage of C‒S bonds in benzothiophene","Chemical Communications","2000","","6","513","","10.1039/a909161k","","","0.71073","MoKα","","0.0467","0.0242","","","0.0327","0.0349","","","","","","1.007","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110798","26.0641","0.0016","26.091","0.0016","53.291","0.003","90","0.001","102.473","0.001","90","0.001","35385","4","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C121.14 H122.71 Cl6 Mn9 N57.57 O47 -","- C121.06 H75.59 Cl6.388 Mn9 N57.53 O50.052 -","- C968.48 H604.72 Cl51.104 Mn72 N460.24 O400.416 -","8","1","","Zhao, Liang; Matthews, Craig J.; Thompson, Laurence K.; Heath, Sarah L.","A novel magnetically coupled nonamanganese(ii) 3 ×3 portcullis-like grid involving just oxygen bridges, generated by strict self assembly of the metal cation and a single heptadentate ligand","Chemical Communications","2000","","4","265","","10.1039/a909180g","","","0.71073","MoKα","","0.1968","0.1419","","","0.3936","0.4232","","","","","","1.424","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110799","10.7307","0.0007","15.0753","0.0009","16.8818","0.001","95.727","0.001","94.86","0.001","93.915","0.002","2699.4","0.3","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C40 H50 N4 O8 -","- C42.6667 H37.8333 N4 O8 -","- C128 H113.5 N12 O24 -","3","1.5","","MacGillivray, Leonard R.; Diamente, Peter R.; Reid, Jennifer L.; Ripmeester, John A.","Encapsulation of two aromatics by a carcerand-like capsule of nanometre-scale dimensions","Chemical Communications","2000","","5","359","","10.1039/a909339g","","","0.7107","MoKα","","0.1491","0.0719","","0.2347","0.1863","","","","0.96","1.151","1.151","","","","","has coordinates,has disorder","180221","2020-10-21","18:00:00",""
"7110800","8.383","0.003","58.887","0.005","14.673","0.003","90","","90","","90","","7243","3","296.2","","296.2","","","","","","","","","4","P c c n","-P 2ab 2ac","56","","","","- C30 H61 N5 O6 -","- C30 H61 N5 O6 -","- C240 H488 N40 O48 -","8","1","","Danby, Andrew; Seib, Larry; Bowman-James, Kristin; Alcock, Nathaniel W.","Novel structural determination of a bilayer network formed by a tripodal lipophilic amide in the presence of anions","Chemical Communications","2000","","11","973","","10.1039/a909341i","","","1.5418","CuKα","","0.1473","0.063","","0.068","","0.063","","","2.291","","","3.17","","","","has coordinates","193981","2020-10-21","18:00:00",""
"7110801","8.519","0.004","14.081","0.003","14.262","0.006","95.6","0.02","94.51","0.05","91.88","0.03","1696","1.1","296.2","","296.2","","","","","","","","","4","P -1","-P 1","2","","","","- C27 H38 Ir2 Se8 -","- C27 H38 Ir2 Se8 -","- C54 H76 Ir4 Se16 -","2","1","","Nagao, Shoken; Seino, Hidetake; Mizobe, Yasushi; Hidai, Masanobu","Syntheses of a dinuclear Ir complex containing bridging tetraselenide ligands [(C5Me5)Ir(μ-Se4)2Ir(C5Me5)] and its conversion into Ir2Pd2Se3 and Ir2Pd3Se5 clusters","Chemical Communications","2000","","3","207","","10.1039/a909403b","","","0.7107","MoKα","","0.0567","0.0567","","","0.059","0.059","","","","","","1.543","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110802","18.884","0.004","11.066","0.001","26.778","0.002","90","","104.843","0.008","90","","5409.1","1.3","296.2","","296.2","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C56 H60 Ir2 P2 Pd2 Se3 -","- C56 H60 Ir2 P2 Pd2 Se3 -","- C224 H240 Ir8 P8 Pd8 Se12 -","4","1","","Nagao, Shoken; Seino, Hidetake; Mizobe, Yasushi; Hidai, Masanobu","Syntheses of a dinuclear Ir complex containing bridging tetraselenide ligands [(C5Me5)Ir(μ-Se4)2Ir(C5Me5)] and its conversion into Ir2Pd2Se3 and Ir2Pd3Se5 clusters","Chemical Communications","2000","","3","207","","10.1039/a909403b","","","0.7107","MoKα","","0.0433","0.0433","","","0.0424","0.0424","","","","","","1.767","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110803","14.789","0.003","16.151","0.003","17.59","0.002","94.48","0.01","99.85","0.01","108.86","0.01","3877","1.2","296.2","","296.2","","","","","","","","","6","P -1","-P 1","2","","","","- C80 H81 Ir2 P3 Pd3 Se5 -","- C80 H81 Ir2 P3 Pd3 Se5 -","- C160 H162 Ir4 P6 Pd6 Se10 -","2","1","","Nagao, Shoken; Seino, Hidetake; Mizobe, Yasushi; Hidai, Masanobu","Syntheses of a dinuclear Ir complex containing bridging tetraselenide ligands [(C5Me5)Ir(μ-Se4)2Ir(C5Me5)] and its conversion into Ir2Pd2Se3 and Ir2Pd3Se5 clusters","Chemical Communications","2000","","3","207","","10.1039/a909403b","","","0.7107","MoKα","","0.0334","0.0334","","","0.0742","0.0742","","","","","","1.884","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110804","25.399","0.005","34.717","0.005","25.74","0.03","90","","90","","90","","22697","3","100","","100","","","","","","","","synthesis (from BACHEM)","5","P 21 21 21","P 2ac 2ab","19","BQ123","Endothelin inhibitor BQ123 Na: cyclo(-D-Trp-D-Asp-Pro-D-Val-Leu-),Na","","- C148 H248 N24 Na4 O46 -","- C144.888 H222.368 N25 Na4 O45.376 -","- C579.552 H889.472 N100 Na16 O181.504 -","4","1","","Doi, Mitsunobu; Ishida, Toshimasa; Katsuya, Yoshio; Mezaki, Yoshihiro; Sasaki, Masahiro; Terashima, Akira; Taniguchi, Taizo; Hasegawa, Hiroshi; Shiono, Masaaki","Unique sodium-caged structure of a potent endothelin-1 inhibitor: crystal structure of BQ123 sodium salt, cyclo(-d-Trp-d-Asp−-Pro-d-Val-Leu-)·Na+","Chemical Communications","2000","","9","743","","10.1039/a909413j","","","0.834","doublemonochromatedbeam","","0.0918","0.0845","","","0.2146","0.2241","","","","","","1.044","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110805","19.6636","0.0001","12.6712","0.0002","19.7853","0.0003","90","","104.432","0.0001","90","","4774.17","0.11","173","2","173","2","","","","","","","","2","P 1 21 1","P 2yb","4","","","","- C18 H24 -","- C18 H24 -","- C216 H288 -","12","6","","Rheingold, Arnold L.; Figueroa, Joshua S.; Dybowski, Cecil; Beckmann, Peter A.","Superlattices, polymorphs and solid-state NMR spin‒lattice relaxation (T1) measurements of 2,6-di-tert-butylnaphthalene","Chemical Communications","2000","","8","651","","10.1039/a909449k","","","0.71073","MoKα","","0.1935","0.1368","","","0.3685","0.4491","","","","","","2.061","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110806","11.3649","0.0004","9.9406","0.0003","6.6728","0.0002","90","","93.943","0.002","90","","752.07","0.04","223","2","223","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- C18 H24 -","- C18 H24 -","- C36 H48 -","2","0.5","","Rheingold, Arnold L.; Figueroa, Joshua S.; Dybowski, Cecil; Beckmann, Peter A.","Superlattices, polymorphs and solid-state NMR spin‒lattice relaxation (T1) measurements of 2,6-di-tert-butylnaphthalene","Chemical Communications","2000","","8","651","","10.1039/a909449k","","","0.71073","MoKα","","0.1192","0.0746","","0.2427","0.1724","","","","0.97","1.162","1.162","","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110807","18.704","0.0016","18.4955","0.0016","20.3393","0.0017","90","","92.588","0.002","90","","7029","1","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C72 H103 Ga3 P2 -","- C72 H103 Ga3 P2 -","- C288 H412 Ga12 P8 -","4","1","","Li, Xiao-Wang; Wei, Pingrong; Beck, Brent C.; Xie, Yaoming; Schaefer III, Henry F.; Su, Jianrui; Robinson, Gregory H.","Synthesis and molecular structure of an unusual ‒Ga‒Ga‒Ga‒ linked organometallic","Chemical Communications","2000","","6","453","","10.1039/a909451b","","","0.71073","MoKα","","0.1665","0.0637","","","0.1359","0.1711","","","","","","1.088","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110808","9.126","0.002","7.223","0.001","21.45","0.004","90","","91.54","0.03","90","","1413.4","0.5","95","2","95","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H18 Cl N O3 Si -","- C12 H18 Cl N O3 Si -","- C48 H72 Cl4 N4 O12 Si4 -","4","1","","Bassindale, Alan R.; Parker, David J.; Taylor, Peter G.; Auner, Norbert; Herrschaft, Bernhard","The X-ray structure of a protonated hypervalent silanol","Chemical Communications","2000","","7","565","","10.1039/a909504g","","","0.71073","MoKα","","0.0502","0.0461","","","0.125","0.1284","","","","","","0.938","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110809","13.302","0.004","13.306","0.006","15.23","0.01","83.69","0.05","64.46","0.04","66.14","0.03","2218","2","298","","298","","","","","","","","","6","P -1","-P 1","2","","","","- C35 H55 Cl5 Eu N9 O12 -","- C35 H38 Cl5 Eu N9 O12 -","- C70 H76 Cl10 Eu2 N18 O24 -","2","1","","Bazzicalupi, Carla; Bencini, Andrea; Bianchi, Antonio; Giorgi, Claudia; Masotti, Andrea; Valtancoli, Barbara; Fusi, Vieri; Roque, Ana; Pina, Fernando","pH Modulation of the luminescence emission of a new europium cryptate complex","Chemical Communications","2000","","7","561","","10.1039/a909581k","","","0.71069","MoKα","","0.1418","0.0769","","0.2364","0.1973","","","","1.037","1.089","1.089","","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110810","22.1929","0.0016","14.8355","0.0018","23.8561","0.0013","90","","99.46","0.006","90","","7747.6","1.2","153","2","153","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C80 H60 Ag2 B2 Cl1.5 F8 N1.5 O3 P6 -","- C79.99 H60 Ag2 B1.998 Cl1.5 F8 N1.49 O2.98 P6 -","- C319.96 H240 Ag8 B7.992 Cl6 F32 N5.96 O11.92 P24 -","4","1","","James, Stuart L.; Lozano, Elvira; Nieuwenhuyzen, Mark","Triply-bridged diphos disilver helical complexes [Ag2(μ2-dppa-P,P′)3(anion)2] [dppa = bis(diphenylphosphino)acetylene]","Chemical Communications","2000","","7","617","","10.1039/a909683c","","","0.71073","MoKα","","0.0674","0.0448","","","0.0963","0.1067","","","","","","1.013","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7110811","14.927","0.003","8.8708","0.0012","15.795","0.003","90","","97.735","0.015","90","","2072.5","0.6","150","2","150","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C42 H34 Cl2 O8 P2 U -","- C42 H34 Cl2 O8 P2 U -","- C84 H68 Cl4 O16 P4 U2 -","2","1","","Saunders, Gregory D.; Foxon, Simon P.; Walton, Paul H.; Joyce, Malcolm J.; Port, Simon N.","A selective uranium extraction agent prepared by polymer imprinting","Chemical Communications","2000","","4","273","","10.1039/a909691d","","","0.71069","MoKα","","0.0645","0.034","","","0.0769","0.0871","","","","","","1.007","","","","has coordinates,has disorder","180222","2020-10-21","18:00:00",""
"7110812","13.6982","0.0017","30.091","0.004","25.195","0.003","90","","90","","90","","10385","2","193","2","193","2","","","","","","","","6","C 2 2 21","C 2c 2","20","","","","- C66 H66 Cl14 N32 O36 Zn4 -","- C66 H66 Cl14 N32 O36 Zn4 -","- C264 H264 Cl56 N128 O144 Zn16 -","4","0.5","","Bu, Xian-He; Tanaka, Kentaro; Shionoya, Mitsuhiko; Biradha, Kumar; Morishita, Hiromasa; Furusho, Sanae","A spontaneously resolved chiral molecular box: a cyclic tetranuclear ZnII complex with DPTZ (DPTZ = 3,6-di-2-pyridyl-1,2,4,5-tetrazine)","Chemical Communications","2000","","11","971","","10.1039/a909742b","","","0.71073","MoKα","","0.088","0.0499","","","0.1105","0.1218","","","","","","0.925","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110813","18.4773","0.0007","11.7424","0.0005","26.0855","0.001","90","","107.794","0.001","90","","5389","0.4","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C64 H60 Fe N4 O9 -","- C64 H60 Fe N4 O9 -","- C256 H240 Fe4 N16 O36 -","4","1","","MacGillivray, Leonard R.; Spinney, Heather A.; Reid, Jennifer L.; Ripmeester, John A.","Entrapment of ferrocenes within supramolecular, deep-cavity resorcin[4]arenes","Chemical Communications","2000","","6","517","","10.1039/a909745g","","","0.7107","MoKα","","0.0522","0.0338","","0.0931","0.0843","","","","1.066","1.126","1.126","","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110814","18.8082","0.0009","11.9478","0.0006","25.5945","0.0011","90","","108.306","0.001","90","","5460.4","0.4","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C66 H62 Fe N4 O10 -","- C66 H62 Fe N4 O10 -","- C264 H248 Fe4 N16 O40 -","4","1","","MacGillivray, Leonard R.; Spinney, Heather A.; Reid, Jennifer L.; Ripmeester, John A.","Entrapment of ferrocenes within supramolecular, deep-cavity resorcin[4]arenes","Chemical Communications","2000","","6","517","","10.1039/a909745g","","","0.7107","MoKα","","0.0588","0.0443","","0.1168","0.1082","","","","1.055","1.115","1.115","","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110815","9.7302","0.0013","25.44","0.003","10.8246","0.0014","90","","110.71","0.003","90","","2506.3","0.6","173","2","173","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C62 H58 Fe N4 O8 -","- C62 H58 Fe N4 O8 -","- C124 H116 Fe2 N8 O16 -","2","0.5","","MacGillivray, Leonard R.; Spinney, Heather A.; Reid, Jennifer L.; Ripmeester, John A.","Entrapment of ferrocenes within supramolecular, deep-cavity resorcin[4]arenes","Chemical Communications","2000","","6","517","","10.1039/a909745g","","","0.7107","MoKα","","0.1986","0.09","","","0.2075","0.2451","","","","","","0.941","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110816","10.327","0.002","15.066","0.003","16.698","0.004","110.738","0.004","92.948","0.004","92.182","0.004","2422","0.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H42 Mg N4 Si2 -","- C16 H42 Mg N4 Si2 -","- C64 H168 Mg4 N16 Si8 -","4","2","","Rees Jr., William S.; Luten, Henry A.; Just, Oliver","Synthesis and structural characterization of a volatile, intramolecularly coordinated monomeric homoleptic magnesium alkylamide","Chemical Communications","2000","","9","735","","10.1039/a909746e","","","0.71073","MoKα","","0.0774","0.0443","","","0.1111","0.1248","","","","","","1.021","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110817","11.2049","0.0016","16.726","0.003","17.152","0.003","64.592","0.003","80.095","0.004","85.225","0.004","2860.1","0.8","160","2","160","2","","","","","","","","4","P -1","-P 1","2","","","","- C59 H81 Li5 N10 -","- C59 H81 Li5 N10 -","- C118 H162 Li10 N20 -","2","1","","Clegg, William; Liddle, Stephen T.; Mulvey, Robert E.; Robertson, Alan","Pentanuclear asymmetrical ladder structure of the 1,4-dimethylpiperazine solvate of lithium anilide and its implication for the unknown structure of amorphous lithium anilide","Chemical Communications","2000","","3","223","","10.1039/a909754f","","","0.71073","MoKα","","0.1501","0.0851","","","0.2192","0.2625","","","","","","1.047","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110818","10.3572","0.0007","20.8156","0.001","17.8865","0.001","90","","93.226","0.005","90","","3850.1","0.4","213","2","213","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C31 H62 Cl2 Hf N2 P2 Si2 -","- C31 H62 Cl2 Hf N2 P2 Si2 -","- C124 H248 Cl8 Hf4 N8 P8 Si8 -","4","1","","Kamalesh Babu, Ruppa P.; Cavell, Ronald G.; McDonald, Robert","The first hafnium methandiide complexes: the assembly of an entire triad of group 4 metal ‘pincer’ bis(phosphinimine) complexes possessing the MC carbene‒ylide structure","Chemical Communications","2000","","6","481","","10.1039/a909771f","","","1.54178","CuKa","","0.0495","0.0432","","0.1148","0.11","","","","1.069","1.095","1.095","","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110819","16.173","0.002","16.512","0.001","18.024","0.002","90","","90","","90","","4813.3","0.9","133.2","","","","","","","","","","","3","P c c n","-P 2ab 2ac","56","","","","- C26 H16 Br4 -","- C26 H16 Br4 -","- C208 H128 Br32 -","8","1","","Tanaka, Koichi; Fujimoto, Daisuke; Oeser, Thomas; Irngartinger, Hermann; Toda, Fumio","Chiral inclusion crystallization of tetra(p-bromophenyl)ethylene by exposure to the vapor of achiral guest molecules: a novel racemic-to-chiral transformation through gas‒solid reaction","Chemical Communications","2000","","5","413","","10.1039/a909782a","","","0.7107","MoK?a","","","0.0328","","","","0.032","","","","","","1.051","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110820","8.762","0.001","14.942","0.002","23.472","0.004","90","","90","","90","","3073","0.8","218","2","218","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","Tetra(p-bromophenyl)ethylene * xylene (3)","","- C34 H26 Br4 -","- C34 H26 Br4 -","- C136 H104 Br16 -","4","1","","Tanaka, Koichi; Fujimoto, Daisuke; Oeser, Thomas; Irngartinger, Hermann; Toda, Fumio","Chiral inclusion crystallization of tetra(p-bromophenyl)ethylene by exposure to the vapor of achiral guest molecules: a novel racemic-to-chiral transformation through gas‒solid reaction","Chemical Communications","2000","","5","413","","10.1039/a909782a","","","0.71073","MoK?a","","0.136","0.047","","","0.096","0.128","","","","","","1.063","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110821","17.283","0.003","11.337","0.002","14.568","0.003","90","","125.16","0.03","90","","2333.6","1.1","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C26 H16 Cr2 N2 O8 -","- C26 H16 Cr2 N2 O8 -","- C104 H64 Cr8 N8 O32 -","4","0.5","","Camiolo, Salvatore; Coles, Simon J.; Gale, Philip A.; Hursthouse, Michael B.; Mayer, Thomas A.; Paver, Michael A.","Hydrogen bonding networks and anion coordination in (η6-arene)Cr(CO)3 complexes: metal carbonyls as hydrogen bond acceptors","Chemical Communications","2000","","4","275","","10.1039/a909861e","","","0.71073","MoKα","","0.0664","0.0418","","","0.11","0.1265","","","","","","0.803","","","","has coordinates","198632","2020-10-21","18:00:00",""
"7110822","7.0198","0.001","7.394","0.0011","9.4002","0.0012","86.089","0.007","86.591","0.008","69.457","0.007","455.49","0.11","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C9 H7 Cr N O3 -","- C9 H7 Cr N O3 -","- C18 H14 Cr2 N2 O6 -","2","1","","Camiolo, Salvatore; Coles, Simon J.; Gale, Philip A.; Hursthouse, Michael B.; Mayer, Thomas A.; Paver, Michael A.","Hydrogen bonding networks and anion coordination in (η6-arene)Cr(CO)3 complexes: metal carbonyls as hydrogen bond acceptors","Chemical Communications","2000","","4","275","","10.1039/a909861e","","","0.71073","MoKα","","0.0934","0.0774","","","0.1996","0.2079","","","","","","1.405","","","","has coordinates","198632","2020-10-21","18:00:00",""
"7110823","11.396","0.007","11.396","0.007","13.913","0.009","90","","90","","90","","1807","2","150","2","150","2","","","","","","","","7","P 43 21 2","P 4nw 2abw","96","{[Ag(2,2'-bpyz)]BF4.2MeNO2}","{Silver(I)(2,2'-bipyrazine)](tetrafluoroborate)}n.MeNO2 solvate","","- C10 H12 Ag B F4 N6 O4 -","- C10 H12 Ag B F4 N6 O4 -","- C40 H48 Ag4 B4 F16 N24 O16 -","4","0.5","","Blake, Alexander J.; Champness, Neil R.; Cooke, Paul A.; Nicolson, James E. B.","Synthesis of a chiral adamantoid network— the role of solvent in the construction of new coordination networks with silver(i)","Chemical Communications","2000","","8","665","","10.1039/a909868b","","","0.71073","MoKα","","0.0684","0.0549","","","0.1262","0.1359","","","","","","1.176","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110824","7.326","0.003","18.423","0.006","10.218","0.004","90","","100.35","0.04","90","","1356.7","0.9","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","AgbpzBF4","[Ag(2,2'-bipyrazine)(acetonitrile)]tetrafluoroborate","","- C10 H9 Ag B F4 N5 -","- C10 H9 Ag B F4 N5 -","- C40 H36 Ag4 B4 F16 N20 -","4","1","","Blake, Alexander J.; Champness, Neil R.; Cooke, Paul A.; Nicolson, James E. B.","Synthesis of a chiral adamantoid network— the role of solvent in the construction of new coordination networks with silver(i)","Chemical Communications","2000","","8","665","","10.1039/a909868b","","","0.71073","MoKα","","0.0829","0.0531","","","0.0913","0.106","","","","","","1.157","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110825","10.799","0.003","15.117","0.001","16.732","0.005","69.56","0.01","76.88","0.01","77.89","0.01","2467.1","1","120","2","120","2","","","","","","","","3","P -1","-P 1","2","","hexakis{[tris(methylthio)tetrathiafulvalenyl]thiomethyl}benzene","","- C66 H66 S48 -","- C66 H64.152 S48 -","- C66 H64.152 S48 -","1","0.5","","Christensen, Christian A.; Bryce, Martin R.; Batsanov, Andrei S.; Becher, Jan","A novel hexakis(tetrathiafulvalene) derivative: synthesis, structure and electrochemical properties","Chemical Communications","2000","","5","331","","10.1039/a909882h","","","0.71073","MoKα","","0.0331","0.0277","","","0.0708","0.0756","","","","","","1.041","","","","has coordinates,has disorder","180222","2020-10-21","18:00:00",""
"7110826","19.6358","0.0007","11.8049","0.0004","21.5544","0.0008","90","","98.26","","90","","4944.5","0.3","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C41 H46 Cl5 Cu Dy N10 O12 -","- C41 H43 Cl5 Cu Dy N10 O12 -","- C164 H172 Cl20 Cu4 Dy4 N40 O48 -","4","1","","Chen, Qiu-Yun; Luo, Qin-Hui; Wang, Zhi-Lin; Chen, Jiu-Tong","Synthesis and crystal structure of the first d‒f heterodinuclear Dy(iii)‒Cu(ii) cryptate","Chemical Communications","2000","","12","1033","","10.1039/a909926n","","","0.71073","MoKα","","","0.0658","","","0.1109","0.145","","","","","","1.04","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110827","6.517","0.0001","11.5188","0.0004","26.6955","0.0008","90","","90","","90","","2003.98","0.1","123","2","123","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C19 H30 O6 Si -","- C19 H30 O6 Si -","- C76 H120 O24 Si4 -","4","1","","Bond, Silas; Perlmutter, Patrick","The vitamin C route to the ciguatoxins: enantioselective synthesis of a ring F building block","Chemical Communications","2000","","7","567","","10.1039/a910163m","","","0.71073","MoKα","","0.134","0.0532","","","0.0793","0.0978","","","","","","1.01","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110828","10.1336","0.0002","9.5207","0.0002","11.1957","0.0002","90","","104.75","0.001","90","","1044.55","0.04","123","2","123","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C23 H26 O7 -","- C23 H26 O7 -","- C46 H52 O14 -","2","1","","Bond, Silas; Perlmutter, Patrick","The vitamin C route to the ciguatoxins: enantioselective synthesis of a ring F building block","Chemical Communications","2000","","7","567","","10.1039/a910163m","","","0.71073","MoKα","","0.0366","0.0336","","","0.0728","0.0741","","","","","","1.051","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110829","9.2972","0.0004","15.7287","0.0007","16.6995","0.0008","73.249","0.001","82.344","0.001","79.303","0.001","2289.49","0.18","203","2","203","2","","","","","","","","4","P -1","-P 1","2","(triphenylphosphine)(sigma-allyl)bis(pi-allyl)iridium","","","- C54 H60 Ir2 P2 -","- C27 H28 Ir P -","- C108 H112 Ir4 P4 -","4","2","","John, Kevin D.; Scott, Brian L.; Baker, R. Thomas; Sattelberger, Alfred P.; Salazar, Kenneth V.","Chemistry of M(allyl)3 (M = Rh, Ir) compounds: structural characterization of tris(allyl)iridium complexes with phosphorus ligands","Chemical Communications","2000","","7","581","","10.1039/a910164k","","","0.71073","MoKα","","0.0319","0.0262","","","0.0645","0.067","","","","","","0.999","","","","has coordinates,has disorder","180222","2020-10-21","18:00:00",""
"7110830","11.2226","0.0005","25.4429","0.0013","16.3141","0.0008","90","","106.45","0.001","90","","4467.6","0.4","203","2","203","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","(bis(2-diphenylphosphinoethyl)phenylphosphine)tris(sigma-allyl)iridium","","","- C50 H56 Ir P3 -","- C43 H45 Ir P3 -","- C172 H180 Ir4 P12 -","4","1","","John, Kevin D.; Scott, Brian L.; Baker, R. Thomas; Sattelberger, Alfred P.; Salazar, Kenneth V.","Chemistry of M(allyl)3 (M = Rh, Ir) compounds: structural characterization of tris(allyl)iridium complexes with phosphorus ligands","Chemical Communications","2000","","7","581","","10.1039/a910164k","","","0.71073","MoKα","","0.0392","0.0292","","","0.0733","0.0761","","","","","","1.023","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110831","10.7816","0.0005","13.5959","0.0006","13.9441","0.0006","86.058","0.001","71.302","0.001","83.341","0.001","1921.98","0.15","203","2","203","2","","","","","","","","4","P -1","-P 1","2","(1,2-bis(diphenylphosphino)benzene)bis(sigma-allyl)(pi-allyl)iridium","","","- C53 H55 Ir P2 -","- C39 H39 Ir P2 -","- C78 H78 Ir2 P4 -","2","1","","John, Kevin D.; Scott, Brian L.; Baker, R. Thomas; Sattelberger, Alfred P.; Salazar, Kenneth V.","Chemistry of M(allyl)3 (M = Rh, Ir) compounds: structural characterization of tris(allyl)iridium complexes with phosphorus ligands","Chemical Communications","2000","","7","581","","10.1039/a910164k","","","0.71073","MoKα","","0.0205","0.0179","","","0.0414","0.0421","","","","","","1.003","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110832","10.336","0.002","17.095","0.006","20.506","0.005","90","","103.99","0.02","90","","3515.8","1.7","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H54 As2 Mn2 N4 -","- C34 H54 As2 Mn2 N4 -","- C136 H216 As8 Mn8 N16 -","4","1","","Bashall, Alan; McPartlin, Mary; Beswick, Michael A.; Kidd, Sara J.; Palmer, Julie S.; Raithby, Paul R.; Rawson, Jeremy M.; Wright, Dominic S.; Ehlenberg, Helmut","The paramagnetic, heterometallic manganese cubanes [{E2(NCy)4}(MnCp)2] (Cy = C6H11, Cp = C5H5, E = As, Sb)","Chemical Communications","2000","","9","749","","10.1039/a910196i","","","0.71073","MoKα","","0.1015","0.0539","","","0.117","0.1559","","","","","","1.029","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110833","11.775","0.002","11.775","0.002","26.095","0.005","90","","90","","90","","3618.1","1.1","180","2","180","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- C34 H54 Mn2 N4 Sb2 -","- C34 H54 Mn2 N4 Sb2 -","- C136 H216 Mn8 N16 Sb8 -","4","0.5","","Bashall, Alan; McPartlin, Mary; Beswick, Michael A.; Kidd, Sara J.; Palmer, Julie S.; Raithby, Paul R.; Rawson, Jeremy M.; Wright, Dominic S.; Ehlenberg, Helmut","The paramagnetic, heterometallic manganese cubanes [{E2(NCy)4}(MnCp)2] (Cy = C6H11, Cp = C5H5, E = As, Sb)","Chemical Communications","2000","","9","749","","10.1039/a910196i","","","0.71073","MoKα","","0.0372","0.0277","","0.1256","0.0786","","","","1.185","0.804","0.804","","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110834","9.7487","0.0006","18.492","0.002","23.164","0.002","90","","101.641","0.003","90","","4090","0.6","173","2","173","2","","","","","","","D. Plaut, Prof. M. Ward","4","P 1 21/n 1","-P 2yn","14","tris-ditertbutylammoniumtrimesate acetone clathrate","","","- C36 H69 N3 O7 -","- C36 H69 N3 O7 -","- C144 H276 N12 O28 -","4","1","","Plaut, David J.; Lund, Kristian M.; Ward, Michael D.","Low-density hydrogen-bonded networks in crystals and at the air/water interface","Chemical Communications","2000","","9","769","","10.1039/a910252n","","","0.71073","MoKα","","0.1422","0.06","","0.1752","0.1478","","","","0.903","1.166","1.166","","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110835","10.5401","0.0006","15.815","0.001","18.711","0.001","107.648","0.001","105.627","0.001","97.211","0.001","2788.4","0.3","173","2","173","2","","","","","","","D. Plaut, Prof. M. Ward","4","P -1","-P 1","2","tris-dicyclohexyammoniumtrimesate isopropanol clathrate","","","- C54 H96 N3 O9 -","- C51 H89 N3 O8 -","- C102 H178 N6 O16 -","2","1","","Plaut, David J.; Lund, Kristian M.; Ward, Michael D.","Low-density hydrogen-bonded networks in crystals and at the air/water interface","Chemical Communications","2000","","9","769","","10.1039/a910252n","","","0.71073","MoKα","","0.098","0.0642","","0.2091","0.1895","","","","0.973","1.157","1.157","","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110836","16.9805","0.0003","19.5242","0.0004","20.0428","0.0004","116.268","0.001","111.491","0.001","95.189","0.001","5284.2","0.2","173","2","173","2","","","","","","","D. Plaut, Prof. M. Ward","4","P -1","-P 1","2","tris-dicyclohexyammoniumtrimesate methanol-acetone clathrate","","","- C45 H75 N3 O6 -","- C45 H75 N3 O6 -","- C180 H300 N12 O24 -","4","2","","Plaut, David J.; Lund, Kristian M.; Ward, Michael D.","Low-density hydrogen-bonded networks in crystals and at the air/water interface","Chemical Communications","2000","","9","769","","10.1039/a910252n","","","0.71073","MoKα","","0.0747","0.0563","","0.1478","0.1379","","","","1.061","1.153","1.153","","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110837","12.0226","0.0002","28.2424","0.0007","15.1695","0.0004","90","","97.512","0.001","90","","5106.6","0.2","123","1","123","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","{(tetra-p-sulfonatocalix[4]arene)(18- crown-6)0.5[yttrium hexahydrate]1.333}tetrahydrate","","","- C34 H58.67 O32.33 S4 Y1.33 -","- C34 H32 O32.3 S4 Y1.33 -","- C136 H128 O129.2 S16 Y5.32 -","4","1","","Hardie, Michaele J.; Raston, Colin L.; Webb, Helen R.; Johnson, Julian A.","Cooperative hydrogen bonding and yttrium(iii) complexation in the assembly of molecular capsules","Chemical Communications","2000","","10","849","","10.1039/a910256f","","","0.71073","MoKα","","0.1547","0.0851","","","0.2139","0.2559","","","","","","1.062","","","","has coordinates,has disorder","180222","2020-10-21","18:00:00",""
"7110838","14.83","0.003","15.354","0.003","15.282","0.003","90","","94.83","0.03","90","","3467.4","1.2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H20 Co0.5 N2 O2 -","- C14 H20 Co0.5 N2 O2 -","- C112 H160 Co4 N16 O16 -","8","1","","Sidorov, Aleksei A.; Ponina, Marina O.; Deomidov, Sergei M.; Novotortsev, Vladimir M.; Nefedov, Sergei E.; Eremenko, Igor L.; Moiseev, Ilya I.; Demonceau, Albert","Oxygen initiated unprecedented condensation of propargylamine into the 1,3-di(propargylimino)propylateanion coordinated to cobalt(iii)","Chemical Communications","2000","","15","1383","","10.1039/b000004n","","","0.71073","MoKα","","0.0678","0.0483","","0.1344","0.1214","","","","1.311","1.351","1.351","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110839","6.528","0.003","10.634","0.004","11.041","0.004","66.36","","79.6","","75.89","","678","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H38 Co N4 O4 -","- C22 H38 Co N4 O4 -","- C22 H38 Co N4 O4 -","1","0.5","","Sidorov, Aleksei A.; Ponina, Marina O.; Deomidov, Sergei M.; Novotortsev, Vladimir M.; Nefedov, Sergei E.; Eremenko, Igor L.; Moiseev, Ilya I.; Demonceau, Albert","Oxygen initiated unprecedented condensation of propargylamine into the 1,3-di(propargylimino)propylateanion coordinated to cobalt(iii)","Chemical Communications","2000","","15","1383","","10.1039/b000004n","","","0.71073","MoKα","","0.0524","0.0463","","0.1326","0.131","","","","1.173","1.229","1.229","","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110840","9.1424","0.0004","11.5049","0.0005","13.446","0.0006","90","","101.281","0.001","90","","1386.96","0.11","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C15 H18 O5 -","- C15 H18 O5 -","- C60 H72 O20 -","4","1","","Tsai, Yow-Fu; Peddinti, Rama Krishna; Liao, Chun-Chen","Intramolecular Diels‒Alder reactions of masked p-benzoquinones: a novel methodology for the synthesis of highly functionalized cis-decalins","Chemical Communications","2000","","6","475","","10.1039/b000248h","","","0.71073","MoKα","","0.0851","0.051","","","0.1249","0.1444","","","","","","1.028","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110841","17.661","0.002","17.661","0.002","20.722","0.004","90","","90","","120","","5597.5","1.4","294","2","294","2","","","","","","","","5","R 3 2 :H","R 3 2""","155","","","","- C48 H54 N12 O12 Zn3 -","- C48 H54 N12 O12 Zn3 -","- C144 H162 N36 O36 Zn9 -","3","0.166667","","Liu, Hong-Ke; Sun, Wei-Yin; Ma, De-Jian; Tang, Wen-Xia; Yu, Kai-Bei","The first X-ray structurally characterized M3L2 cage-like complex with tetrahedral metal centres and its encapsulation of a neutral guest molecule","Chemical Communications","2000","","7","591","","10.1039/b000259n","","","0.71073","MoKα","","0.1476","0.0684","","0.3411","0.1641","","","","0.811","1.083","1.083","","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110842","12.108","0.001","36.869","0.003","14.32","0.001","90","","105.004","0.002","90","","6174.7","0.8","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C52 H92 N4 O Si4 Sn2 -","- C52 H92 N4 O Si4 Sn2 -","- C208 H368 N16 O4 Si16 Sn8 -","4","1","","Leung, Wing-Por; Cheng, Hui; Huang, Rong-Bin; Yang, Qing-Chuan; Mak, Thomas C. W.","Synthesis and structural characterization of a novel asymmetric distannene [{1-[N(But)C(SiMe3)C(H)]-2-[N(But)(SiMe3)CC(H)]C6H4}Sn\ρightarrow Sn{1,2-[N(But)(SiMe3)CC(H)]2C6H4}]","Chemical Communications","2000","","6","451","","10.1039/b000268m","","","0.71073","MoKα","","0.106","0.054","","","0.1269","0.1435","","","","","","0.974","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110843","12.178","0.003","10.329","0.005","39.179","0.01","90","0.03","94.65","0.02","90","0.03","4912","3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C37 H43 Cl3 Fe2 N10 O16 -","- C37 H42 Cl3 Fe2 N10 O16 -","- C148 H168 Cl12 Fe8 N40 O64 -","4","1","","Kryatov, Sergey V.; Rybak-Akimova, Elena V.; Nazarenko, Alexander Y.; Robinson, Paul D.","A dinuclear iron(iii) complex with a bridging urea anion: implications for the urease mechanism","Chemical Communications","2000","","11","921","","10.1039/b000286k","","","0.71069","MoKα","","0.2428","0.0697","","0.2835","0.1901","","","","0.971","1.208","1.208","","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110844","12.161","0.0015","10.4451","0.0017","38.758","0.01","90","","97.137","0.016","90","","4885","1.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C37.75 H42.5 Cl3 Fe2 N11.5 O15 -","- C37.75 H42.5 Cl3 Fe2 N11.5 O15 -","- C151 H170 Cl12 Fe8 N46 O60 -","4","1","","Kryatov, Sergey V.; Rybak-Akimova, Elena V.; Nazarenko, Alexander Y.; Robinson, Paul D.","A dinuclear iron(iii) complex with a bridging urea anion: implications for the urease mechanism","Chemical Communications","2000","","11","921","","10.1039/b000286k","","","0.71069","MoKα","","0.1406","0.0673","","0.2103","0.1733","","","","1.024","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110845","9.8565","0.0005","18.8443","0.0008","17.9089","0.0008","90","","104.652","0.001","90","","3218.2","0.3","203","2","203","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","2B","","","- C32 H40 Mo N4 Si2 -","- C32 H40 Mo N4 Si2 -","- C128 H160 Mo4 N16 Si8 -","4","1","","Cameron, Tom M.; Ortiz, Carlos G.; Abboud, Khalil A.; Boncella, James M.; Baker, R. Tom; Scott, Brian L.","Molybdenum η2-imine complex formation and the reductive coupling of imines","Chemical Communications","2000","","7","573","","10.1039/b000355g","","","0.71073","MoKα","","0.0647","0.0431","","","0.0774","0.0831","","","","","","1.225","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110846","9.96","0.0005","19.0705","0.0009","10.2628","0.0005","90","","97.351","0.001","90","","1933.32","0.16","173","2","173","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C38 H53 Mo N5 O2 Si2 -","- C38 H53 Mo N5 O2 Si2 -","- C76 H106 Mo2 N10 O4 Si4 -","2","1","","Cameron, Tom M.; Ortiz, Carlos G.; Abboud, Khalil A.; Boncella, James M.; Baker, R. Tom; Scott, Brian L.","Molybdenum η2-imine complex formation and the reductive coupling of imines","Chemical Communications","2000","","7","573","","10.1039/b000355g","","","0.71073","MoKα","","0.0608","0.042","","","0.0775","0.0843","","","","","","1.021","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110847","9.464","0.006","9.754","0.004","13.596","0.004","101.94","0.02","102.32","0.04","103.37","0.04","1148.8","1","213","","213","","","","","","","","see paper","5","P -1","-P 1","2","Complex 1","","","- C21 H35 B N4 Ti -","- C21 H35 B N4 Ti -","- C42 H70 B2 N8 Ti2 -","2","1","","Braunschweig, Holger; Koblinski, Carsten von; Englert, Ulli","Synthesis and structure of the first boron-bridged constrained geometry complexes","Chemical Communications","2000","","12","1049","","10.1039/b000380h","","","0.71073","Mo-Kα","","0.0578","0.0444","","","0.1106","0.1162","","","","","","1.064","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110848","30.603","0.002","30.603","0.002","46.202","0.005","90","","90","","120","","37473","5","220","2","220","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C193.5 H240.5 Cl22.5 N30 Ni13 O65 -","- C151 H169.5 Cl22.5 N30 Ni13 O48 -","- C906 H1017 Cl135 N180 Ni78 O288 -","6","0.333333","","Graham, Alasdair; Meier, Stephanie; Parsons, Simon; Winpenny, Richard E. P.","Changing cage structures through inter-ligand repulsions","Chemical Communications","2000","","10","811","","10.1039/b000385i","","","1.54184","CuKα","","0.1569","0.0794","","0.2245","0.1824","","","","0.886","1.161","1.161","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7110849","19.054","0.003","19.054","0.003","81.851","0.016","90","","90","","120","","25735","8","220","2","220","2","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","","","- C178 H164 Co10 N9 O39 -","- C178.02 H160.08 Co10 N9 O39.02 -","- C1068.12 H960.48 Co60 N54 O234.12 -","6","0.166667","","Graham, Alasdair; Meier, Stephanie; Parsons, Simon; Winpenny, Richard E. P.","Changing cage structures through inter-ligand repulsions","Chemical Communications","2000","","10","811","","10.1039/b000385i","","","0.71073","MoKα","","0.1299","0.0715","","","0.179","0.2127","","","","","","1.055","","","","has coordinates,has disorder","180222","2020-10-21","18:00:00",""
"7110850","18.452","0.001","19.131","0.001","28.239","0.001","90","","90","","90","","9968.5","0.8","117","","117","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C53 H80 N2 O2 Zr -","- C48 H60 N2 O2 Zr -","- C384 H480 N16 O16 Zr8 -","8","1","","Tshuva, Edit Y.; Goldberg, Israel; Kol, Moshe; Weitman, Hana; Goldschmidt, Zeev","Novel zirconium complexes of amine bis(phenolate) ligands. Remarkable reactivity in polymerization of hex-1-ene due to an extra donor arm","Chemical Communications","2000","","5","379","","10.1039/b000396o","","","0.7107","MoKα","","0.148","0.1028","","","0.2636","0.2853","","","","","","1.028","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110851","10.484","0.0001","19.297","0.0004","24.594","0.0005","90","","91.048","0.001","90","","4974.77","0.15","116","","116","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C54 H81 N O2 Zr -","- C54 H56 N O2 Zr -","- C216 H224 N4 O8 Zr4 -","4","1","","Tshuva, Edit Y.; Goldberg, Israel; Kol, Moshe; Weitman, Hana; Goldschmidt, Zeev","Novel zirconium complexes of amine bis(phenolate) ligands. Remarkable reactivity in polymerization of hex-1-ene due to an extra donor arm","Chemical Communications","2000","","5","379","","10.1039/b000396o","","","0.7107","MoKα","","0.0624","0.0493","","","0.1295","0.1377","","","","","","1.03","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110852","20.778","0.001","17.918","0.001","21.623","0.001","90","","90","","90","","8050.2","0.7","130","","130","","","","","","","","by syntheses","6","P b c a","-P 2ac 2ab","61","","","","- C33 H51 Cl N5 Si4 V -","- C33 H51 Cl N5 Si4 V -","- C264 H408 Cl8 N40 Si32 V8 -","8","1","","Brussee, Edward A. C.; Meetsma, Auke; Hessen, Bart; Teuben, Jan H.","The N,N′-bis(trimethylsilyl)pentafluorobenzamidinate ligand: enhanced ethene oligomerisation with a neutral V(iii) bis(benzamidinate) alkyl catalyst","Chemical Communications","2000","","6","497","","10.1039/b000397m","","","0.71073","MoKα","","0.1086","0.0514","","","","0.1093","","","","","","1.04","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110853","10.206","0.002","13.176","0.002","17.922","0.003","86.41","0.01","74.73","0.01","67.63","0.01","2148.1","0.7","130","","130","","","","","","","","by syntheses","7","P -1","-P 1","2","","","","- C33 H41 Cl F10 N5 Si4 V -","- C33 H41 Cl F10 N5 Si4 V -","- C66 H82 Cl2 F20 N10 Si8 V2 -","2","1","","Brussee, Edward A. C.; Meetsma, Auke; Hessen, Bart; Teuben, Jan H.","The N,N′-bis(trimethylsilyl)pentafluorobenzamidinate ligand: enhanced ethene oligomerisation with a neutral V(iii) bis(benzamidinate) alkyl catalyst","Chemical Communications","2000","","6","497","","10.1039/b000397m","","","0.71073","MoKα","","0.0412","0.0356","","","0.0933","0.0986","","","","","","1.101","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110854","17.07","0.02","9.82","0.01","11.51","0.01","90","","94.03","0.04","90","","1925","3","298","","298","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C19 H17 Cl N4 O3 V -","- C19 H17 Cl N4 O3 V -","- C76 H68 Cl4 N16 O12 V4 -","4","1","","Tolis, Evangelos J.; Soulti, Kalliopi D.; Kabanos, Themistoklis A.; Raptopoulou, Catherine P.; Terzis, Aris; Deligiannakis, Yiannis","Structural, electron paramagnetic resonance and electron spin echo envelope modulation studies of oxovanadium(iv)‒amidate compounds containing monoanionic axial ligands: effect on the 51V-hyperfine coupling constants","Chemical Communications","2000","","7","601","","10.1039/b000399i","","","0.71073","MoKα","","0.1213","0.0663","","0.1923","0.1453","","","","1.063","1.126","1.126","","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110855","12.395","0.001","9.226","0.001","13.343","0.001","90","0.001","109.082","0.001","90","0.001","1442","0.2","298","","","","","","","","","","Local laboratory","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H18 Fe N3 O6 -","- C9 H18 Fe N3 O6 -","- C36 H72 Fe4 N12 O24 -","4","1","","Kovács, Tibor; Speier, Gábor; Réglier, Marius; Giorgi, Michel; Vértes, Attila; Vankó, György","Preparation and characterization of homoleptic and ethoxy-bridged nitronato iron(iii) complexes","Chemical Communications","2000","","6","469","","10.1039/b000408l","","","0.71073","xray","","","0.032","","","0.033","","","","","0.85","0.85","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110856","10.1033","0.0004","10.3819","0.0004","13.8442","0.0004","111.605","0.002","95.663","0.002","99.772","0.001","1309.78","0.08","197","2","197","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H34 Fe2 N4 O10 -","- C16 H34 Fe2 N4 O10 -","- C32 H68 Fe4 N8 O20 -","2","1","","Kovács, Tibor; Speier, Gábor; Réglier, Marius; Giorgi, Michel; Vértes, Attila; Vankó, György","Preparation and characterization of homoleptic and ethoxy-bridged nitronato iron(iii) complexes","Chemical Communications","2000","","6","469","","10.1039/b000408l","","","0.7107","MoKα","","0.0493","0.0425","","","0.0984","0.1038","","","","","","1.027","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110857","37.653","0.042","37.653","0.042","55.359","0.063","90","","90","","120","","67970","13","293","2","293","2","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","","","- C288 H450 Cd6 N18 O48 S24 -","- C288 H432 Cd6 N18 O48 S24 -","- C1728 H2592 Cd36 N108 O288 S144 -","6","0.166667","","Fox, O. Danny; Wilkinson, Emma J. S.; Beer, Paul D.; Drew, Michael G. B.","Cadmium- and zinc-directed assembly of nano-sized, resorcarene-based host architectures which strongly bind C60","Chemical Communications","2000","","5","391","","10.1039/b000481m","","","0.71073","MoKα","","0.2044","0.1406","","0.4427","0.3873","","","","1.103","1.269","1.269","","","","","has coordinates,has disorder","180222","2020-10-21","18:00:00",""
"7110858","37.517","0.044","37.517","0.044","56.042","0.065","90","","90","","120","","68313","14","293","2","293","2","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","","","- C258 H408 Cd6 N18 O57 S24 -","- C258 H354 Cd6 N18 O57 S24 -","- C1548 H2124 Cd36 N108 O342 S144 -","6","0.166667","","Fox, O. Danny; Wilkinson, Emma J. S.; Beer, Paul D.; Drew, Michael G. B.","Cadmium- and zinc-directed assembly of nano-sized, resorcarene-based host architectures which strongly bind C60","Chemical Communications","2000","","5","391","","10.1039/b000481m","","","0.71073","MoKα","","0.2427","0.112","","0.3646","0.2956","","","","1.001","1.282","1.282","","","","","has coordinates,has disorder","180222","2020-10-21","18:00:00",""
"7110859","37.228","0.039","37.228","0.039","55.63","0.072","90","","90","","120","","66770","13","293","2","293","2","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","","","- C276 H417 N18 O43.5 S24 Zn6 -","- C276 H396 N18 O43.5 S24 Zn6 -","- C1656 H2376 N108 O261 S144 Zn36 -","6","0.166667","","Fox, O. Danny; Wilkinson, Emma J. S.; Beer, Paul D.; Drew, Michael G. B.","Cadmium- and zinc-directed assembly of nano-sized, resorcarene-based host architectures which strongly bind C60","Chemical Communications","2000","","5","391","","10.1039/b000481m","","","0.71073","MoKα","","0.212","0.1413","","0.4644","0.3982","","","","0.877","1.004","1.004","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7110860","12.053","0.003","13.678","0.003","18.81","0.004","89.84","0.02","81.13","0.02","68.37","0.02","2843.3","1.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C29 H37 Mg N S Si -","- C29 H37 Mg N S Si -","- C116 H148 Mg4 N4 S4 Si4 -","4","2","","Strohmann, Carsten; Abele, Bors C.; Schildbach, Daniel; Strohfeldt, Katja","Synthesis and molecular structure of the unsymmetrically substituted magnesium alkyl Mg(Bun){CH[SPh][SiPh2(CH2NC5H10)]}","Chemical Communications","2000","","10","865","","10.1039/b000494o","","","0.71073","MoKα","","0.0723","0.0493","","0.1519","0.1357","","","","1.004","1.084","1.084","","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110861","11.592","0.004","12.132","0.003","11.024","0.003","114.66","0.02","101.92","0.03","85.74","0.02","1378.5","0.7","293.2","","293.2","","","","","","","","","8","P -1","-P 1","2","","","","- C22 H25 Br2 Cl2 Cu N4 Ni O2.5 -","- C22 H24 Br2 Cl2 Cu N4 Ni O2.5 -","- C44 H48 Br4 Cl4 Cu2 N8 Ni2 O5 -","2","1","","Yonemura, Masami; Ōkawa, Hisashi; Ohba, Masaaki; Fenton, David E.; Thompson, Laurence K.","A mixed-metal CuII2NiII2 complex derived from a phenol-based heterotetranucleating macrocyclic ligand","Chemical Communications","2000","","10","817","","10.1039/b000516i","","","0.7107","MoKα","","0.0484","0.0484","","","0.0615","0.0615","","","","","","2.538","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110862","6.269","0.002","8.6418","0.0012","12.173","0.002","90","","104.16","0.02","90","","639.4","0.3","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C14 H17 N O3 -","- C14 H17 N O3 -","- C28 H34 N2 O6 -","2","1","","Meth-Cohn, Otto; Chen, Yi; Williams, David J.","Enantiopure epoxidation of electrophilic alkenes","Chemical Communications","2000","","6","495","","10.1039/b000520g","","","0.71073","MoKα","","0.0556","0.046","","0.1256","0.1166","","","","1.053","1.076","1.076","","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110863","6.271","0.001","10.9937","0.0011","24.771","0.005","90","","90","","90","","1707.7","0.5","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H20 N2 O3 -","- C20 H20 N2 O3 -","- C80 H80 N8 O12 -","4","1","","Meth-Cohn, Otto; Chen, Yi; Williams, David J.","Enantiopure epoxidation of electrophilic alkenes","Chemical Communications","2000","","6","495","","10.1039/b000520g","","","1.54178","CuKα","","0.1245","0.0657","","0.2087","0.1511","","","","1.049","1.11","1.11","","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110864","11.3054","0.0004","11.5193","0.0004","17.8036","0.0007","101.135","0.002","92.151","0.002","113.594","0.002","2067.68","0.14","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H62.5 Cl4 N2 O10.25 P4 -","- C28 H62 Cl4 N2 O10.25 P4 -","- C56 H124 Cl8 N4 O20.5 P8 -","2","1","","Ahlmark, Marko J.; Vepsäläinen, Jouko J.; Ahlgrén, Markku; Niemi, Riku; Taipale, Hannu; Järvinen, Tomi","Bisphosphonate prodrugs: unusual dimerisation of clodronic acid trimethyl ester to a cyclic bis(bisphosphonate)","Chemical Communications","2000","","8","711","","10.1039/b000558o","","","0.71073","MoKα","","0.0538","0.0371","","","0.0828","0.0898","","","","","","1.049","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110865","8.4556","0.0002","11.4227","0.0002","11.4637","0.0002","90","","90","","90","","1107.23","0.04","123","1","123","1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","(-)-Nemorensic Acid","","","- C10 H16 O5 -","- C10 H16 O5 -","- C40 H64 O20 -","4","1","","Donohoe, Timothy J.; Guillermin, Jean-Baptiste; Frampton, Christopher; Walter, Daryl S.","The synthesis of (+)-nemorensic acid","Chemical Communications","2000","","6","465","","10.1039/b000565g","","","0.71073","MoKα","","0.0274","0.0264","","","0.0768","0.0773","","","","","","1.001","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110866","15.632","0.001","9.417","0.001","9.668","0.001","90","","111.1","0.01","90","","1327.8","0.2","293","2","293","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C13 H17 N O3 -","- C13 H17 N O3 -","- C52 H68 N4 O12 -","4","1","","Griesbeck, Axel G.; Fiege, Maren; Lex, Johann","Oxazole‒Carbonyl photocycloadditions: selectivity pattern and synthetic route to erythro α-amino, β-hydroxy ketones","Chemical Communications","2000","","7","589","","10.1039/b000578i","","","0.71073","MoKα","","0.1224","0.0505","","","0.0757","0.0961","","","","","","1.108","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110867","6.8402","0.0003","20.6247","0.0009","21.2353","0.001","90","","92.484","0.002","90","","2993","0.2","133","2","133","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C32 H26 Cl4 Si2 -","- C32 H26 Cl4 Si2 -","- C128 H104 Cl16 Si8 -","4","1","","Sohn, Honglae; Woo, Hee-Gweon; Powell, Douglas R.","Synthesis and structural characterization of a silacycloheptadiene","Chemical Communications","2000","","8","697","","10.1039/b000585l","","","0.71073","MoKα","","0.0735","0.0516","","0.1215","0.1031","","","","1.204","1.166","1.166","","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110868","9.1677","0.0003","16.5631","0.0004","18.6634","0.0006","90","","101.333","0.002","90","","2778.7","0.15","133","2","133","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C36 H25 Cl Si -","- C36 H25 Cl Si -","- C144 H100 Cl4 Si4 -","4","1","","Sohn, Honglae; Woo, Hee-Gweon; Powell, Douglas R.","Synthesis and structural characterization of a silacycloheptadiene","Chemical Communications","2000","","8","697","","10.1039/b000585l","","","0.71073","MoKα","","0.0563","0.0394","","0.1059","0.097","","","","1.022","1.059","1.059","","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110869","9.3366","0.0015","9.5519","0.0015","22.527","0.004","96.259","0.003","95.649","0.003","95.673","0.003","1975.1","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C35 H28 Cr2 N8 Na2 O18 -","- C35 H24 Cr2 N8 Na2 O18 -","- C70 H48 Cr4 N16 Na4 O36 -","2","1","","Zhang, Lei; Cheng, Peng; Tang, Liang-Fu; Jiang, Zong-Hui; Liao, Dai-Zheng; Yan, Shi-Ping; Wang, Geng-Lin; Weng, Lin-Hong","Two dimensional stair-shaped coordination polymer exhibiting three-dimensional structure with cavities","Chemical Communications","2000","","8","717","","10.1039/b000588f","","","0.71073","MoKα","","0.0783","0.0442","","","0.095","0.1066","","","","","","0.973","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110870","13.857","0.007","13.898","0.008","14.232","0.006","114.01","0.04","91.01","0.04","112.79","0.04","2258","2","295","","295","","","","","","","","?","5","P -1","-P 1","2","","","","- C40 H62 O13 Ru4 W2 -","- C40 H56 O13 Ru4 W2 -","- C80 H112 O26 Ru8 W4 -","2","1","","Artero, Vincent; Proust, Anna; Herson, Patrick; Thouvenot, René; Gouzerh, Pierre","(η6-Arene)ruthenium oxomolybdenum and oxotungsten clusters. Stereochemical non-rigidity of [{Ru(η6-p-MeC6H4Pri)}4Mo4O16] and crystal structure of [{Ru(η6-p-MeC6H4Pri)}4W2O10]","Chemical Communications","2000","","10","883","","10.1039/b000782j","","","0.71069","MoKα","","","0.0562","","","0.0654","","","","","1.1315","1.1315","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7110871","20.9876","0.0006","14.6084","0.0004","44.1418","0.0011","90","","93.707","0.001","90","","13505.4","0.6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C94 H132 N6 Ni31 O42 Sb4 -","- C94 H112 N6 Ni31 O42 Sb4 -","- C376 H448 N24 Ni124 O168 Sb16 -","4","1","","Femoni, Cristina; Iapalucci, M. Carmela; Longoni, Giuliano; Svensson, Per H.","A high-nuclearity Ni‒Sb carbonyl cluster displaying unprecedented metal stereochemistries: synthesis and X-ray structure of [NEt4]6[Ni31Sb4(CO)40]·2 Me2CO","Chemical Communications","2000","","8","655","","10.1039/b000783h","","","0.71073","MoKα","","0.1012","0.0492","","","0.1166","0.1274","","","","","","0.885","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110872","12.696","0.002","8.873","0.001","36.989","0.004","90","","98.278","0.006","90","","4123.5","0.9","183","2","183","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C44 H50 N4 Ni2 O4 -","- C44 H50 N4 Ni2 O4 -","- C176 H200 N16 Ni8 O16 -","4","1","","Döhler, Thomas; Görls, Helmar; Walther, Dirk","Di- and oligo-nuclear nickel complexes with oxalic amidinato bridging ligands: syntheses, structures and catalytic reactions","Chemical Communications","2000","","11","945","","10.1039/b000791i","","","0.71073","MoKα","","0.108","0.0805","","0.2709","0.2307","","","","1.074","1.149","1.149","","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110873","22.2023","0.0008","21.6541","0.0006","25.343","0.001","90","","105.96","0.002","90","","11714.5","0.7","183","2","183","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C112 H122 N12 Ni2 O4 Zn2 -","- C112 H122 N12 Ni2 O4 Zn2 -","- C448 H488 N48 Ni8 O16 Zn8 -","4","0.5","","Döhler, Thomas; Görls, Helmar; Walther, Dirk","Di- and oligo-nuclear nickel complexes with oxalic amidinato bridging ligands: syntheses, structures and catalytic reactions","Chemical Communications","2000","","11","945","","10.1039/b000791i","","","0.71073","MoKα","","0.1752","0.0862","","","0.2171","0.261","","","","","","1.01","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110874","12.232","0.002","16.072","0.003","20.841","0.004","98.25","0.03","103.53","0.03","91.77","0.03","3933.4","1.4","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C182 H218 N10 O12 -","- C182 H218 N10 O12 -","- C182 H218 N10 O12 -","1","0.5","","Leverd, Pascal C.; Nierlich, Martine; Dumazet-Bonnamour, Isabelle; Lamartine, Roger","Using a large calixarene as a polyalkoxide ligand: tert-butylcalix[12]arene and its complex with the uranyl cation","Chemical Communications","2000","","6","493","","10.1039/b000909l","","","0.71073","MoKα","","0.3481","0.1212","","0.3373","0.2145","","","","0.989","1.194","1.194","","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110875","10.099","0.002","22.133","0.004","25.109","0.005","114.39","0.03","94.07","0.03","97.5","0.03","5019","2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C199 H247 N15 O26 U4 -","- C199 H206 N15 O26 U4 -","- C199 H206 N15 O26 U4 -","1","0.5","","Leverd, Pascal C.; Nierlich, Martine; Dumazet-Bonnamour, Isabelle; Lamartine, Roger","Using a large calixarene as a polyalkoxide ligand: tert-butylcalix[12]arene and its complex with the uranyl cation","Chemical Communications","2000","","6","493","","10.1039/b000909l","","","0.71073","MoKα","","0.3007","0.1397","","0.3604","0.2578","","","","1.036","1.228","1.228","","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110876","11.0148","0.0007","19.6065","0.0013","13.6281","0.0009","90","","98.891","0.001","90","","2907.8","0.3","193","2","193","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H23 N P Re S7 -","- C26 H23 N P Re S7 -","- C104 H92 N4 P4 Re4 S28 -","4","1","","Schwarz, Daniel E.; Rauchfuss, Thomas B.","The addition of isocyanides to ReS4−: [3 + 1] cycloaddition to SMS","Chemical Communications","2000","","13","1123","","10.1039/b000932f","","","0.71073","MoKα","","0.0947","0.0427","","","0.0898","0.1043","","","","","","0.783","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110877","7.68","0.002","7.68","0.002","6.49","0.002","90","","90","","90","","382.8","0.18","130","","130","","","","","","","","","3","I 4","I 4","79","Pentamethylmolybdenum(V)","Pentamethylmolybdenum(V)","","- C5 H15 Mo -","- C5 H15 Mo -","- C10 H30 Mo2 -","2","0.25","","Roessler, Beatrice; Kleinhenz, Sven; Seppelt, Konrad","Pentamethylmolybdenum","Chemical Communications","2000","","12","1039","","10.1039/b000987n","","","0.71069","MoKα","","0.0253","0.0253","","","0.0446","0.0446","","","","","","1.111","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110878","7.85","0.001","7.85","0.001","6.42","0.001","90","","90","","90","","395.62","0.09","120","","120","","","","","","","","","3","I 4","I 4","79","Pentamethyltantal","Pentamethyltantal","","- C5 H15 Ta -","- C5 H15 Ta -","- C10 H30 Ta2 -","2","0.25","","Roessler, Beatrice; Kleinhenz, Sven; Seppelt, Konrad","Pentamethylmolybdenum","Chemical Communications","2000","","12","1039","","10.1039/b000987n","","","0.71069","MoKα","","0.0229","0.0229","","","0.0564","0.0564","","","","","","1.058","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110879","11.09","0.0004","11.705","0.0004","23.335","0.0009","75.901","0.0019","80.661","0.0019","83.003","0.002","2888.16","0.18","230","2","230","2","","","","","","","","5","P -1","-P 1","2","","","","- C46 H84 O12 Pt Si8 -","- C45.95 H83.91 O12 Pt Si8 -","- C91.9 H167.82 O24 Pt2 Si16 -","2","1","","Quadrelli, Elsje Alessandra; Davies, John E.; Johnson, Brian F. G.; Feeder, Neil","Molecular insight into the non-innocence of a silica-support: the structure of a platinum‒silsesquioxane derivative","Chemical Communications","2000","","12","1031","","10.1039/b000992j","","","0.7107","MoKα","","0.0768","0.053","","","0.1228","0.1355","","","","","","1.01","","","","has coordinates,has disorder","180222","2020-10-21","18:00:00",""
"7110880","14.613","0.002","19.703","0.002","20.723","0.002","98.04","0.04","101.92","0.04","92.99","0.03","5760.3","1.6","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","","","- C84 H156 O24 Pt Si16 Tl2 -","- C84 H156 O24 Pt Si16 Tl2 -","- C168 H312 O48 Pt2 Si32 Tl4 -","2","1","","Quadrelli, Elsje Alessandra; Davies, John E.; Johnson, Brian F. G.; Feeder, Neil","Molecular insight into the non-innocence of a silica-support: the structure of a platinum‒silsesquioxane derivative","Chemical Communications","2000","","12","1031","","10.1039/b000992j","","","0.71069","MoKα","","0.1248","0.0817","","0.2465","0.2119","","","","1.338","1.465","1.465","","","","","has coordinates,has disorder","180222","2020-10-21","18:00:00",""
"7110881","13.5444","0.0013","4.1098","0.0004","15.094","0.0014","90","","105.583","0.002","90","","809.32","0.13","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C6 H6 Cu I N2 O -","- C6 H6 Cu I N2 O -","- C24 H24 Cu4 I4 N8 O4 -","4","1","","Aakeröy, Christer B.; Beatty, Alicia M.; Leinen, Destin S.; Lorimer, Keith R.","Deliberate combination of coordination polymers and hydrogen bonds in a supramolecular design strategy for inorganic/organic hybrid networks","Chemical Communications","2000","","11","935","","10.1039/b001001o","","","0.71073","MoKα","","0.0268","0.0253","","","0.0665","0.0678","","","","","","1.067","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110882","13.495","0.003","4.1059","0.0009","16.727","0.004","90","","109.626","0.004","90","","873","0.3","173","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C6 H6 Cu I N2 O -","- C6 H6 Cu I N2 O -","- C24 H24 Cu4 I4 N8 O4 -","4","1","","Aakeröy, Christer B.; Beatty, Alicia M.; Leinen, Destin S.; Lorimer, Keith R.","Deliberate combination of coordination polymers and hydrogen bonds in a supramolecular design strategy for inorganic/organic hybrid networks","Chemical Communications","2000","","11","935","","10.1039/b001001o","","","0.71073","MoKα","","0.0687","0.0514","","","0.1334","0.1441","","","","","","1.109","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7110883","7.263","0.001","10.282","0.001","12.312","0.001","90","","92.06","0.01","90","","918.84","0.17","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C4 H9 Cl2 N Se2 -","- C4 H9 Cl2 N Se2 -","- C16 H36 Cl8 N4 Se8 -","4","1","","Maaninen, Tiina; Chivers, Tristram; Laitinen, Risto; Wegelius, Elina","Acyclic imidoselenium(ii) dihalides: synthesis and X-ray structures of ClSe[N(But)Se]nCl (n = 1, 2)","Chemical Communications","2000","","9","759","","10.1039/b001002m","","","0.71073","MoKα","","0.083","0.0753","","","0.1947","0.2004","","","","","","1.198","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110884","9.989","0.002","9.643","0.002","16.124","0.003","90","","101.81","0.03","90","","1520.2","0.5","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 H18 Cl2 N2 Se3 -","- C8 H18 Cl2 N2 Se3 -","- C32 H72 Cl8 N8 Se12 -","4","1","","Maaninen, Tiina; Chivers, Tristram; Laitinen, Risto; Wegelius, Elina","Acyclic imidoselenium(ii) dihalides: synthesis and X-ray structures of ClSe[N(But)Se]nCl (n = 1, 2)","Chemical Communications","2000","","9","759","","10.1039/b001002m","","","0.71073","MoKα","","0.0371","0.0262","","","0.0792","0.091","","","","","","0.692","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110885","25.836","0.005","15.369","0.003","19.478","0.004","90","","105.15","0.03","90","","7465","3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C40 H98 Cr2 N30 Ni3 O12 -","- C40 H82 Cr2 N30 Ni3 O12 -","- C160 H328 Cr8 N120 Ni12 O48 -","4","0.5","","Kou, Hui-Zhong; Gao, Song; Ma, Bao-Qing; Liao, Dai-Zheng","Crystal structure and magnetic properties of a new two-dimensional cyano-bridged bimetallic assembly [NiL′]3[Cr(CN)5(NO)]2·10H2O (L′ = 3,10-dimethyl-1,3,5,8,10,12-hexaazacyclotetradecane)","Chemical Communications","2000","","8","713","","10.1039/b001005g","","","0.71073","MoKα","","0.0945","0.0605","","","0.166","0.1907","","","","","","1.058","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110886","6.8583","0.0005","19.607","0.002","8.0977","0.0006","90","0.002","95.323","0.002","90","0.001","1084.21","0.16","173","2","173","2","","","","","","","Bing Luo","4","C 1 c 1","C -2yc","9","99255/BL045","","","- C4 H18 Ga2 N4 -","- C4 H18 Ga2 N4 -","- C16 H72 Ga8 N16 -","4","1","","Luo, Bing; Gladfelter, Wayne L.","1,1-Dimethylhydrazidogallane and a gallium hydrazide with two Ga2N2 rings bridged by two NNMe2 ligands","Chemical Communications","2000","","10","825","","10.1039/b001010n","","","0.71073","MoKα","","0.0364","0.0294","","","0.0612","0.0635","","","","","","1.035","","","","has coordinates","198632","2020-10-21","18:00:00",""
"7110887","9.8972","0.0007","22.489","0.002","10.023","0.0007","90","0.001","112.824","0.001","90","0.001","2056.2","0.3","173","2","173","2","","","","","","","Bing Luo","4","P 1 21/c 1","-P 2ybc","14","99343/BL046","","","- C20 H68 Ga4 N20 -","- C20 H68 Ga4 N20 -","- C40 H136 Ga8 N40 -","2","0.5","","Luo, Bing; Gladfelter, Wayne L.","1,1-Dimethylhydrazidogallane and a gallium hydrazide with two Ga2N2 rings bridged by two NNMe2 ligands","Chemical Communications","2000","","10","825","","10.1039/b001010n","","","0.71073","MoKα","","0.0647","0.0384","","0.0957","0.0887","","","","0.975","1.089","1.089","","","","","has coordinates","198632","2020-10-21","18:00:00",""
"7110888","16.892","0.004","14.926","0.007","25.494","0.013","90","","107.94","0.02","90","","6115","5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C110 H126 F18 N6 O34 S6 -","- C110 H108 F18 N6 O36 S6 -","- C220 H216 F36 N12 O72 S12 -","2","0.5","","Loeb, Stephen J.; Wisner, James A.","[3]Rotaxanes employing multiple 1,2-bis(pyridinium) ethane binding sites and dibenzo-24-crown-8 ethers","Chemical Communications","2000","","10","845","","10.1039/b001018i","","","0.71073","MoKα","","0.2204","0.1368","","","0.3516","0.3959","","","","","","1.212","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110889","11.732","0.002","11.9065","0.0015","26.506","0.003","78.765","0.009","83.179","0.009","65.113","0.011","3291.5","0.8","163","2","163","2","","","","","","","","6","P -1","-P 1","2","","","","- C68 H28 F30 N6 O2 Pt3 -","- C68 H12 F30 N6 O2 Pt3 -","- C136 H24 F60 N12 O4 Pt6 -","2","1","","Espinet, Pablo; Soulantica, Katerina; Charmant, Jonathan P. H.; Orpen, A. Guy","1,2-Phenylene diisocyanide for metallotriangles","Chemical Communications","2000","","11","915","","10.1039/b001027h","","","0.71073","MoKα","","0.1051","0.0531","","","0.0972","0.1108","","","","","","0.957","","","","has coordinates,has disorder","180222","2020-10-21","18:00:00",""
"7110890","15.2218","0.0014","10.6024","0.0008","16.8946","0.0017","90","","99.728","0.011","90","","2687.4","0.4","200","3","200","3","","","","","","","provided by W. Fraenk","4","C 1 2/c 1","-C 2yc","15","","Bis(pentafluorophenyl)boron azide","","- C12 B F10 N3 -","- C12 B F10 N3 -","- C96 B8 F80 N24 -","8","1","","Fraenk, Wolfgang; Klapötke, Thomas M.; Krumm, Burkhard; Mayer, Peter","Bis(pentafluorophenyl)boron azide: synthesis and structural characterization of the first dimeric boron azide","Chemical Communications","2000","","8","667","","10.1039/b001103g","","","0.71073","MoKα","","0.0665","0.0553","","","0.1354","0.1434","","","","","","1.016","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110891","9.276","0.005","11.668","0.006","6.849","0.004","104.61","0.03","105.06","0.03","99.87","0.03","670","0.7","30","1","30","1","","","","","","","","5","P -1","-P 1","2","","2-methylpyridine pentachlorophenol","","- C12 H8 Cl5 N O -","- C12 H8 Cl5 N O -","- C24 H16 Cl10 N2 O2 -","2","1","","Steiner, Thomas; Wilson, Chick C.; Majerz, Irena","Neutron diffraction study of a very short O‒H‥N hydrogen bond: crystalline adduct of 2-methylpyridine and pentachlorophenol","Chemical Communications","2000","","14","1231","","10.1039/b001179g","","neutron","","neutron","","0.0735","0.0735","","","0.183","0.183","","","","","","1.023","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110892","9.854","0.0003","32.338","0.0006","11.358","0.0015","90","0.0018","110.521","0.003","90","0.002","3389.7","0.5","110","","110","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C82 H65 N4 Na O16 -","- C82 H65 N4 Na O16 -","- C164 H130 N8 Na2 O32 -","2","1","","Diskin-Posner, Yael; Dahal, Sanjay; Goldberg, Israel","New effective synthons for supramolecular self-assembly of meso-carboxyphenylporphyrins","Chemical Communications","2000","","7","585","","10.1039/b001189o","","","0.7107","MoKα","","0.0949","0.0653","","","0.1545","0.1778","","","","","","1.021","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110893","27.694","0.0008","19.51","0.0009","32.598","0.0013","90","","92.724","0.003","90","","17593.1","1.2","115","","115","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C74 H104 N4 O34 Zn2 -","- C50 H32 N4 O10 Zn2 -","- C400 H256 N32 O80 Zn16 -","8","1","","Diskin-Posner, Yael; Dahal, Sanjay; Goldberg, Israel","New effective synthons for supramolecular self-assembly of meso-carboxyphenylporphyrins","Chemical Communications","2000","","7","585","","10.1039/b001189o","","","0.7107","MoKα","","0.1497","0.0758","","","0.1435","0.1652","","","","","","0.91","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110894","15.792","0.003","12.679","0.003","21.434","0.004","90","","91.52","0.03","90","","4290.2","1.5","293","2","293","2","","","","","","","synthesis as described","5","C 1 2/c 1","-C 2yc","15","","","","- C42 H22 B F24 Ni -","- C42 H22 B F24 Ni -","- C168 H88 B4 F96 Ni4 -","4","0.5","","Priego, José L.; Doerrer, Linda H.; Rees, Leigh H.; Green, Malcolm. L. H.","Weakly-coordinating anions stabilise the unprecedented monovalent and divalent η-benzene nickel cations [(η-C5H5)Ni(η-C6H6)Ni(η-C5H5)]2+ and [Ni(η-C6H6)2]2+","Chemical Communications","2000","","9","779","","10.1039/b001190h","","","0.71073","MoKα","","0.0948","0.0921","","0.1973","0.1857","","","","1.451","1.457","1.457","","","","","has coordinates,has disorder","180222","2020-10-21","18:00:00",""
"7110895","11.873","0.007","13.526","0.008","16.304","0.008","73.658","0.006","75.969","0.006","71.607","0.006","2350","2","150","","150","","","","","","","","?","7","P -1","-P 1","2","","","","- C47 H18 B3 Cl2 F25 Ni2 O3 -","- C47 H18 B3 Cl2 F25 Ni2 O3 -","- C94 H36 B6 Cl4 F50 Ni4 O6 -","2","1","","Priego, José L.; Doerrer, Linda H.; Rees, Leigh H.; Green, Malcolm. L. H.","Weakly-coordinating anions stabilise the unprecedented monovalent and divalent η-benzene nickel cations [(η-C5H5)Ni(η-C6H6)Ni(η-C5H5)]2+ and [Ni(η-C6H6)2]2+","Chemical Communications","2000","","9","779","","10.1039/b001190h","","","0.71073","MoKα","","","0.0462","","","","0.0572","","","","","","1.0715","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110896","12.889","0.005","13.191","0.006","14.42","0.004","86.902","0.006","90.131","0.006","61.171","0.006","2143.6","1.4","150","2","150","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C43 H23 B F24 Ni -","- C43 H23 B F24 Ni -","- C86 H46 B2 F48 Ni2 -","2","1","","Priego, José L.; Doerrer, Linda H.; Rees, Leigh H.; Green, Malcolm. L. H.","Weakly-coordinating anions stabilise the unprecedented monovalent and divalent η-benzene nickel cations [(η-C5H5)Ni(η-C6H6)Ni(η-C5H5)]2+ and [Ni(η-C6H6)2]2+","Chemical Communications","2000","","9","779","","10.1039/b001190h","","","0.71073","MoKα","","0.0797","0.063","","0.2037","0.1873","","","","1.018","1.069","1.069","","","","","has coordinates,has disorder","180222","2020-10-21","18:00:00",""
"7110897","28.092","0.004","13.6821","0.0016","24.311","0.002","90","","98.078","0.005","90","","9251.4","1.9","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C59 H47 P2 -","- C59 H47 P2 -","- C472 H376 P16 -","8","1","","Vohs, Jason K.; Wei, Pingrong; Su, Jianrui; Beck, Brent C.; Goodwin, Sonya D.; Robinson, Gregory H.","Formation of a diphosphine: synthesis and molecular structure of bis(tetraphenylbutadienyl)diphosphine, (Ph4C4)P‒P(C4Ph4)","Chemical Communications","2000","","12","1037","","10.1039/b001257m","","","0.71073","MoKα","","0.1026","0.0569","","","0.1165","0.1321","","","","","","1.003","","","","has coordinates","180222","2020-10-21","18:00:00",""
"7110898","11.655","0.002","30.385","0.005","24.34","0.004","90","","103.745","0.003","90","","8373","2","193","2","193","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C166.5 H169 F12 N12 O17.5 P2 Ru2 -","- C166.5 H169 F12 N12 O17.5 P2 Ru2 -","- C333 H338 F24 N24 O35 P4 Ru4 -","2","0.5","","Chichak, Kelly; Walsh, M. Catherine; Branda, Neil R.","Axially coordinated porphyrins as new rotaxane stoppers","Chemical Communications","2000","","10","847","","10.1039/b001259i","","","0.71073","MoKα","","0.2872","0.0877","","","0.2014","0.2673","","","","","","0.864","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110899","17.133","0.003","13.611","0.003","20.493","0.004","90","","90.3","0.03","90","","4778.8","1.6","153","2","153","2","","","","","","","selfmade","5","P 1 21/n 1","-P 2yn","14","decamethylborocenium tetrachloroaluminate","","","- C20 H30 Al B Cl4 -","- C20 H30 Al B Cl4 -","- C160 H240 Al8 B8 Cl32 -","8","2","","Voigt, Andreas; Filipponi, Silvia; Macdonald, Charles L. B.; Gorden, John D.; Cowley, Alan H.","The structure of the decamethylborocenium cation: the most tightly-squeezed metallocene?","Chemical Communications","2000","","11","911","","10.1039/b001271h","","","0.71073","MoKα","","0.1131","0.0713","","0.2235","0.2069","","","","1.529","1.764","1.764","","","","","has coordinates","182221","2020-10-21","18:00:00",""
"7110900","19.8406","0.0012","39.31","0.002","13.309","0.0008","90","","108.107","0.001","90","","9866.1","1","173","2","293","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C51 H77 N3.5 O4 -","- C51 H77 N3.5 O4 -","- C408 H616 N28 O32 -","8","2","","Brouwer, Eric B.; Udachin, Kostantin A.; Enright, Gary D.; Ripmeester, John A.","Amine guest size and hydrogen-bonding influence the structures of p-tert-butylcalix[4]arene inclusions","Chemical Communications","2000","","19","1905","","10.1039/b001274m","","","0.7107","MoKα","","0.2057","0.0755","","","0.1573","0.172","","","","","","1.202","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7110901","10.5667","0.0003","10.9262","0.0003","13.89","0.0004","90.436","0.002","96.562","0.002","114.401","0.002","1448.18","0.07","173","2","173","2","","","","","","","synthesis as described","6","P -1","-P 1","2","[Mo(CO)3{P3C2tBu2C(tBu)(C3N2Me4)}]","","","- C25 H39 Mo N2 O3 P3 -","- C25 H39 Mo N2 O3 P3 -","- C50 H78 Mo2 N4 O6 P6 -","2","1","","Clendenning, Scott B.; Hitchcock, Peter B.; Nixon, John F.; Nyulászi, László","Remarkable carbene-induced transformation of 2,4,6-tri-tert-butyl-1,3,5-triphosphabenzene, P3C3But3, to the 1,2,4-triphosphole, P3C2But2CBut(carbene). Crystal and molecular structure of the planar triphosphole complex [Mo(CO)3(η5-P3C2But2CBut(carbene))] [carbene = C(N(Me)C(Me)=C(Me)N(Me))]","Chemical Communications","2000","","14","1305","","10.1039/b001285h","","x-ray","0.71073","MoKα","","0.0275","0.0242","","","0.0576","0.0592","","","","","","1.026","","","","has coordinates,has disorder","180223","2020-10-21","18:00:00",""
"7110902","13.606","0.0017","17.608","0.003","32.497","0.004","90","","91.698","0.006","90","","7782","1.9","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","[Zn(L)4(H2O)3].H2O.0.25MeCN","","","- C72.5 H72.75 N8.25 O20 Zn8 -","- C72.5 H70.75 N8.25 O20 Zn8 -","- C290 H283 N33 O80 Zn32 -","4","1","","Sanmartín, Jesús; Bermejo, Manuel R.; García-Deibe, Ana M.; Llamas-Saiz, Antonio L.","Unusual high nuclearity and pseudo-tetrahedral Zn8O13 core found in a self-assembled complex","Chemical Communications","2000","","9","795","","10.1039/b001368o","","","1.54184","CuKα","","0.2279","0.0895","","","0.2625","0.345","","","","","","0.946","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7110903","8.353","0.001","13.317","0.001","23.533","0.001","90","","90","","90","","2617.7","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C31 H30 O2 Si -","- C31 H30 O2 Si -","- C124 H120 O8 Si4 -","4","1","","Jankowski, Paweł; Wicha, Jerzy; Zarecki, Andrzej; Schaumann, Ernst; Adiwidjaja, Gunadi; Asztemborska, Monika","Preparation of optically active n-butyl(methyl)phenyl-, tert-butyl(methyl)phenyl- and isopropyl(methyl)phenylsilanes from the corresponding silyl chlorides using 2,2′-dihydroxy-1,1′-binaphthyls as resolving agents","Chemical Communications","2000","","12","1029","","10.1039/b001440k","","","1.54184","CuKα","","0.0356","0.0356","","","0.1063","0.1063","","","","","","0.561","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110904","13.209","0.003","26.694","0.005","7.443","0.002","90","","105.57","0.03","90","","2528.1","1.1","110","2","110","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H12 Fe2 Mn3 N20 O13 -","- C28 H12 Fe2 Mn3 N20 O12.96 -","- C56 H24 Fe4 Mn6 N40 O25.92 -","2","0.5","","Smith, Jennifer A.; Galán-Mascarós, José-Ramón; Clérac, Rodolphe; Dunbar, Kim R.","{Mn(OH2)2[Mn(bpym)(OH2)]2[Fe(CN)6]2}∞: a two-dimensional ferrimagnet with a partial cubane motif","Chemical Communications","2000","","12","1077","","10.1039/b001513j","","","0.71069","MoKα","","0.3042","0.0715","","","0.163","0.29","","","","","","0.849","","","","has coordinates,has disorder","180223","2020-10-21","18:00:00",""
"7110905","20.349","0.002","10.095","0.002","21.338","0.002","90","","99.06","0.02","90","","4328.6","1.1","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C27 H20 N2 O2 -","- C27 H20 N2 O2 -","- C216 H160 N16 O16 -","8","1","","Asiri, Abdullah M. A.; Heller, Harry G.; Hursthouse, Michael B.; Karalulov, Alexander","Tribochromic compounds, exemplified by 3-dicyclopropylmethylene-5-dicyanomethylene-4-diphenylmethylenetetrahydrofuran-2-one","Chemical Communications","2000","","9","799","","10.1039/b001567i","","","0.71069","MoKα","","0.1359","0.064","","0.2435","0.1743","","","","0.573","0.73","0.73","","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110906","10.066","0.026","23.906","0.052","9.504","0.047","90","","110.38","0.18","90","","2144","13","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C27 H20 N2 O2 -","- C27 H20 N2 O2 -","- C108 H80 N8 O8 -","4","1","","Asiri, Abdullah M. A.; Heller, Harry G.; Hursthouse, Michael B.; Karalulov, Alexander","Tribochromic compounds, exemplified by 3-dicyclopropylmethylene-5-dicyanomethylene-4-diphenylmethylenetetrahydrofuran-2-one","Chemical Communications","2000","","9","799","","10.1039/b001567i","","","0.71069","MoKα","","0.2377","0.0897","","0.244","0.2076","","","","0.75","1.557","1.557","","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110907","10.9872","0.0002","13.0824","0.0002","27.2127","0.0001","84.68","","87.285","0.001","71.884","0.001","3700.9","0.09","183","2","183","2","","","","","","","","6","P -1","-P 1","2","Co2DPD","","","- C79 H86 Cl2 Co2 N8 O3 -","- C79 H86 Cl2 Co2 N8 O3 -","- C158 H172 Cl4 Co4 N16 O6 -","2","1","","Chang, Christopher J.; Deng, Yongqi; Nocera, Daniel G.; Shi, Chunnian; Anson, Fred C.; Chang, C. K.","Electrocatalytic four-electron reduction of oxygen to water by a highly flexible cofacial cobalt bisporphyrin","Chemical Communications","2000","","15","1355","","10.1039/b001620i","","","0.71073","MoKα","","0.1072","0.0977","","0.2889","0.2714","","","","1.082","1.08","1.08","","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110908","24.131","0.0005","10.626","0.0002","50.2717","0.0001","90","","99.512","0.001","90","","12713.2","0.4","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Co2DPX","","","- C79 H82 Co2 N8 O -","- C79 H82 Co2 N8 O -","- C632 H656 Co16 N64 O8 -","8","1","","Chang, Christopher J.; Deng, Yongqi; Nocera, Daniel G.; Shi, Chunnian; Anson, Fred C.; Chang, C. K.","Electrocatalytic four-electron reduction of oxygen to water by a highly flexible cofacial cobalt bisporphyrin","Chemical Communications","2000","","15","1355","","10.1039/b001620i","","","0.71073","MoKα","","0.1554","0.0848","","0.2646","0.2003","","","","1.224","1.198","1.198","","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110909","11.827","0.004","15.837","0.009","15.626","0.005","90","","94.87","0.03","90","","2916","2","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","[P6(CtBu)4SiI2]","","","- C20 H36 I2 P6 Si -","- C20 H36 I2 P6 Si -","- C80 H144 I8 P24 Si4 -","4","2","","Avent, Anthony G.; Cloke, F. Geoffrey N.; Francis, Matthew D.; Hitchcock, Peter B.; Nixon, John F.","Synthesis, crystal and molecular structures of the novel, structurally different, cage compounds P6C4But4SiI2 and P6C4But4GeI2, resulting from intra-molecular coupling of two 1,2,4-triphospholyl rings","Chemical Communications","2000","","10","879","","10.1039/b001632m","","","0.71073","MoKα","","0.0419","0.0326","","","0.0653","0.0696","","","","","","1.061","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110910","11.8196","0.0012","17.491","0.003","13.85","0.003","90","0.014","95.009","0.014","90","0.011","2852.4","0.8","173","2","173","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H36 Ge I2 P6 -","- C20 H36 Ge I2 P6 -","- C80 H144 Ge4 I8 P24 -","4","1","","Avent, Anthony G.; Cloke, F. Geoffrey N.; Francis, Matthew D.; Hitchcock, Peter B.; Nixon, John F.","Synthesis, crystal and molecular structures of the novel, structurally different, cage compounds P6C4But4SiI2 and P6C4But4GeI2, resulting from intra-molecular coupling of two 1,2,4-triphospholyl rings","Chemical Communications","2000","","10","879","","10.1039/b001632m","","","0.71073","MoKα","","0.0903","0.0462","","","0.0891","0.1076","","","","","","0.888","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110911","13.3036","0.0019","19.602","0.004","23.287","0.004","90","","90","","90","","6072.7","1.8","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C72.76 H50.76 Cl4.27 O5 P2 Pt -","- C72.756 H50.756 Cl4.268 O5 P2 Pt -","- C291.024 H203.024 Cl17.072 O20 P8 Pt4 -","4","1","","Gillon, Amy; Heslop, Katie; Hyett, David J.; Martorell, Aina; Orpen, A. Guy; Pringle, Paul G.; Claver, Carmen; Fernandez, Elena","Biarylphosphonites: a class of monodentate phosphorus(iii) ligands that outperform their chelating analogues in asymmetric hydrogenation catalysis","Chemical Communications","2000","","11","961","","10.1039/b001638l","","","0.71073","MoKα","","0.0731","0.0445","","","0.0853","0.0937","","","","","","0.973","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110912","14.8155","0.0016","19.132","0.003","23.69","0.002","90","","90","","90","","6714.9","1.4","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C72 H50 Cl8 O7 P2 Pt -","- C72 H50 Cl8 O7 P2 Pt -","- C288 H200 Cl32 O28 P8 Pt4 -","4","1","","Gillon, Amy; Heslop, Katie; Hyett, David J.; Martorell, Aina; Orpen, A. Guy; Pringle, Paul G.; Claver, Carmen; Fernandez, Elena","Biarylphosphonites: a class of monodentate phosphorus(iii) ligands that outperform their chelating analogues in asymmetric hydrogenation catalysis","Chemical Communications","2000","","11","961","","10.1039/b001638l","","","0.71073","MoKα","","0.0784","0.0498","","","0.0997","0.1122","","","","","","1.043","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110913","10.0645","0.0014","10.9349","0.0013","9.9598","0.0013","108.124","0.009","106.426","0.01","84.967","0.011","999.2","0.2","296","2","296","2","","","","","","","","7","P 1","P 1","1","","","","- C44 H49 B F4 O P Rh -","- C44 H49 B F4 O P Rh -","- C44 H49 B F4 O P Rh -","1","1","","Kataoka, Yasutaka; Iwato, Yoko; Shibahara, Atsushi; Yamagata, Tsuneaki; Tani, Kazuhide","Configurationally stable metal-centered chirality: stereospecific and regioselective rhodaacylation of alkynes controlled by the third generation of the [Cp′-P]H ligand","Chemical Communications","2000","","10","841","","10.1039/b001735n","","","0.71069","MoKα","","0.0416","0.0316","","","0.0826","0.0875","","","","","","1.026","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7110914","15.052","0.004","13.982","0.002","17.202","0.003","90","0.013","98.426","0.014","90","0.01","3581.2","1.3","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C38.14 H40.28 Cl0.28 Ir N6 O2 Rh -","- C38.14 H40.28 Cl0.28 Ir N6 O2 Rh -","- C152.56 H161.12 Cl1.12 Ir4 N24 O8 Rh4 -","4","1","","Connelly, Neil G.; Hayward, Owen D.; Klangsinsirikul, Phimphaka; Orpen, A. Guy; Rieger, Philip H.","Redox-active heterobinuclear triazenide-bridged complexes; ancillary ligand control of electron distribution in a three-electron metal‒metal bond","Chemical Communications","2000","","11","963","","10.1039/b001764g","","","0.71073","MoKα","","0.0891","0.047","","","0.0766","0.0882","","","","","","1.013","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110915","12.9339","0.001","15.1205","0.0013","18.301","0.003","83.5","0.08","71.74","0.06","88.57","0.07","3376.8","1.5","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C69 H62 Cl6 Ir N6 O2 P2 Rh -","- C69 H62 Cl6 Ir N6 O2 P2 Rh -","- C138 H124 Cl12 Ir2 N12 O4 P4 Rh2 -","2","1","","Connelly, Neil G.; Hayward, Owen D.; Klangsinsirikul, Phimphaka; Orpen, A. Guy; Rieger, Philip H.","Redox-active heterobinuclear triazenide-bridged complexes; ancillary ligand control of electron distribution in a three-electron metal‒metal bond","Chemical Communications","2000","","11","963","","10.1039/b001764g","","","0.71073","MoKα","","0.0438","0.0299","","","0.075","0.0794","","","","","","0.986","","","","has coordinates,has disorder","180223","2020-10-21","18:00:00",""
"7110916","12.967","0.003","13.714","0.002","19.83","0.003","97.712","0.012","98.499","0.019","90.43","0.012","3454.7","1.1","173","2","173","2","","","","","","","","9","P -1","-P 1","2","","","","- C67.5 H60 Cl3 F6 Ir N6 O2 P3 Rh -","- C67.5 H60 Cl3 F6 Ir N6 O2 P3 Rh -","- C135 H120 Cl6 F12 Ir2 N12 O4 P6 Rh2 -","2","1","","Connelly, Neil G.; Hayward, Owen D.; Klangsinsirikul, Phimphaka; Orpen, A. Guy; Rieger, Philip H.","Redox-active heterobinuclear triazenide-bridged complexes; ancillary ligand control of electron distribution in a three-electron metal‒metal bond","Chemical Communications","2000","","11","963","","10.1039/b001764g","","","0.71073","MoKα","","0.1494","0.064","","","0.1123","0.1431","","","","","","0.944","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7110917","12.316","0.0019","12.5698","0.0009","17.359","0.002","105.29","0.015","104.369","0.014","104.954","0.017","2355.9","0.7","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C49 H45 Cl3 N6 O2 P Pd Rh -","- C49 H45 Cl3 N6 O2 P Pd Rh -","- C98 H90 Cl6 N12 O4 P2 Pd2 Rh2 -","2","1","","Connelly, Neil G.; Hayward, Owen D.; Klangsinsirikul, Phimphaka; Orpen, A. Guy; Rieger, Philip H.","Redox-active heterobinuclear triazenide-bridged complexes; ancillary ligand control of electron distribution in a three-electron metal‒metal bond","Chemical Communications","2000","","11","963","","10.1039/b001764g","","","0.71073","MoKα","","0.056","0.0344","","","0.0786","0.0854","","","","","","1.014","","","","has coordinates,has disorder","180223","2020-10-21","18:00:00",""
"7110918","21.8855","0.0011","19.6232","0.001","22.1697","0.0011","90","","90.886","0.001","90","","9519.9","0.8","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Co-ISO","","","- C80 H104 Co2 N20 O36 -","- C80 H104 Co2 N20 O36 -","- C320 H416 Co8 N80 O144 -","4","0.5","","Barbour, Leonard J.; Orr, G. William; Atwood, Jerry L.","Characterization of a well resolved supramolecular ice-like (H2O)10 cluster in the solid state","Chemical Communications","2000","","10","859","","10.1039/b001862g","","","0.7107","MoKα","","0.1006","0.0673","","","0.1857","0.2084","","","","","","1.071","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110919","12.574","0.002","18.056","0.002","9.318","0.001","92.756","0.003","98.623","0.004","88.678","0.008","2088.9","0.5","93.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C30 H67 Bi0.5 Sb0.5 Si7 -","- C30 H67 Bi0.5 Sb0.5 Si7 -","- C60 H134 Bi Sb Si14 -","2","1","","Sasamori, Takahiro; Takeda, Nobuhiro; Tokitoh, Norihiro","Synthesis of a stable stibabismuthene; the first compound with an antimony‒bismuth double bond","Chemical Communications","2000","","15","1353","","10.1039/b001900n","","","0.7107","MoKα","","","0.0571","","","","0.149","","","","","","1.069","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110920","17.4941","0.0001","32.393","0.0004","10.0749","0.0002","90","","90","","90","","5709.31","0.14","293","2","293","2","","","","","","","","7","P c a 21","P 2c -2ac","29","MIL-31","","","- C20 H60 F3 Ga9 N4 O41 P9 -","- C20 F4 Ga9 N4 O40 P9 -","- C80 F16 Ga36 N16 O160 P36 -","4","1","","Sassoye, Capucine; Loiseau, Thierry; Férey, Gérard; Taulelle, Francis","A new open-framework fluorinated gallium phosphate with large 18-ring channels (MIL-31)","Chemical Communications","2000","","11","943","","10.1039/b001948h","","","0.71073","MoKα","","0.1292","0.0625","","0.1307","0.1068","","","","1.039","1.09","1.09","","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110921","8.739","0.009","9.404","0.009","6.411","0.008","103.23","0.08","97.33","0.09","111","0.08","465.9","1","150.2","","150.2","","","","","","","","","5","P 1","P 1","1","","","","- C20 H26 F N O2 -","- C20 H26 F N O2 -","- C20 H26 F N O2 -","1","1","","Takahashi, Tamiko; Fukuishima, Aki; Tanaka, Yuki; Takeuchi, Yoshio; Kabuto, Kuninobu; Kabuto, Chizuko","CFTA, a new efficient agent for determination of absolute configurations of chiral secondary alcohols","Chemical Communications","2000","","9","787","","10.1039/b001962n","","","0.7107","MoKα","","0.0615","0.0615","","","0.0623","0.0622","","","","","","2.832","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110922","7.0595","0.0021","7.4252","0.002","9.3827","0.0022","90","","90","","90","","491.8","0.2","293","2","293","2","","","","","","","","5","P m m n :2","-P 2ab 2a","59","dichloroethylendithiolone","5,6-Dichloro-5,6-dihydro-[1,3]dithiolo[4,5-b][1,4]dithiin-2one","","- C5 H2 Cl2 O S4 -","- C5 Cl2 O S4 -","- C10 Cl4 O2 S8 -","2","0.25","","Dautel, Olivier J.; Larsen, Jan; Fourmigué, Marc","Electrophilic halogenation of thioethers: 5-chloro- and 5,6-dichloro-5,6-dihydro-1,3-dithiolo[4,5-b][1,4]dithiine-2-one and an efficient synthesis of vinylenedithiotetrathiafulvalene (VDT-TTF)","Chemical Communications","2000","","13","1117","","10.1039/b001996h","","","0.71073","MoKα","","0.0687","0.0357","","","0.0871","0.097","","","","","","0.816","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110923","6.4203","0.0013","14.905","0.003","11.648","0.002","90","","93.58","0.03","90","","1112.5","0.4","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","VDT-TTF","2-[1,3]dithiol-2-ylidene-[1,3]dithiolo[4,5-b][1,4]dithiine","","- C8 H4 S6 -","- C8 H4 S6 -","- C32 H16 S24 -","4","1","","Dautel, Olivier J.; Larsen, Jan; Fourmigué, Marc","Electrophilic halogenation of thioethers: 5-chloro- and 5,6-dichloro-5,6-dihydro-1,3-dithiolo[4,5-b][1,4]dithiine-2-one and an efficient synthesis of vinylenedithiotetrathiafulvalene (VDT-TTF)","Chemical Communications","2000","","13","1117","","10.1039/b001996h","","","0.71073","MoKα","","0.0412","0.0268","","","0.0565","0.059","","","","","","0.886","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110924","9.759","0.0002","21.354","0.0004","16.794","0.0006","90","","98.073","0.005","90","","3465.08","0.16","173","","173","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H48 Li4 N4 Si4 -","- C26 H48 Li4 N4 Si4 -","- C104 H192 Li16 N16 Si16 -","4","1","","Gauvin, Régis M.; Kress, Jacky; Kyritsakas, Nathalie; Fischer, Jean","The arched four-rung ladder structure of the unsolvated dilithium salt of N,N′-bis(trimethylsilyl)-2-aminobenzylamine, and its structural deformation on THF complexation","Chemical Communications","2000","","11","965","","10.1039/b002004o","","","0.71073","Mo-Kα","","0.073","0.038","","0.292","","0.058","","","5.653","","","1.146","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110925","19.9167","0.0009","9.8818","0.0002","22.1151","0.0009","90","","99.75","0.002","90","","4289.7","0.3","173","","173","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C34 H64 Li4 N4 O2 Si4 -","- C34 H58 Li4 N4 O2 Si4 -","- C136 H232 Li16 N16 O8 Si16 -","4","1","","Gauvin, Régis M.; Kress, Jacky; Kyritsakas, Nathalie; Fischer, Jean","The arched four-rung ladder structure of the unsolvated dilithium salt of N,N′-bis(trimethylsilyl)-2-aminobenzylamine, and its structural deformation on THF complexation","Chemical Communications","2000","","11","965","","10.1039/b002004o","","","0.71073","Mo-Kα","","0.102","0.043","","0.097","","0.064","","","1.58","","","1.079","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110926","13.69","0.002","13.69","0.002","63.88","0.009","90","","90","","120","","10368","3","293","2","293","2","","","","","","","","6","P 31 2 1","P 31 2""","152","","","","- C108 H152 Co5 N18 O42 S5 -","- C108 H108 Co5 N18 O42 S5 -","- C324 H324 Co15 N54 O126 S15 -","3","0.5","","Carlucci, Lucia; Ciani, Gianfranco; Proserpio, Davide M.; Rizzato, Silvia","Chiral packing of chiral quintuple layers polycatenated to give a three-dimensional network in the coordination polymer [Co5(bpe)9(H2O)8(SO4)4](SO4)·14H2O [bpe = 1,2-bis(4-pyridyl)ethane]","Chemical Communications","2000","","14","1319","","10.1039/b002021o","","","0.71073","MoKα","","0.0921","0.088","","0.2489","0.2458","","","","1.133","","","","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110927","10.773","0.002","7.861","0.002","19.492","0.004","90","","92.42","0.03","90","","1649.2","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C19 H20 O3 S -","- C19 H20 O3 S -","- C76 H80 O12 S4 -","4","1","","Badland, Matthew; Cleeves, Alison; Heller, Harry G.; Hughes, David S.; Hursthouse, Michael B.","Photochromic heteroaromatic thiofulgides and dimethoxybutanoic acid lactones","Chemical Communications","2000","","17","1567","","10.1039/b002033h","","","0.71069","MoKα","","0.0686","0.0517","","0.1179","0.109","","","","0.836","0.964","0.964","","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110928","8.403","0.002","11.995","0.003","7.787","0.002","98.41","0.02","95.26","0.02","109.72","0.02","722.5","0.3","293.2","","293.2","","","","","","","","","4","P -1","-P 1","2","","","","- C30 H24 N2 O12 -","- C30 H16 N2 O12 -","- C30 H16 N2 O12 -","1","0.5","","Degenhardt III, Charles; Shortell, David Brian; Adams, Richard D.; Shimizu, Ken D.","Synthesis and structural characterization of adaptable shape-persistent building blocks","Chemical Communications","2000","","11","929","","10.1039/b002085k","","","0.7107","MoKα","","0.1047","0.1047","","0.1764","","0.1764","","","3.447","","","3.447","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110929","9.8448","0.0009","13.2382","0.0012","11.0507","0.001","90","","99.152","0.002","90","","1421.9","0.2","150","2","150","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C17 H24 O3 -","- C17 H24 O3 -","- C68 H96 O12 -","4","1","","Bassindale, Martin J.; Edwards, Andrew S.; Adams, Harry; Harrity, Joseph P. A.; Hamley, Peter","The synthesis of angularly fused tricyclic compounds via tandem ring closing metathesis reactions","Chemical Communications","2000","","12","1035","","10.1039/b002136i","","","0.71073","MoKα","","0.0774","0.0586","","","0.1677","0.182","","","","","","1.05","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110930","16.567","0.006","13.585","0.005","13.245","0.004","90","","128.712","0.005","90","","2326","1.4","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C14 H20 O2 -","- C14 H20 O2 -","- C112 H160 O16 -","8","2","","Bassindale, Martin J.; Edwards, Andrew S.; Adams, Harry; Harrity, Joseph P. A.; Hamley, Peter","The synthesis of angularly fused tricyclic compounds via tandem ring closing metathesis reactions","Chemical Communications","2000","","12","1035","","10.1039/b002136i","","","0.71073","MoKα","","0.1894","0.0852","","","0.1551","0.1995","","","","","","0.984","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110931","8.6041","0.0005","13.1932","0.0007","19.0521","0.001","90","","90","","90","","2162.7","0.2","150","2","150","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C13 H18 O2 -","- C13 H18 O2 -","- C104 H144 O16 -","8","1","","Bassindale, Martin J.; Edwards, Andrew S.; Adams, Harry; Harrity, Joseph P. A.; Hamley, Peter","The synthesis of angularly fused tricyclic compounds via tandem ring closing metathesis reactions","Chemical Communications","2000","","12","1035","","10.1039/b002136i","","","0.71073","MoKα","","0.0693","0.0572","","","0.1503","0.1589","","","","","","0.981","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110932","20.262","0.0005","20.262","0.0005","43.104","0.0007","90","","90","","90","","17696.3","0.7","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","resorcarene","4,6,10,12,16,18,22,24-Octahydroxy-2,8,14,20-(tetraethyl)calix[4]arene","","- C78 H80 Br N O31.63 -","- C78 H80 Br N O31.62 -","- C624 H640 Br8 N8 O252.96 -","8","0.5","","Shivanyuk, Alexander; Rissanen, Kari; Kolehmainen, Erkki","Encapsulation of Et3N±-H···OH2 in a hydrogen-bonded resorcarene capsule","Chemical Communications","2000","","13","1107","","10.1039/b002144j","","","0.71073","MoKα","","0.0809","0.0539","","","0.1598","0.18","","","","","","1.106","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110933","17.5459","0.0017","29.323","0.003","9.1556","0.0007","90","","90","","90","","4710.5","0.8","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- Cl26.51 Cs1.78 Nb12 O8.14 Ti3 -","- Cl26.513 Cs1.785 Nb12 O8.139 Ti3 -","- Cl106.052 Cs7.14 Nb48 O32.556 Ti12 -","4","0.5","","Anokhina, Ekaterina V.; Day, Cynthia S.; Lachgar, Abdessadek","A new layered niobium oxochloride cluster compound with novel framework topology","Chemical Communications","2000","","16","1491","","10.1039/b002147o","","","0.71073","MoKα","","0.1011","0.0544","","","0.1059","0.1173","","","","","","1.027","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110934","7.976","0.001","30.996","0.005","15.559","0.002","90","","104.47","0.01","90","","3724.5","0.9","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","tri(bicopper tetraacetate) bis(1,3,5-tri(4-pyridyl)-2,4,6-triazine) bismethanol solvate","","- C62 H68 Cu6 N12 O26 -","- C62 H66 Cu6 N12 O26 -","- C124 H132 Cu12 N24 O52 -","2","0.5","","Batten, Stuart R.; Hoskins, Bernard F.; Robson, Richard; Moubaraki, Boujemaa; Murray, Keith S.","An alternative to interpenetration whereby nets with large windows may achieve satisfactory space filling","Chemical Communications","2000","","13","1095","","10.1039/b002193h","","","1.5418","CuKα","","0.1436","0.0739","","","0.1607","0.1952","","","","","","1.02","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110935","9.567","0.006","11.994","0.006","15.986","0.005","90","","100.57","0.04","90","","1803.2","1.6","","","300","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tricarbonyl(dicloro){O,C-[methoxy(o-methoxyphenyl)carbene]}tungsten","","- C13 H12 Cl4 O5 W -","- C13 H12 Cl4 O5 W -","- C52 H48 Cl16 O20 W4 -","4","1","","Jaeger, Monika; Stumpf, Rüdiger; Troll, Carsten; Fischer, Helmut","Novel hepta-coordinated molybdenum(ii) and tungsten(ii) carbene complexes by oxidative decarbonylation of Mo(0) and W(0) carbene complexes","Chemical Communications","2000","","11","931","","10.1039/b002228o","","","0.71073","MoKα","","0.058","0.034","","0.041","0.037","","","","","1.168","1.168","","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110936","14.6057","0.0003","15.2988","0.0004","15.6144","0.0004","81.596","0.001","81.663","0.001","83.954","0.002","3402.45","0.14","173","2","173","2","","","","","","","","3","P -1","-P 1","2","[C60Me5(OH)(O)2]","","","- C65 H16 O3 -","- C65 H15 O2.9185 -","- C260 H60 O11.674 -","4","2","","Al-Matar, Hamad; Hitchcock, Peter B.; Avent, Anthony G.; Taylor, Roger","Isolation and characterisation of Cs-symmetry C60Me5O2OH, the first methylated fullerenol; a bis-epoxide with two oxygens in a pentagonal ring","Chemical Communications","2000","","12","1071","","10.1039/b002254n","","","0.71073","MoKα","","0.087","0.0746","","","0.1986","0.205","","","","","","1.065","","","","has coordinates,has disorder","180223","2020-10-21","18:00:00",""
"7110937","11.37","0.002","16.982","0.004","19.115","0.004","90","","103.657","0.004","90","","3586.5","1.3","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H29 N Si2 -","- C17 H29 N Si2 -","- C136 H232 N8 Si16 -","8","2","","Beckwith, Rohan E. J.; Blake, Alexander J.; Simpkins, Nigel S.; Wilson, Claire; Gravestock, Michael B.","Nucleophilic addition reactions of bridged triene η6-chromiumtricarbonyl complexes","Chemical Communications","2000","","13","1097","","10.1039/b002256j","","","0.71073","MoKα","","0.0993","0.0484","","","0.107","0.125","","","","","","0.912","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110938","6.8685","0.0012","9.314","0.002","19.746","0.004","102.19","0.003","95.424","0.003","98.875","0.003","1209.3","0.4","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H34 O2 S Si2 -","- C22 H34 O2 S Si2 -","- C44 H68 O4 S2 Si4 -","2","1","","Beckwith, Rohan E. J.; Blake, Alexander J.; Simpkins, Nigel S.; Wilson, Claire; Gravestock, Michael B.","Nucleophilic addition reactions of bridged triene η6-chromiumtricarbonyl complexes","Chemical Communications","2000","","13","1097","","10.1039/b002256j","","","0.71073","MoKα","","0.0585","0.051","","","0.142","0.148","","","","","","1.059","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7110939","8.0682","0.0005","8.9506","0.0008","16.6435","0.0012","90","","92.763","0.0009","90","","1200.52","0.16","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H43 Cl P2 Ru -","- C18 H43 Cl P2 Ru -","- C36 H86 Cl2 P4 Ru2 -","2","0.5","","van der Schaaf, Paul A.; Kolly, Roman; Hafner, Andreas","A 14-electron ruthenium hydride: the key intermediate in the synthesis of ruthenium carbene complexes; X-ray structure of [RuHCl(PPri3)2]","Chemical Communications","2000","","12","1045","","10.1039/b002298p","","","0.71073","MoKα","","0.045","0.0382","","","0.1168","0.1219","","","","","","1.106","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110940","8.0641","0.0008","8.9361","0.0006","16.684","0.0015","90","","92.736","0.011","90","","1200.91","0.18","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H43 Cl P2 Ru -","- C18 H43 Cl P2 Ru -","- C36 H86 Cl2 P4 Ru2 -","2","0.5","","van der Schaaf, Paul A.; Kolly, Roman; Hafner, Andreas","A 14-electron ruthenium hydride: the key intermediate in the synthesis of ruthenium carbene complexes; X-ray structure of [RuHCl(PPri3)2]","Chemical Communications","2000","","12","1045","","10.1039/b002298p","","","0.71073","MoKα","","0.0474","0.0423","","","0.1361","0.1421","","","","","","1.126","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110941","9.8438","0.0008","10.2011","0.0008","10.8356","0.0009","114.29","0.009","108.475","0.009","90.824","0.01","927.37","0.17","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H67 Cl P2 Ru -","- C36 H67 Cl P2 Ru -","- C36 H67 Cl P2 Ru -","1","0.5","","van der Schaaf, Paul A.; Kolly, Roman; Hafner, Andreas","A 14-electron ruthenium hydride: the key intermediate in the synthesis of ruthenium carbene complexes; X-ray structure of [RuHCl(PPri3)2]","Chemical Communications","2000","","12","1045","","10.1039/b002298p","","","0.71073","MoKα","","0.0439","0.0412","","","0.1251","0.1277","","","","","","1.09","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110942","8.471","0.004","16.716","0.01","14.781","0.006","90","","100.21","0.03","90","","2059.9","1.8","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 H30 Cr N2 -","- C22 H30 Cr N2 -","- C88 H120 Cr4 N8 -","4","1","","Siemeling, Ulrich; Kölling, Lars; Stammler, Anja; Stammler, Hans-Georg; Kaminski, Eric; Fink, Gerhard","Polymerisation of acrylonitrile with di(organoimido)chromium(vi) complexes","Chemical Communications","2000","","13","1177","","10.1039/b002310h","","","0.71073","MoKα","","0.1084","0.057","","","0.105","0.1222","","","","","","1.028","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110943","18.551","0.003","18.551","0.003","18.0135","0.0016","90","","90","","120","","5368.6","1.3","293","2","293","2","","","","","","","","5","P 31 2 1","P 31 2""","152","","","","- C52 H72 Cu4 N4 O26 -","- C52 H70 Cu4 N4 O26 -","- C156 H210 Cu12 N12 O78 -","3","0.5","","Fragoso, Alex; Kahn, Myrtil L.; Sutter, Jean-Pascal; Kahn, Olivier; Cao, Roberto; Castiñeiras, Alfonso","Chiral channels in a 3-D network of self-assembled tetranuclear copper(ii) aggregates","Chemical Communications","2000","","16","1547","","10.1039/b002360o","","","1.54184","CuKα","","0.0931","0.0541","","","0.1339","0.1476","","","","","","1.003","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110944","8.386","0.002","5.7","0.002","9.456","0.002","90","","103.81","0.03","90","","438.9","0.2","220","2","220","2","","","","","","","","4","P 1 2/n 1","-P 2yac","13","","","","- C6 H13 N O4 -","- C6 H13 N O4 -","- C12 H26 N2 O8 -","2","0.5","","Mascal, Mark; Marjo, Christopher E.; Blake, Alexander J.","Breakdown of the hydrogen bond strength‒length analogy: a revision","Chemical Communications","2000","","17","1591","","10.1039/b002361m","","","0.71073","MoKα","","0.0472","0.042","","","0.1132","0.1198","","","","","","1.07","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110945","14.291","0.006","10.933","0.007","15.38","0.02","90","","90.99","0.11","90","","2403","4","220","2","220","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H21 N O4 -","- C10 H19.416 N O4 -","- C80 H155.328 N8 O32 -","8","2","","Mascal, Mark; Marjo, Christopher E.; Blake, Alexander J.","Breakdown of the hydrogen bond strength‒length analogy: a revision","Chemical Communications","2000","","17","1591","","10.1039/b002361m","","","0.71073","MoKα","","0.215","0.152","","","0.349","0.422","","","","","","1.17","","","","has coordinates,has disorder","180223","2020-10-21","18:00:00",""
"7110946","16.529","0.004","17.616","0.005","17.244","0.005","90","","90","","90","","5021","2","150","2","150","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C20 H17 N7 O13.5 Sm -","- C20 H16 N7 O13.5 Sm -","- C160 H128 N56 O108 Sm8 -","8","1","","Long, De-Liang; Blake, Alexander J.; Champness, Neil R.; Schröder, Martin","Lanthanide co-ordination frameworks of 4,4′-bipyridine-N,N′-dioxide","Chemical Communications","2000","","15","1369","","10.1039/b002363i","","","0.71073","MoKα","","0.0438","0.0329","","","0.0686","0.0772","","","","","","1.165","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"7110947","26.435","0.006","26.435","0.006","7.584","0.002","90","","90","","90","","5300","2","220","2","220","2","","","","","","","","5","P -4 21 c","P -4 2n","114","","","","- C16 H16 Er N6 O13 -","- C16 H12 Er N6 O13 -","- C128 H96 Er8 N48 O104 -","8","1","","Long, De-Liang; Blake, Alexander J.; Champness, Neil R.; Schröder, Martin","Lanthanide co-ordination frameworks of 4,4′-bipyridine-N,N′-dioxide","Chemical Communications","2000","","15","1369","","10.1039/b002363i","","","0.71073","MoKα","","0.097","0.076","","","0.164","0.179","","","","","","1.1","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7110948","16.305","0.0003","17.6498","0.0003","15.9096","0.0002","90","","100.777","0.0011","90","","4497.71","0.13","123","1","123","1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C48 H57 Ga3 O6 -","- C48 H57 Ga2.5 O5 -","- C192 H228 Ga10 O20 -","4","0.5","","Nichols, Peter J.; Papadopoulos, Stavroula; Raston, Colin L.","Reaction of tris-arylgallium(iii) with water: biaryl coupling versus Ga‒C hydrolysis","Chemical Communications","2000","","14","1227","","10.1039/b002422h","","","0.7107","MoKα","","0.0672","0.0672","","0.0824","","0.0824","","","5.863","","","5.863","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110949","22.5232","0.0002","22.5232","0.0002","20.8835","0.0002","90","","90","","120","","9174.75","0.14","123","1","123","1","","","","","","","","4","R -3 :H","-R 3","148","","","","- C40 H78 Ga6 O9 -","- C171 H198 Ga18 O20.166 -","- C1026 H1188 Ga108 O120.996 -","6","0.333333","","Nichols, Peter J.; Papadopoulos, Stavroula; Raston, Colin L.","Reaction of tris-arylgallium(iii) with water: biaryl coupling versus Ga‒C hydrolysis","Chemical Communications","2000","","14","1227","","10.1039/b002422h","","","0.7107","MoKα","","0.0611","0.0611","","0.0599","","0.0599","","","4.55","","","4.55","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110950","39.397","0.007","5.545","0.001","24.783","0.003","90","","110.9","0.01","90","","5057.8","1.5","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","N,N-dibenzycarbamic acid","","- C15 H15 N O2 -","- C15 H15 N O2 -","- C240 H240 N16 O32 -","16","2","","Aresta, Michele; Ballivet-Tkatchenko, Danielle; Dell’Amico, Daniela Belli; Boschi, Daniele; Calderazzo, Fausto; Labella, Luca; Bonnet, Michel C.; Faure, René; Marchetti, Fabio","Isolation and structural determination of two derivatives of the elusive carbamic acid","Chemical Communications","2000","","13","1099","","10.1039/b002479l","","","0.71073","MoKα","","0.0826","0.0411","","","0.0845","0.1012","","","","","","1.019","","","","has coordinates,has disorder","180223","2020-10-21","18:00:00",""
"7110951","15.339","0.001","8.85","0.001","18.402","0.002","90","","101.98","0.01","90","","2443.7","0.4","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N,N-dibenzylammonium N,N-dibenzylcarbamate","","- C29 H30 N2 O2 -","- C29 H30 N2 O2 -","- C116 H120 N8 O8 -","4","1","","Aresta, Michele; Ballivet-Tkatchenko, Danielle; Dell’Amico, Daniela Belli; Boschi, Daniele; Calderazzo, Fausto; Labella, Luca; Bonnet, Michel C.; Faure, René; Marchetti, Fabio","Isolation and structural determination of two derivatives of the elusive carbamic acid","Chemical Communications","2000","","13","1099","","10.1039/b002479l","","","","MoKα","","0.085","0.0447","","","0.088","0.1039","","","","","","1.042","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110952","9.612","0.002","11.936","0.003","12.371","0.004","73.34","0.02","69.94","0.02","66.18","0.02","1201.4","0.6","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","N-carboxy-P-phenyl-P-dinitrosylchlorocobalt(i)-1-aza-4,6-dioxa-5- phosphacycl oottane","","- C17 H26 Cl Co N3 O8 P -","- C17 H26 Cl Co N3 O8 P -","- C34 H52 Cl2 Co2 N6 O16 P2 -","2","1","","Aresta, Michele; Ballivet-Tkatchenko, Danielle; Dell’Amico, Daniela Belli; Boschi, Daniele; Calderazzo, Fausto; Labella, Luca; Bonnet, Michel C.; Faure, René; Marchetti, Fabio","Isolation and structural determination of two derivatives of the elusive carbamic acid","Chemical Communications","2000","","13","1099","","10.1039/b002479l","","","0.71073","MoKα","","0.1321","0.0915","","","0.2348","0.3093","","","","","","1.157","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110953","6.0174","0.0008","20.717","0.003","7.6596","0.001","90","","108.215","0.003","90","","907","0.2","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C19 H24 O5 Se -","- C19 H24 O5 Se -","- C38 H48 O10 Se2 -","2","1","","Clark, J. Stephen; Wong, Yung-Sing","Construction of the 11-oxabicyclo[6.2.1]undecane core of the cladiellins by a novel rearrangement reaction","Chemical Communications","2000","","12","1079","","10.1039/b002511i","","","0.71073","MoKα","","0.0348","0.0278","","","0.0568","0.0588","","","","","","0.965","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110954","5.2491","0.0002","21.3577","0.001","16.4109","0.0008","90","","90.709","0.003","90","","1839.66","0.14","150","2","150","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C19 H23 Cl O4 Se -","- C19 H23 Cl O4 Se -","- C76 H92 Cl4 O16 Se4 -","4","2","","Clark, J. Stephen; Wong, Yung-Sing","Construction of the 11-oxabicyclo[6.2.1]undecane core of the cladiellins by a novel rearrangement reaction","Chemical Communications","2000","","12","1079","","10.1039/b002511i","","","0.71073","MoKα","","0.116","0.0583","","","0.0894","0.103","","","","","","0.972","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110955","18.256","0.004","20.59","0.005","20.454","0.005","90","","111.28","0.06","90","","7164","4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C38 H42 N2 O4 P2 Ru -","- C38 H42 N2 O4 P2 Ru -","- C304 H336 N16 O32 P16 Ru8 -","8","2","","Braunstein, Pierre; Naud, Frédéric; Graiff, Claudia; Tiripicchio, Antonio","Unexpected and then rational synthesis of a new class of anionic phosphino‒oxazoline ligands; structure and catalytic properties of a ruthenium complex","Chemical Communications","2000","","11","897","","10.1039/b002515l","","","0.71073","MoKα","","0.1381","0.0369","","","0.0677","0.0876","","","","","","0.772","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110956","7.6677","0.0006","11.419","0.001","21.001","0.001","90","","90","","90","","1838.8","0.2","200","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","3-bromobarekoxide","","- C20 H33 Br O -","- C20 H33 Br O -","- C80 H132 Br4 O4 -","4","1","","Kuniyoshi, Masayuki; Marma, Mong S.; Higa, Tatsuo; Bernardinelli, Gérald; Jefford, Charles W.","3-Bromobarekoxide, an unusual diterpene from Laurencia luzonensis","Chemical Communications","2000","","13","1155","","10.1039/b002530p","","","1.54183","CuKα","","","0.031","","","","0.03","","","","","","2.669","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110957","11.477","0.004","25.327","0.009","11.595","0.005","90","","98.54","0.04","90","","3333","2","293","2","293","2","","","","","","","chemical synthesis","5","P 1 21/n 1","-P 2yn","14","Bis(diphenylphosphino)methane-terpyridyl Pd complex","Bis(diphenylphosphino)methane-terpyridyl Pd(II) complex","","- C80 H60 N6 P4 Pd -","- C80 H60 N6 P4 Pd -","- C160 H120 N12 P8 Pd2 -","2","0.5","","Pickaert, Guillaume; Douce, Laurent; Ziessel, Raymond; Cesario, Michèle","Synthesis and coordinative properties of a hybrid bis(diphenylphosphino)methane‒terpyridine","Chemical Communications","2000","","13","1125","","10.1039/b002586k","","","0.71073","MoKα","","0.1328","0.0705","","0.1423","","0.1194","","","1.068","","","1.161","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110958","27.1904","0.0013","9.8355","0.0007","19.0955","0.0011","90","","110.777","0.003","90","","4774.6","0.5","150","1","150","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H39 B P3 Pt -","- C18 H39 B P3 Pt -","- C144 H312 B8 P24 Pt8 -","8","1","","Dorn, Hendrik; Jaska, Cory A.; Singh, Ryan A.; Lough, Alan J.; Manners, Ian","Synthesis and novel reactivity of platinum phosphine‒borane complexes trans-[PtH(PPhR·BH3)(PEt3)2] (R = H, Ph)","Chemical Communications","2000","","12","1041","","10.1039/b002615h","","","0.71073","MoKα","","0.049","0.0387","","","0.0916","0.0969","","","","","","1.042","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110959","24.521","0.004","24.521","0.004","20.201","0.004","90","","90","","120","","10519","3","150","2","150","2","","","","","","","","5","R -3 :H","-R 3","148","","(3-mesityl-1-(2-picolyl)-imidazolin-2-ylidene) palladium methyl bromide","","- C19 H22 Br N3 Pd -","- C19 H22 Br N3 Pd -","- C342 H396 Br18 N54 Pd18 -","18","1","","Tulloch, Arran A. D.; Danopoulos, Andreas A.; Cafferkey, Sean M.; Kleinhenz, Sven; Hursthouse, Michael B.; Tooze, Robert P.","Pyridine functionalised N-heterocyclic carbene complexes of palladium","Chemical Communications","2000","","14","1247","","10.1039/b002645j","","","0.71073","MoKα","","0.0636","0.0439","","","0.1072","0.1142","","","","","","1.066","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110960","9.852","0.002","20.026","0.004","21.056","0.004","89.95","0.03","90.19","0.03","90.04","0.03","4154.2","1.4","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C68 H89 F12 N12 O9 Pd4 -","- C68 H89 F12 N12 O9 Pd4 -","- C136 H178 F24 N24 O18 Pd8 -","2","1","","Tulloch, Arran A. D.; Danopoulos, Andreas A.; Cafferkey, Sean M.; Kleinhenz, Sven; Hursthouse, Michael B.; Tooze, Robert P.","Pyridine functionalised N-heterocyclic carbene complexes of palladium","Chemical Communications","2000","","14","1247","","10.1039/b002645j","","","0.71073","MoK/a","","0.265","0.1095","","","0.2539","0.323","","","","","","1.03","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110961","8.763","0.002","10.534","0.002","15.243","0.002","90","","97.31","0.02","90","","1395.6","0.5","301.2","","301.2","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C30 H44 N6 Ru -","- C30 H44 N6 Ru -","- C60 H88 N12 Ru2 -","2","0.5","","Choi, Mei-Yuk; Chan, Michael C. W.; Cheung, Kung-Kai; Che, Chi-Ming; Peng, Shie-Ming","Molecular rods based on a ruthenium(ii) macrocyclic bis(acetylide) building block","Chemical Communications","2000","","14","1259","","10.1039/b002674n","","","0.7107","MoKalpha","","","0.0643","","","0.0776","","","","","2.26","2.26","","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110962","8.3284","0.0002","10.5843","0.0003","20.8961","0.0005","84.37","0.001","84.973","0.001","88.998","0.001","1825.99","0.08","295","2","295","2","","","","","","","","8","P -1","-P 1","2","","","","- C62 H70 F6 N10 O13 Re2 Ru S2 -","- C62 H34 F6 N10 O13 Re2 Ru S2 -","- C62 H34 F6 N10 O13 Re2 Ru S2 -","1","0.5","","Choi, Mei-Yuk; Chan, Michael C. W.; Cheung, Kung-Kai; Che, Chi-Ming; Peng, Shie-Ming","Molecular rods based on a ruthenium(ii) macrocyclic bis(acetylide) building block","Chemical Communications","2000","","14","1259","","10.1039/b002674n","","","0.71073","MoKα","","0.1326","0.0649","","0.166","0.1329","","","","1.028","1.094","1.094","","","","","has coordinates,has disorder","180223","2020-10-21","18:00:00",""
"7110963","13.016","0.0002","11.291","0.0003","15.7543","0.0004","90","","105.039","0.001","90","","2236.01","0.09","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C7 H5 Cd K N2 O8 -","- C7 H5 Cd K N2 O8 -","- C56 H40 Cd8 K8 N16 O64 -","8","1","","Prasad, P. A.; Neeraj, S.; Natarajan, Srinivasan; Rao, C. N. R.","Synthesis and structure of the first open-framework cadmium oxalate possessing channels","Chemical Communications","2000","","14","1251","","10.1039/b002684k","","","0.71073","MoKα","","0.0302","0.0259","","0.0664","0.0648","","","","1.068","1.103","1.103","","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110964","18.85","0.003","15.338","0.004","20.992","0.004","90","","90","","90","","6069","2","173","2","173","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C29.5 H22 F2 I3 O P2 Rh -","- C29.5 H22 F2 I3 O P2 Rh -","- C236 H176 F16 I24 O8 P16 Rh8 -","8","1","","Carraz, Charles-Antoine; Orpen, A. Guy; Ellis, Dianne D.; Pringle, Paul G.; Ditzel, Evert J.; Sunley, Glenn J.","Rhodium(i) complexes of unsymmetrical diphosphines: efficient and stable methanol carbonylation catalysts","Chemical Communications","2000","","14","1277","","10.1039/b002802i","","","0.71073","MoKα","","0.0526","0.0382","","0.0981","0.0854","","","","1.165","1.132","1.132","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7110965","19.352","0.002","24.599","0.002","15.916","0.002","90","","109.378","0.007","90","","7147.4","1.3","293","2","293","2","","","","","","","","3","C 1 2 1","C 2y","5","beta-CD/butyrophenone unidecahydrate","","","- C52 H105 O47.5 -","- C52.01 H59.02 O47.51 -","- C208.04 H236.08 O190.04 -","4","1","","Brett, Tom J.; Stezowski, John J.","Structural studies of supramolecular β-cyclodextrin complexes with butyrophenone and valerophenone: an explanation for photochemical reaction modification","Chemical Communications","2000","","10","857","","10.1039/b002828m","","","0.71073","MoKα","","0.0851","0.0668","","","0.1748","0.1929","","","","","","1.052","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7110966","19.339","0.002","25.581","0.001","16.01","0.002","90","","109.08","0.007","90","","7485.2","1.3","293","2","293","2","","","","","","","","3","C 1 2 1","C 2y","5","beta-CD/valerophenone unidecahydrate","","","- C53 H106 O47 -","- C53 H63 O46.861 -","- C212 H252 O187.444 -","4","1","","Brett, Tom J.; Stezowski, John J.","Structural studies of supramolecular β-cyclodextrin complexes with butyrophenone and valerophenone: an explanation for photochemical reaction modification","Chemical Communications","2000","","10","857","","10.1039/b002828m","","","0.71073","MoKα","","0.1426","0.0915","","","0.2504","0.2986","","","","","","1.02","","","","has coordinates,has disorder","180223","2020-10-21","18:00:00",""
"7110967","11.8142","0.0007","11.8617","0.0007","20.5469","0.0013","74.844","0.002","84.437","0.002","83.078","0.002","2752.5","0.3","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C124 H148 Mg4 O10 -","- C124 H148 Mg4 O10 -","- C124 H148 Mg4 O10 -","1","0.5","","Allan, John F.; Henderson, Kenneth W.; Kennedy, Alan R.; Teat, Simon J.","Synthesis and structural characterisation of a magnesium bisenolate: a tetrameric (Mg2O2)2 chain terminated by solvating ketone","Chemical Communications","2000","","12","1059","","10.1039/b002892o","","","0.6884","synchrotron","","0.096","0.068","","","0.174","0.1823","","","","","","1.002","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110968","8.5237","0.0012","17.014","0.003","12.103","0.002","90","","98.7","0.02","90","","1735","0.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C10 H16 Cr Cu K N10 -","- C10 H16 Cr Cu K N10 -","- C40 H64 Cr4 Cu4 K4 N40 -","4","0.5","","Yuan, Aihua; Li, Baolong; Zha, Zhenggen; Duan, Chunying; Liu, Yongjian; Xu, Zheng; Zou, Jianzhong; Keizer, Steven","An unusual three-dimensional porous framework complex {[Cu(en)2][KCr(CN)6]}∞(en = ethylenediamine) from a template self-assembly reaction","Chemical Communications","2000","","14","1297","","10.1039/b002913k","","","0.71073","MoKα","","0.0578","0.0505","","0.1533","0.1491","","","","1.096","1.137","1.137","","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110969","7.462","0.007","11.991","0.003","21.169","0.007","90","","90","","90","","1894.1","1.9","293","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C18 H18 B Cl F4 Fe O2 -","- C18 H18 B Cl F3.5 Fe O2 -","- C72 H72 B4 Cl4 F14 Fe4 O8 -","4","1","","Ferré, Karine; Le Mignot, Philippe; Guerchais, Véronique; Sinbandhit, Sourisak; Toupet, Loïc","Regioselective iron-mediated C‒C coupling reactions: role of the iodide anion","Chemical Communications","2000","","15","1405","","10.1039/b002921l","","","0.71069","MoKα","","0.1519","0.0798","","0.2501","0.2063","","","","1.019","1.019","1.019","","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110970","31.771","0.006","14.038","0.004","13.366","0.005","90","","90","","90","","5961","3","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C28 H43 F6 N2 P Ru -","- C28 H43 F6 N2 P Ru -","- C224 H344 F48 N16 P8 Ru8 -","8","1","","Kondo, Hideo; Yamaguchi, Yoshitaka; Nagashima, Hideo","The first organoruthenium(iv) complexes containing nitrogen donor ligands by oxidative addition of allylic substrates to coordinatively unsaturated Ru(ii) complexes","Chemical Communications","2000","","12","1075","","10.1039/b002927k","","","0.7107","MoKα","","0.0917","0.0492","","","0.1418","0.162","","","","","","1.037","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110971","11.202","0.002","12.7326","0.0014","15.125","0.003","90","","107.05","0.02","90","","2062.5","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","zn","","","- C18 H26 N2 Se2 Zn -","- C18 H16 N2 Se2 Zn -","- C72 H64 N8 Se8 Zn4 -","4","1","","Jun, Young-wook; Koo, Ja-Eung; Cheon, Jinwoo","One-step synthesis of size tuned zinc selenide quantum dots via a temperature controlled molecular precursor approach","Chemical Communications","2000","","14","1243","","10.1039/b002983l","","","0.71073","MoKα","","0.0819","0.0623","","0.174","0.1634","","","","1.376","1.479","1.479","","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110972","10.338","0.0006","13.956","0.0007","20.852","0.0011","90","","90","","90","","3008.5","0.3","293","2","150","2","","","","","","","synthesis as described","5","P 21 21 21","P 2ac 2ab","19","","[Al(L-1)Me2]","","- C29 H54 Al N3 O -","- C29 H54 Al N3 O -","- C116 H216 Al4 N12 O4 -","4","1","","Robson, David A.; Rees, Leigh H.; Mountford, Philip; Schröder, Martin","An unprecedented coordination mode for hemilabile pendant-arm 1,4,7-triazacyclononanes and the synthesis of cationic organoaluminium complexes","Chemical Communications","2000","","14","1269","","10.1039/b003019h","","","0.71073","MoKα","","0.0746","0.0715","","0.1466","0.1446","","","","1.41","1.421","1.421","","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110973","12.269","0.0005","13.41","0.0006","12.429","0.0004","90","","95.998","0.002","90","","2033.71","0.14","150","2","150","2","","","","","","","synthesis as described","5","P 1 21 1","P 2yb","4","","[Al2(L-2)Me4]","","- C34 H76 Al2 N6 O2 -","- C34 H76 Al2 N6 O2 -","- C68 H152 Al4 N12 O4 -","2","1","","Robson, David A.; Rees, Leigh H.; Mountford, Philip; Schröder, Martin","An unprecedented coordination mode for hemilabile pendant-arm 1,4,7-triazacyclononanes and the synthesis of cationic organoaluminium complexes","Chemical Communications","2000","","14","1269","","10.1039/b003019h","","","0.71073","MoKα","","0.0726","0.0691","","0.174","0.1677","","","","1.298","1.311","1.311","","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110974","15.78","0.001","22.179","0.002","15.618","0.001","90","","118.743","0.002","90","","4792.6","0.6","93.2","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C56 H25.6 F20 N4 O1.3 Pd -","- C56 H24 F20 N4 O1.3 Pd -","- C224 H96 F80 N16 O5.2 Pd4 -","4","1","","Furuta, Hiroyuki; Maeda, Hiromitsu; Osuka, Atsuhiro; Yasutake, Mikio; Shinmyozu, Teruo; Ishikawa, Yuichi","Inner C-arylation of a doubly N-confused porphyrin‒Pd complex in toluene—the possibility of a Pd3+ intermediate","Chemical Communications","2000","","13","1143","","10.1039/b003022h","","","0.7107","MoK??","","","0.0778","","","","0.2475","","","","","","0.843","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110975","29.0219","0.0014","8.797","0.002","18.447","0.002","90","","125.944","0.012","90","","3812.9","1.1","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C16 H22 Fe N6 O S2 -","- C16 H22 Fe N6 O S2 -","- C128 H176 Fe8 N48 O8 S16 -","8","1","","Chen-jie, Fang; Chun-ying, Duan; Cheng, He; Qing-jin, Meng","A double-helix generated from a ferrocenyl-thiosemicarbazato metallo-synthon and its novel hydrogen-bonding cavities","Chemical Communications","2000","","13","1187","","10.1039/b003072o","","","0.71073","MoKα","","0.1003","0.0647","","","0.1512","0.1739","","","","","","1.023","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110976","30.076","0.006","9.6742","0.0018","21.693","0.005","90","","132.206","0.017","90","","4675","2","293","2","293","2","","","","","","","","8","C 1 2 1","C 2y","5","","","","- C34 H44 Cl4 Fe2 N12 O2 S4 Zn2 -","- C34 H40 Cl4 Fe2 N12 O2 S4 Zn2 -","- C136 H160 Cl16 Fe8 N48 O8 S16 Zn8 -","4","1","","Chen-jie, Fang; Chun-ying, Duan; Cheng, He; Qing-jin, Meng","A double-helix generated from a ferrocenyl-thiosemicarbazato metallo-synthon and its novel hydrogen-bonding cavities","Chemical Communications","2000","","13","1187","","10.1039/b003072o","","","0.71073","MoKα","","0.0803","0.0695","","","0.177","0.1882","","","","","","1.038","","","","has coordinates,has disorder","180223","2020-10-21","18:00:00",""
"7110977","10.018","0.002","13.861","0.003","15.162","0.003","102.06","0.03","101.24","0.03","92.67","0.03","2011","0.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C48 H114 Fe2 N30 Ni3 O12 -","- C48 H88 Fe2 N30 Ni3 O12 -","- C48 H88 Fe2 N30 Ni3 O12 -","1","0.5","","Kou, Hui-Zhong; Gao, Song; Ma, Bao-Qing; Liao, Dai-Zheng","A cyano-bridged molecular magnet with a novel two-dimensional brick wall structure","Chemical Communications","2000","","14","1309","","10.1039/b003089i","","","0.71073","MoKα","","0.2819","0.085","","","0.1742","0.2489","","","","","","0.916","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110978","11.583","0.0003","17.1392","0.0006","12.1278","0.0005","90","","98.964","0.002","90","","2378.25","0.14","200","0.1","200","0.1","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C17 H32 Cl N3 O5 S2 Zn -","- C17 H32 Cl N3 O5 S2 Zn -","- C68 H128 Cl4 N12 O20 S8 Zn4 -","4","1","","Berreau, Lisa M.; Allred, Russell A.; Makowska-Grzyska, Magdalena M.; Arif, Atta M.","Synthesis and structure of a nitrogen/sulfur-ligated zinc hydroxide complex","Chemical Communications","2000","","15","1423","","10.1039/b003144p","","","0.71073","MoKα","","0.0764","0.0507","","","0.118","0.1317","","","","","","1.011","","","","has coordinates,has disorder","180223","2020-10-21","18:00:00",""
"7110979","16.0431","0.0009","9.2753","0.0003","19.5165","0.0011","90","","111.117","","90","","2709.1","0.2","200","0.1","200","0.1","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C17 H31 Cl2 N3 O8 S2 Zn -","- C17 H31 Cl2 N3 O8 S2 Zn -","- C68 H124 Cl8 N12 O32 S8 Zn4 -","4","1","","Berreau, Lisa M.; Allred, Russell A.; Makowska-Grzyska, Magdalena M.; Arif, Atta M.","Synthesis and structure of a nitrogen/sulfur-ligated zinc hydroxide complex","Chemical Communications","2000","","15","1423","","10.1039/b003144p","","","0.71073","MoKα","","0.1002","0.0595","","","0.1403","0.1599","","","","","","1.03","","","","has coordinates,has disorder","180223","2020-10-21","18:00:00",""
"7110980","14.298","0.0003","13.6936","0.0003","15.253","0.0003","90","","98.635","0.001","90","","2952.55","0.11","173","2","173","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","[{LiN(SiMe3)(SiMe2Ph)}2]","","","- C22 H40 Li2 N2 Si4 -","- C22 H40 Li2 N2 Si4 -","- C88 H160 Li8 N8 Si16 -","4","1","","Antolini, Floria; Hitchcock, Peter B.; Lappert, Michael F.; Merle, Philippe","Unusual alkali metal α- or β-phenyl(trimethylsilyl)amides","Chemical Communications","2000","","14","1301","","10.1039/b003169k","","x-ray","0.71073","MoKα","","0.0555","0.0408","","","0.103","0.1129","","","","","","1.021","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110981","16.6414","0.0006","14.67","0.0005","11.6899","0.0004","90","","93.187","0.002","90","","2849.43","0.17","173","2","173","2","","","","","","","synthesis as described","5","C 1 2/c 1","-C 2yc","15","[{NaN(SiMe3)(SiMe2Ph)}2]","","","- C22 H40 N2 Na2 Si4 -","- C22 H40 N2 Na2 Si4 -","- C88 H160 N8 Na8 Si16 -","4","0.5","","Antolini, Floria; Hitchcock, Peter B.; Lappert, Michael F.; Merle, Philippe","Unusual alkali metal α- or β-phenyl(trimethylsilyl)amides","Chemical Communications","2000","","14","1301","","10.1039/b003169k","","x-ray","0.71073","MoKα","","0.0451","0.038","","","0.0981","0.1031","","","","","","1.005","","","","has coordinates","183806","2020-10-21","18:00:00",""
"7110982","10.103","0.004","10.873","0.005","20.223","0.007","99.82","0.03","91.76","0.03","113.16","0.03","2000.8","1.5","173","2","173","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C36 H56 Li4 N4 Si4 -","- C36 H56 Li4 N4 Si4 -","- C72 H112 Li8 N8 Si8 -","2","1","","Antolini, Floria; Hitchcock, Peter B.; Lappert, Michael F.; Merle, Philippe","Unusual alkali metal α- or β-phenyl(trimethylsilyl)amides","Chemical Communications","2000","","14","1301","","10.1039/b003169k","","","0.71073","MoKα","","0.1398","0.0729","","","0.1604","0.1944","","","","","","1.007","","","","has coordinates,has disorder","180223","2020-10-21","18:00:00",""
"7110983","10.939","0.0003","12.151","0.0004","12.6313","0.0003","90","","103.068","0.002","90","","1635.47","0.08","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H20 Cl4 Co2 O3 -","- C9 H20 Cl4 Co2 O3 -","- C36 H80 Cl16 Co8 O12 -","4","1","","Hierso, Jean-Cyrille; Bouwman, Elisabeth; Reedijk, Jan; Ellis, Dianne D.; Spek, Anthony L.","Unique chains of alternating octahedral and tetrahedral cobalt(ii) sites: crystal structures of the novel chloro-bridged complexes [Co4(μ-Cl)6Cl2(thf)4(MeOH)2]n and [{Co4(μ-Cl)6Cl2(thf)4(H2O)2}·2THF]n","Chemical Communications","2000","","15","1359","","10.1039/b003213l","","","0.71073","MoKα","","0.0488","0.033","","","0.0682","0.0736","","","","","","1.016","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110984","8.6714","0.0003","10.8418","0.0003","11.8514","0.0005","76.563","0.002","77.804","0.002","68.245","0.002","996.81","0.06","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H26 Cl4 Co2 O4 -","- C12 H26 Cl4 Co2 O4 -","- C24 H52 Cl8 Co4 O8 -","2","1","","Hierso, Jean-Cyrille; Bouwman, Elisabeth; Reedijk, Jan; Ellis, Dianne D.; Spek, Anthony L.","Unique chains of alternating octahedral and tetrahedral cobalt(ii) sites: crystal structures of the novel chloro-bridged complexes [Co4(μ-Cl)6Cl2(thf)4(MeOH)2]n and [{Co4(μ-Cl)6Cl2(thf)4(H2O)2}·2THF]n","Chemical Communications","2000","","15","1359","","10.1039/b003213l","","","0.71073","MoKα","","0.0445","0.0314","","","0.0651","0.0699","","","","","","1.055","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110985","10.402","0.005","21.565","0.005","19.623","0.005","90","","100.7","0.02","90","","4325","3","180","2","180","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C53 H48 Co O4 P W -","- C53 H48 Co O4 P W -","- C212 H192 Co4 O16 P4 W4 -","4","1","","Davies, John E.; Mays, Martin J.; Raithby, Paul R.; Sarveswaran, Koshala; Solan, Gregory A.","Formation of carbene and cyclopentadienyl ligands from phenylacetylene via oligomerisation and CC bond scission at a mixed-metal W‒Co centre","Chemical Communications","2000","","14","1313","","10.1039/b003296o","","","0.71073","MoKα","","0.0741","0.0491","","","0.0949","0.1028","","","","","","1.025","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110986","18.284","0.005","20.171","0.007","17.758","0.005","90","","90","","90","","6549","3","296.2","","296.2","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C34 H35 P Se3 W -","- C34 H35 P Se3 W -","- C272 H280 P8 Se24 W8 -","8","1","","Kawaguchi, Hiroyuki; Tatsumi, Kazuyuki","Synthesis and structures of half-sandwich W(vi) tri(selenido) and W(ii) selenolato complexes","Chemical Communications","2000","","14","1299","","10.1039/b003303k","","","0.7107","MoKα","","0.0568","0.0463","","","0.0556","0.058","","","","","","1.439","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110987","9.7349","0.0008","18.9776","0.0005","17.4477","0.0003","90","","97.1791","0.0007","90","","3198.1","0.3","273.2","","273.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C29 H51 N3 Se W -","- C29 H51 N3 Se W -","- C116 H204 N12 Se4 W4 -","4","1","","Kawaguchi, Hiroyuki; Tatsumi, Kazuyuki","Synthesis and structures of half-sandwich W(vi) tri(selenido) and W(ii) selenolato complexes","Chemical Communications","2000","","14","1299","","10.1039/b003303k","","","0.7107","MoKα","","0.0774","0.0505","","","0.0597","0.0635","","","","","","1.472","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110988","13.352","0.003","14.822","0.003","18.105","0.004","90","","90","","90","","3583","1.3","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C18 H28 Br N3 O -","- C18 H28 Br N3 O -","- C144 H224 Br8 N24 O8 -","8","1","","Pidwell, Andrew D.; Collinson, Simon R.; Bruce, Duncan W.; Coles, Simon J.; Hursthouse, Michael B.; Schröder, Martin","The synthesis and properties of surfactant aza macrocycles","Chemical Communications","2000","","11","955","","10.1039/b003368p","","","0.71073","MoKα","","0.0601","0.041","","","0.1123","0.1283","","","","","","0.908","","","","has coordinates","198632","2020-10-21","18:00:00",""
"7110989","13.1339","0.0009","16.203","0.001","26.309","0.002","73.953","0.002","87.9327","0.0007","81.7369","0.0006","5324.7","0.6","183.2","","183.2","","","","","","","","","8","P -1","-P 1","2","","","","- C78 H98 Cl4 F12 Ir4 N8 O14 S4 -","- C78 H92 Cl4 F12 Ir4 N8 O14 S4 -","- C156 H184 Cl8 F24 Ir8 N16 O28 S8 -","2","1","","Suzuki, Hajime; Yamamoto, Yasuhiro; Tajima, Nobuo; Tatsumi, Kazuyuki","Molecular architecture via coordination: quasi-octahedral macrocycles of rhodium and iridium bearing a pentamethylcyclopentadienyl group","Chemical Communications","2000","","18","1801","","10.1039/b003416i","","","0.7107","MoKα","","0.0858","0.0858","","","0.0891","0.089","","","","","","2.197","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110990","7.54","0.01","16.571","0.007","12.8","0.007","90","","95.69","0.07","90","","1591","2","300.2","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H38 Cl4 Ir2 N2 -","- C30 H38 Cl4 Ir2 N2 -","- C60 H76 Cl8 Ir4 N4 -","2","0.5","","Suzuki, Hajime; Yamamoto, Yasuhiro; Tajima, Nobuo; Tatsumi, Kazuyuki","Molecular architecture via coordination: quasi-octahedral macrocycles of rhodium and iridium bearing a pentamethylcyclopentadienyl group","Chemical Communications","2000","","18","1801","","10.1039/b003416i","","","0.7107","MoKα","","","0.0412","","","","0.1155","","","","","","1.219","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110991","13.245","0.007","20.417","0.006","14.419","0.004","90","","108.31","0.02","90","","3702","2","298.2","","","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C27 H38 Cl2 F6 N2 O7 Rh2 S2 -","- C27 H38 Cl2 F6 N2 O7 Rh2 S2 -","- C108 H152 Cl8 F24 N8 O28 Rh8 S8 -","4","1","","Suzuki, Hajime; Yamamoto, Yasuhiro; Tajima, Nobuo; Tatsumi, Kazuyuki","Molecular architecture via coordination: quasi-octahedral macrocycles of rhodium and iridium bearing a pentamethylcyclopentadienyl group","Chemical Communications","2000","","18","1801","","10.1039/b003416i","","","0.7107","MoKα","","","0.0502","","","","0.1698","","","","","","1.887","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110992","8.564","0.002","16.354","0.002","15.51","0.002","90","","93.81","0.02","90","","2167.5","0.6","296.2","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C18 H25 F2 K N2 O5 S -","- C18 H25 F2 K N2 O5 S -","- C72 H100 F8 K4 N8 O20 S4 -","4","1","","Habata, Yoichi; Saeki, Tomomi; Akabori, Sadatoshi; Zhang, Xian X.; Bradshaw, Jerald S.","Polymer-like complexes bridged by a fluorine substituent of the side arm in the 3′,5′-difluoro-4′-hydroxybenzyl-armed monoaza-15-crown-5 ether","Chemical Communications","2000","","16","1469","","10.1039/b003451g","","","0.7107","MoKα","","","0.0481","","","","0.1362","","","","","","1.31","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110993","8.875","0.003","18.627","0.004","13.359","0.003","90","","93.72","0.02","90","","2203.8","1","296.2","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C18 H25 F2 N2 O5 Rb S -","- C54 H75 F6 N6 O15 Rb3 S3 -","- C216 H300 F24 N24 O60 Rb12 S12 -","4","1","","Habata, Yoichi; Saeki, Tomomi; Akabori, Sadatoshi; Zhang, Xian X.; Bradshaw, Jerald S.","Polymer-like complexes bridged by a fluorine substituent of the side arm in the 3′,5′-difluoro-4′-hydroxybenzyl-armed monoaza-15-crown-5 ether","Chemical Communications","2000","","16","1469","","10.1039/b003451g","","","0.7107","MoKα","","","0.0596","","","","0.1746","","","","","","1.016","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110994","10.679","0.002","21.224","0.008","13.847","0.003","90","","95.46","0.02","90","","3124.2","1.5","223","2","223","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H50 Li2 N3 O1.5 P3 -","- C24 H46 Li2 N3 O1.5 P3 -","- C96 H184 Li8 N12 O6 P12 -","4","1","","Bashall, Alan; McPartlin, Mary; Elvidge, Benjamin R.; Beswick, Michael A.; Kidd, Sara J.; Wright, Dominic S.","Synthesis and structure of [(ButN)P(μ-NBut)2P(PCy)Li2·thf]2; an unusual cage compound containing an amido/phosphido functionalised [(ButN)P(μ-NBut)2P(PCy)]2− dianion (Cy = C6H11)","Chemical Communications","2000","","15","1439","","10.1039/b003468l","","","0.71073","MoKα","","0.1543","0.0769","","","0.1866","0.2419","","","","","","0.937","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7110995","9.372","0.008","11.198","0.007","17.679","0.007","90","","101.07","0.04","90","","1821","2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H20 N2 O3 -","- C22 H20 N2 O3 -","- C88 H80 N8 O12 -","4","1","","Heller, Harry G.; Hughes, David S.; Hursthouse, Michael B.; Rowles, Neil G.","Thermally stable fatigue resistant near infrared active photochromic compounds, exemplified by 6-amino-7-cyano-3-(dicyclopropylmethylene)-4-(2,5-dimethyl-3-furyl)-benzofuran-2(3H)-one","Chemical Communications","2000","","15","1397","","10.1039/b003496g","","","0.71069","MoKα","","0.137","0.038","","0.083","0.0676","","","","0.542","0.816","0.816","","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110996","10.342","0.002","12.08","0.002","21.651","0.004","92.435","0.004","98.115","0.003","106.672","0.004","2555.4","0.8","223","2","223","2","","","","","","","","4","P -1","-P 1","2","","","","- C43 H95 Fe2 N12 -","- C43 H95 Fe2 N12 -","- C86 H190 Fe4 N24 -","2","1","","Foley, Stephen R.; Yap, Glenn P. A.; Richeson, Darrin S.","Iron guanidinate complexes and formation of a novel dinuclear iron(ii) species with a dianionic μ-η2∶η2 (biguanidinate) ligand","Chemical Communications","2000","","16","1515","","10.1039/b003547p","","","0.71073","MoKα","","0.052","0.0381","","","0.0883","0.0897","","","","","","1.007","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7110997","19.572","0.006","12.747","0.004","18.649","0.006","90","","90","","90","","4653","3","238","2","238","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","","","- C37 H79 Fe2 N11 -","- C37 H79 Fe2 N11 -","- C148 H316 Fe8 N44 -","4","0.5","","Foley, Stephen R.; Yap, Glenn P. A.; Richeson, Darrin S.","Iron guanidinate complexes and formation of a novel dinuclear iron(ii) species with a dianionic μ-η2∶η2 (biguanidinate) ligand","Chemical Communications","2000","","16","1515","","10.1039/b003547p","","","0.71073","MoKα","","0.1038","0.0488","","","0.1076","0.1262","","","","","","1.044","","","","has coordinates,has disorder","180223","2020-10-21","18:00:00",""
"7110998","13.593","0.004","13.788","0.004","10.821","0.003","108.41","0.02","112.25","0.02","104.09","0.02","1621.7","1","296.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C24 H33 Cl7 N6 Zn2 -","- C24 H33 Cl7 N6 Zn2 -","- C48 H66 Cl14 N12 Zn4 -","2","1","","Sun, Wei-Yin; Xie, Jin; Huang, Chang-Kang; Okamura, Taka-aki; Ueyama, Norikazu","Novel tripodal chelating ligand for appending and encapsulating metal ions. Crystal structure of a parachute-like hydrogen bonded complex","Chemical Communications","2000","","15","1429","","10.1039/b003694n","","","0.7107","MoKα","","","0.0431","","","","0.1177","","","","","","1.576","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110999","10.3957","0.0003","10.4236","0.0003","12.737","0.0003","97.388","0.002","93.166","0.002","96.499","0.002","1356.52","0.06","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H12 Co4 O11 S3 -","- C21 H12 Co4 O11 S3 -","- C42 H24 Co8 O22 S6 -","2","1","","Davies, John E.; Hope-Weeks, Louisa J.; Mays, Martin J.; Raithby, Paul R.","The formation of sulfur macrocycles containing dialkyne units","Chemical Communications","2000","","15","1411","","10.1039/b003720f","","","0.71069","MoKα","","0.0364","0.0253","","0.1086","0.0736","","","","1.207","0.879","0.879","","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7111000","9.2401","0.0004","10.6059","0.0004","15.5957","0.0005","102.693","0.002","101.976","0.002","91.827","0.002","1453.75","0.1","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C44 H24 Co8 O24 S6 -","- C44 H24 Co8 O24 S6 -","- C44 H24 Co8 O24 S6 -","1","0.5","","Davies, John E.; Hope-Weeks, Louisa J.; Mays, Martin J.; Raithby, Paul R.","The formation of sulfur macrocycles containing dialkyne units","Chemical Communications","2000","","15","1411","","10.1039/b003720f","","","0.71069","MoKα","","0.059","0.0389","","0.1419","0.1098","","","","1.064","0.94","0.94","","","","","has coordinates,has disorder","180224","2020-10-21","18:00:00",""
"7111001","9.392","0.0002","16.392","0.0007","18.502","0.0007","90","","90.255","0.002","90","","2848.42","0.17","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H12 Co4 O13 S2 -","- C22 H12 Co4 O13 S2 -","- C88 H48 Co16 O52 S8 -","4","1","","Davies, John E.; Hope-Weeks, Louisa J.; Mays, Martin J.; Raithby, Paul R.","The formation of sulfur macrocycles containing dialkyne units","Chemical Communications","2000","","15","1411","","10.1039/b003720f","","","0.7107","MoKα","","0.0606","0.0349","","","0.0573","0.0637","","","","","","1.019","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111002","26.665","0.007","14.449","0.003","25.967","0.005","90","","90","","90","","10005","4","143","2","143","2","","","","","","","","8","P n a 21","P 2c -2n","33","1","","","- C112 H78 Cl6 N6 O8 P6 Pb Pd2 -","- C112 H78 Cl6 N6 O8 P6 Pb Pd2 -","- C448 H312 Cl24 N24 O32 P24 Pb4 Pd8 -","4","1","","Catalano, Vincent J.; Bennett, Byron L.; Noll, Bruce C.","Pt(0) and Pd(0) based metallocryptands: metallophilic hosts for Pb(ii) ion","Chemical Communications","2000","","15","1413","","10.1039/b003758n","","","0.71073","MoKα","","0.0523","0.0396","","","0.0762","0.0803","","","","","","0.926","","","","has coordinates,has disorder","180224","2020-10-21","18:00:00",""
"7111003","20.6415","0.0005","13.3094","0.0004","17.2658","0.0008","90","","95.591","0.002","90","","4720.8","0.3","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C54 H60 Cl2 N6 O3 -","- C50 H52 Cl2 N6 O2 -","- C200 H208 Cl8 N24 O8 -","4","1","","Sessler, Jonathan L.; Seidel, Daniel; Bucher, Christophe; Lynch, Vincent","[26]Hexaphyrin(1.1.1.1.0.0): an all-aza isomer of rubyrin with an inverted pyrrole subunit","Chemical Communications","2000","","16","1473","","10.1039/b003777j","","","0.71073","MoKα","","0.1493","0.0983","","0.1835","0.1683","","","","1.191","1.327","1.327","","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111004","7.802","0.002","7.351","0.001","11.923","0.002","90","","101.36","0.01","90","","670.4","0.2","143","2","143","2","","","","","","","","4","P 1 2/n 1","-P 2yac","13","","Octamethyl-dialuminadiazanorbornane","","- C9 H24 Al2 N2 -","- C9 H24 Al2 N2 -","- C18 H48 Al4 N4 -","2","0.5","","Lustig, Christian; Mitzel, Norbert W.","Novel aluminium‒ and gallium‒nitrogen heteronorbornanes","Chemical Communications","2000","","15","1393","","10.1039/b003813j","","","0.71073","MoKα","","0.0264","0.0232","","","0.0672","0.0691","","","","","","1.076","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111005","7.7786","0.0003","7.4037","0.0003","11.8506","0.0006","90","","101.475","0.003","90","","668.84","0.05","133","2","133","2","","","","","","","","4","P 1 2/n 1","-P 2yac","13","","Octamethyl-digalladiazanorbornane","","- C9 H24 Ga2 N2 -","- C9 H24 Ga2 N2 -","- C18 H48 Ga4 N4 -","2","0.5","","Lustig, Christian; Mitzel, Norbert W.","Novel aluminium‒ and gallium‒nitrogen heteronorbornanes","Chemical Communications","2000","","15","1393","","10.1039/b003813j","","","0.71073","MoKα","","0.0386","0.0338","","","0.0863","0.09","","","","","","1.071","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111006","19.633","0.004","15.226","0.003","17.809","0.004","90","","89.76","0.03","90","","5323.6","1.9","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C45 H46 N4 O11 Ru5 -","- C45 H46 N4 O11 Ru5 -","- C180 H184 N16 O44 Ru20 -","4","1","","Bröring, Martin; Pfister, Andreas; Ilg, Kerstin","Cluster stabilization by an open-chain tetrapyrrolic ligand: first evidence for NH activation as an initial step in tetrapyrrole metalation processes","Chemical Communications","2000","","15","1407","","10.1039/b003815f","","","0.71073","MoKα","","0.1177","0.0542","","","0.1323","0.1526","","","","","","0.815","","","","has coordinates,has disorder","180224","2020-10-21","18:00:00",""
"7111007","14.4835","0.001","10.0013","0.0007","9.9918","0.0007","90","","106.259","0.002","90","","1389.46","0.17","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13 H6 Ag6 F13 N3 O8 -","- C14.16 Ag6 F13 N2 O8 -","- C28.32 Ag12 F26 N4 O16 -","2","0.5","","Wang, Quan-Ming; Mak, Thomas C. W.","Novel layer-type triple salts of silver(i), AgCN·AgF·4AgCF3CO2·2L (L = MeCN or H2O)","Chemical Communications","2000","","15","1435","","10.1039/b003821k","","","0.71073","MoKα","","0.0479","0.0343","","","0.0809","0.0861","","","","","","0.968","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111008","23.4455","0.0017","9.9378","0.0007","9.8962","0.0007","90","","90.002","0.002","90","","2305.8","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C9 H4 Ag6 F13 N O10 -","- C9 Ag6 F13 N O10 -","- C36 Ag24 F52 N4 O40 -","4","1","","Wang, Quan-Ming; Mak, Thomas C. W.","Novel layer-type triple salts of silver(i), AgCN·AgF·4AgCF3CO2·2L (L = MeCN or H2O)","Chemical Communications","2000","","15","1435","","10.1039/b003821k","","","0.71073","MoKα","","0.0741","0.0385","","","0.0867","0.0996","","","","","","0.953","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111009","12.8306","0.0011","18.4336","0.0013","18.7237","0.0015","90","","96.161","0.004","90","","4402.8","0.6","173","2","173","2","","","","","","","synthesis as described","6","P 1 21/n 1","-P 2yn","14","[Li(thf)2{Si(SiMe3)3(C6H4(NCH2tBu)2)}]","","","- C33 H69 Li N2 O2 Si5 -","- C33 H69 Li N2 O2 Si5 -","- C132 H276 Li4 N8 O8 Si20 -","4","1","","Gehrhus, Barbara; Hitchcock, Peter B.; Lappert, Michael F.; Slootweg, J. Chris","The diverse reactions of the silylene Si[(NCH2But)2C6H4-1,2] with Li[Si(SiMe3)3](thf)3 and K[N(SiMe3)2]","Chemical Communications","2000","","15","1427","","10.1039/b003833o","","x-ray","0.71073","MoKα","","0.0734","0.0522","","","0.1257","0.1377","","","","","","1.007","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111010","13.4645","0.0004","12.7533","0.0003","16.5858","0.0003","90","","91.759","0.002","90","","2846.72","0.12","173","2","173","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","[K{Me3SiNSi(SiMe3)(C6H4(NCH2tBu)2)}]","","","- C22 H44 K N3 Si3 -","- C22 H44 K N3 Si3 -","- C88 H176 K4 N12 Si12 -","4","1","","Gehrhus, Barbara; Hitchcock, Peter B.; Lappert, Michael F.; Slootweg, J. Chris","The diverse reactions of the silylene Si[(NCH2But)2C6H4-1,2] with Li[Si(SiMe3)3](thf)3 and K[N(SiMe3)2]","Chemical Communications","2000","","15","1427","","10.1039/b003833o","","x-ray","0.71073","MoKα","","0.0539","0.0391","","","0.0904","0.0972","","","","","","1.033","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111011","6.4542","0.0003","12.2543","0.0004","12.418","0.0006","90","","93.604","0.003","90","","980.22","0.07","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H12 B2 Fe2 O8 -","- C20 H12 B2 Fe2 O8 -","- C40 H24 B4 Fe4 O16 -","2","0.5","","Aldridge, S.; Calder, R. J.; Dickinson, A. A.; Willock, D. J.; Steed, J. W.","Linking of metal centres through boryl ligands: synthesis, spectroscopic and structural characterisation of a symmetrically bridged boryl complex CpFe(CO)2BO2C6H2O2BFe(CO)2Cp","Chemical Communications","2000","","15","1377","","10.1039/b003901m","","","0.71073","MoKα","","0.0315","0.0257","","","0.0582","0.0605","","","","","","1.029","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111012","11.2022","0.0008","14.7746","0.001","15.119","0.0011","90","","90.155","0.001","90","","2502.3","0.3","93","","93","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H40 Cl2 Fe N4 -","- C22 H40 Cl2 Fe N4 -","- C88 H160 Cl8 Fe4 N16 -","4","1","","Louie, Janis; Grubbs, Robert H.","Highly active iron imidazolylidene catalysts for atom transfer radical polymerization","Chemical Communications","2000","","16","1479","","10.1039/b003957h","","","0.71073","MoKα","","0.0397","0.0294","","","0.0592","0.0607","","","","","","1.547","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7111013","7.425","0.002","10.493","0.003","12.277","0.003","108.12","0.03","91.82","0.03","94.31","0.03","905","0.5","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C18 H15 B Cu F4 N3 O2 -","- C18 H15 B Cu F4 N3 O2 -","- C36 H30 B2 Cu2 F8 N6 O4 -","2","1","","Zhang, Jing; Xiong, Ren-Gen; Zuo, Jing-Lin; You, Xiao-Zeng","A highly stable copper(i)-olefin coordination polymer with strong red fluorescent emission","Chemical Communications","2000","","16","1495","","10.1039/b004001k","","","0.71073","MoKα","","0.0755","0.0441","","","0.1179","0.1353","","","","","","0.976","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111014","15.5941","0.0007","15.5941","0.0007","12.4867","0.0008","90","","90","","90","","3036.5","0.3","193","2","193","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- C22 H44 N4 O5 Te2 -","- C22 H44 N4 O5 Te2 -","- C88 H176 N16 O20 Te8 -","4","0.5","","Schatte, Gabriele; Chivers, Tristram; Jaska, Cory; Sandblom, Nicole","Cycloaddition reaction of tert-butyl isocyanate and a tellurium diimide dimer: extended helical structure of the ureato telluroxide {[OC(μ-NBut)2TeO]2(thf)}\ιnfty","Chemical Communications","2000","","17","1657","","10.1039/b004137h","","","0.71073","MoKα","","0.0188","0.0164","","","0.0405","0.0413","","","","","","1.024","","","","has coordinates,has disorder","180224","2020-10-21","18:00:00",""
"7111015","10.737","0.001","10.837","0.001","13.762","0.001","67.04","0.01","85.71","0.01","73.11","0.01","1409.5","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H28 Fe0 N4 Ni2 O5 -","- C32 H28 N4 Ni2 O5 -","- C64 H56 N8 Ni4 O10 -","2","1","","Bag, Bappaditya; Mondal, Nijhuma; Mitra, Samiran; Rosair, Georgina","The first thermally-stable singly oxo-bridged dinuclear Ni(iii) complex","Chemical Communications","2000","","18","1729","","10.1039/b004165n","","","0.71073","MoKα","","0.0509","0.0443","","","0.1296","0.1358","","","","","","1.041","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111016","12.143","0.007","21.64","0.01","11.97","0.03","90","","90","","90","","3145","8","296.2","","296.2","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C18 H54 Cl6 N8 O2.75 -","- C18 H54 Cl6 N8 O2.75 -","- C72 H216 Cl24 N32 O11 -","4","1","","Hossain, Md. Alamgir; Llinares, José M.; Miller, Cynthia A.; Seib, Larry; Bowman-James, Kristin","Further insight to selectivity issues in halide binding in a tiny octaazacryptand","Chemical Communications","2000","","22","2269","","10.1039/b004167j","","","1.5418","CuKα","","0.1555","0.064","","0.069","","0.059","","","1.396","","","1.57","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7111017","28.4009","0.0007","11.293","0.0003","16.937","0.0005","90","","126.604","0.001","90","","4360.9","0.2","200","2","200","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C28 H72 Cu2 N4 O2 P2 Si4 -","- C28 H72 Cu2 N4 O2 P2 Si4 -","- C112 H288 Cu8 N16 O8 P8 Si16 -","4","0.5","","Straub, Bernd F.; Rominger, Frank; Hofmann, Peter","A neutral dicopper(iii) bis(μ-oxo) complex from a copper(i) ethylene iminophosphanamide and O2","Chemical Communications","2000","","17","1611","","10.1039/b004173o","","","0.71073","MoKα","","0.1108","0.0583","","","0.1403","0.1638","","","","","","1.024","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111018","16.026","0.005","11.41","0.002","22.56","0.005","90","","90","","90","","4125.2","1.7","173","2","173","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C21 H22 Li2 N3 O3 P -","- C21 H22 Li2 N3 O3 P -","- C168 H176 Li16 N24 O24 P8 -","8","1","","Burke, Lisa T.; Hevia-Freire, Eva; Holland, Rebecca; Jeffery, John C.; Leedham, Angela P.; Russell, Christopher A.; Zagorski, Anette; Steiner, Alexander","Synthesis and structure of a tris imido phosphonate anion; the missing link in imido analogues of phosphorus oxoanions","Chemical Communications","2000","","18","1769","","10.1039/b004192k","","","0.71073","MoKα","","0.0671","0.0402","","0.1042","0.092","","","","1.015","1.065","1.065","","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111019","7.1177","0.0018","8.6729","0.0016","9.22","0.003","65.108","0.016","70.521","0.013","68.504","0.016","469.4","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- Al1.5 H7.5 O13.5 P3 -","- Al1.5 H3 O13.5 P3 -","- Al3 H6 O27 P6 -","2","1","","Yan, Wenfu; Yu, Jihong; Shi, Zhan; Xu, Ruren","A novel open-framework aluminophosphate [AlP2O6(OH)2][H3O] containing propeller-like chiral motifs","Chemical Communications","2000","","15","1431","","10.1039/b004200p","","","0.71073","MoKα","","0.0445","0.0377","","","0.105","0.1098","","","","","","1.057","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7111020","11.6682","0.0002","16.8825","0.0004","20.998","0.0004","90","","90","","90","","4136.36","0.14","150","2","150","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C30 H70 Li2 Mg2 N4 Si4 -","- C30 H70 Li2 Mg2 N4 Si4 -","- C120 H280 Li8 Mg8 N16 Si16 -","4","1","","Barr, Lorna; Kennedy, Alan R.; MacLellan, Jonathan G.; Moir, Jennifer H.; Mulvey, Robert E.; Rodger, Philip J. A.","Synthesis of the mixed lithium‒magnesium, mixed amide (R,R/S,S)-[{LiMg(TMP)[CH2Si(Me)2N(SiMe3)]}2]: a conformationally-locked structure of five fused rings inducing two stereogenic nitrogen centres","Chemical Communications","2000","","18","1757","","10.1039/b004317f","","","0.71073","MoKα","","0.0979","0.0504","","","0.102","0.1181","","","","","","0.982","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111021","13.9497","0.0014","23.133","0.002","22.485","0.002","90","","99.792","0.002","90","","7150.2","1.1","293","2","173","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C30 H27 Cu F12 N6 O2 P2 S3 -","- C30 H15 Cu F12 N6 O2 P2 S3 -","- C240 H120 Cu8 F96 N48 O16 P16 S24 -","8","1","","Rice, Craig R.; Wörl, Stefan; Jeffery, John C.; Paul, Rowena L.; Ward, Michael D.","Pyridyl-thiazoles as a new class of ligand for metallosupramolecular chemistry: formation of double and triple helicates with Cu(ii)","Chemical Communications","2000","","16","1529","","10.1039/b004319m","","","0.71073","MoKα","","0.1655","0.0886","","","0.2332","0.2807","","","","","","1.003","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111022","13.4641","0.0013","15.0528","0.0015","21.859","0.002","80.685","0.002","81.242","0.002","77.288","0.002","4233.2","0.7","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C76 H58 Cl4 Cu2 N20 O17 S4 -","- C76 H32 Cl4 Cu2 N20 O17 S4 -","- C152 H64 Cl8 Cu4 N40 O34 S8 -","2","1","","Rice, Craig R.; Wörl, Stefan; Jeffery, John C.; Paul, Rowena L.; Ward, Michael D.","Pyridyl-thiazoles as a new class of ligand for metallosupramolecular chemistry: formation of double and triple helicates with Cu(ii)","Chemical Communications","2000","","16","1529","","10.1039/b004319m","","","0.71073","MoKα","","0.1853","0.0984","","","0.2353","0.2884","","","","","","1.026","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111023","9.752","0.002","19.758","0.003","22.963","0.003","90","","90","","90","","4424.5","1.3","293","2","293","2","","","","","","","","8","P b c a","-P 2ac 2ab","61","","","","- C15 H24 B F4 I N4 S Zn -","- C13.3333 H21.3333 B0.888889 F3.55556 I0.888889 N3.55556 S0.888889 Zn0.888889 -","- C120 H192 B8 F32 I8 N32 S8 Zn8 -","9","1.125","","Hammes, Brian S.; Carrano, Carl J.","Methylation of (2-methylethanethiol-bis-3,5-dimethylpyrazolyl)methane zinc complexes and coordination of the resulting thioether: relevance to zinc-containing alkyl transfer enzymes","Chemical Communications","2000","","17","1635","","10.1039/b004338i","","","0.71073","MoKα","","0.1159","0.064","","0.22","0.1607","","","","0.98","0.992","0.992","","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111024","17.674","0.005","17.674","0.005","15.531","0.003","90","","90","","120","","4201.5","1.9","293","2","293","2","","","","","","","","8","P 32 2 1","P 32 2""","154","","","","- C17 H24 B0.5 F2 N4 O3.5 S Zn -","- C17.03 H24 B0.5 F2 N4 O3.5 S Zn -","- C102.18 H144 B3 F12 N24 O21 S6 Zn6 -","6","1","","Hammes, Brian S.; Carrano, Carl J.","Methylation of (2-methylethanethiol-bis-3,5-dimethylpyrazolyl)methane zinc complexes and coordination of the resulting thioether: relevance to zinc-containing alkyl transfer enzymes","Chemical Communications","2000","","17","1635","","10.1039/b004338i","","","0.71073","MoKα","","0.0971","0.0728","","0.2508","0.2119","","","","0.99","0.965","0.965","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7111025","6.359","0.003","21.465","0.005","9.991","0.002","90","","92.68","0.02","90","","1362.2","0.8","296.2","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C27 H34 N2 O6 S -","- C27 H34 N2 O6 S -","- C54 H68 N4 O12 S2 -","2","1","","Hitotsuyanagi, Yukio; Hasuda, Tomoyo; Matsumoto, Yuji; Itokawa, Hideji; Takeya, Koichi; Yamaguchi, Kentaro","Degradation of an antitumour bicyclic hexapeptide RA-VII into cycloisodityrosines","Chemical Communications","2000","","17","1633","","10.1039/b004459h","","","1.5418","CuK?a","","","0.0357","","","","0.0308","","","","","","1.444","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7111026","8.962","0.003","19.793","0.004","22.363","0.007","99.606","0.017","92.371","0.018","98.307","0.018","3861","2","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","1-tetradecylimidazolium nitrate","","- C17 H33 N3 O3 -","- C17 H33 N3 O3 -","- C136 H264 N24 O24 -","8","4","","Lee, Ching K.; Huang, Hsin W.; Lin, Ivan J. B.","Simple amphiphilic liquid crystalline N-alkylimidazolium salts. A new solvent system providing a partially ordered environment","Chemical Communications","2000","","19","1911","","10.1039/b004462h","","","0.71073","MoKα","","0.0897","0.0505","","","0.1176","0.139","","","","","","1.007","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111027","8.314","0.006","9.565","0.005","12.293","0.004","77.57","0.07","87.72","0.04","79.55","0.14","938.8","1","293","","293","","","","","","","","","6","P -1","-P 1","2","","","","- C17 H17 F6 N O2 Pd -","- C17 H17 F6 N O2 Pd -","- C34 H34 F12 N2 O4 Pd2 -","2","1","","Nowotny, Mathias; Hanefeld, Ulf; Koningsveld, Henk van; Maschmeyer, Thomas","Cyclopalladated imine catalysts in Heck arylation: search for the catalytic species","Chemical Communications","2000","","19","1877","","10.1039/b004502k","","","0.71073","MoKα","","0.059","0.037","","0.037","","0.037","","","2.651","","","2.947","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7111028","15.6676","0.0013","14.1868","0.0008","15.099","0.0005","90","","113.44","0.004","90","","3079.1","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H52 Br2 O2 P2 Pd2 -","- C24 H52 Br2 O2 P2 Pd2 -","- C96 H208 Br8 O8 P8 Pd8 -","4","1","","Durà-Vilà, Víctor; Mingos, D. Michael P.; Vilar, Ramón; White, Andrew J. P.; Williams, David J.","Insertion of O2 into a Pd(i)‒Pd(i) dimer and subsequent C‒O bond formation by activation of a C‒H bond","Chemical Communications","2000","","16","1525","","10.1039/b004537n","","","1.54178","CuKα","","0.053","0.0432","","0.11","0.1028","","","","1.039","1.067","1.067","","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111029","7.788","0.003","15.368","0.005","13.557","0.003","90","","105.4","0.02","90","","1564.3","0.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H52 Br2 P2 Pd2 -","- C24 H52 Br2 P2 Pd2 -","- C48 H104 Br4 P4 Pd4 -","2","0.5","","Durà-Vilà, Víctor; Mingos, D. Michael P.; Vilar, Ramón; White, Andrew J. P.; Williams, David J.","Insertion of O2 into a Pd(i)‒Pd(i) dimer and subsequent C‒O bond formation by activation of a C‒H bond","Chemical Communications","2000","","16","1525","","10.1039/b004537n","","","0.71073","MoKα","","0.0935","0.048","","0.106","0.0889","","","","0.998","1.072","1.072","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7111030","20.067","0.002","14.271","0.003","8.775","0.005","90","","90","","90","","2513","1.5","173","2","173","2","","","","","","","","5","P n a 21","P 2c -2n","33","[(C5Me5)Ir(P2C2tBu2NtBu)]","","","- C24 H42 Ir N P2 -","- C24 H42 Ir N P2 -","- C96 H168 Ir4 N4 P8 -","4","1","","Cloke, F. Geoffrey N.; Hitchcock, Peter B.; Nixon, John F.; Wilson, D. James; Schiemann, Udo; Streubel, Rainer","Syntheses of complexes containing the novel 1,2,3-azadiphosphole and 1,2,5-azadiphosphole ring systems: crystal and molecular structure of [Ir(η5-C5Me5)(η4-(ButCPNButPCBut)]","Chemical Communications","2000","","17","1659","","10.1039/b004692m","","","0.71073","MoKα","","0.0253","0.0215","","","0.0494","0.0508","","","","","","1.041","","","","has coordinates,has disorder","180224","2020-10-21","18:00:00",""
"7111031","26.275","0.011","6.131","0.007","12.513","0.01","90","","102.85","0.06","90","","1965","3","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7 Br F4 N2 Se2 -","- C7 Br F4 N2 Se2 -","- C56 Br8 F32 N16 Se16 -","8","2","","Feeder, Neil; Less, Robert J.; Rawson, Jeremy M.; Oliete, Patricia; Palacio, Fernando","An unprecedented mode of association in diselenadiazolyl radicals: crystal structures and magnetic properties of [p-XC6F4CNSeSeN]2 (X=Cl, Br)","Chemical Communications","2000","","24","2449","","10.1039/b004705h","","","0.71069","MoKα","","0.1496","0.0971","","0.2821","0.2475","","","","1.165","1.322","1.322","","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111032","6.163","0.001","17.243","0.004","18.471","0.001","90","","92","0.01","90","","1961.7","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H16 N8 O2 -","- C22 H16 N8 O2 -","- C88 H64 N32 O8 -","4","1","","Kövér, Péter; Hajós, György; Riedl, Zsuzsanna; Párkányi, László; Kollenz, Gert","An unexpected valence bond isomerization to the heteroaromatic ring system: [1,2,3]triazolo[4,5-d]pyridazine","Chemical Communications","2000","","18","1785","","10.1039/b004775i","","","0.71073","MOkα","","0.1173","0.0404","","","0.0909","0.1036","","","","","","0.842","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111033","18.3979","0.0009","10.7098","0.0006","17.2722","0.0006","90","","90","","90","","3403.3","0.3","293","2","293","2","","","","","","","-","6","P n a 21","P 2c -2n","33","","","","- C24.5 H49 Cl3 N6 P2 Pt -","- C24.5 H49 Cl3 N6 P2 Pt -","- C98 H196 Cl12 N24 P8 Pt4 -","4","1","","Clarke, Matthew L.; Cole-Hamilton, David J.; Slawin, Alexandra M. Z.; Woollins, J. Derek","P‒N bond formation as a route to highly electron rich phosphine ligands","Chemical Communications","2000","","20","2065","","10.1039/b004893n","","","0.71073","MoKα","","0.0638","0.0428","","0.1247","0.0929","","","","0.748","0.853","0.853","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7111034","8.5068","0.0003","26.2926","0.001","21.6988","0.0008","90","","90.272","0.001","90","","4853.2","0.3","566","2","566","2","","","","","","","-","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H38 Cl2 N4 P2 Pt -","- C18 H38 Cl2 N4 P2 Pt -","- C144 H304 Cl16 N32 P16 Pt8 -","8","2","","Clarke, Matthew L.; Cole-Hamilton, David J.; Slawin, Alexandra M. Z.; Woollins, J. Derek","P‒N bond formation as a route to highly electron rich phosphine ligands","Chemical Communications","2000","","20","2065","","10.1039/b004893n","","","0.71073","MoKα","","0.0635","0.0366","","0.1027","0.0774","","","","0.885","0.929","0.929","","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111035","8.3968","0.0009","8.7615","0.0008","12.3337","0.0009","76.161","0.006","74.331","0.008","70.17","0.01","810.87","0.14","293","2","293","2","","","","","","","","4","P -1","-P 1","2","Kemp's triacid: 8-aminoquinoline (2:1)","bis(cis-cis-1,3,5-trimethylcyclohexane-1,3,5-tricarboxylic acid) (8-aminoquinoline)","","- C33 H44 N2 O12 -","- C16.5 H21.5 N O6 -","- C33 H43 N2 O12 -","2","1","","Smith, Graham; Wermuth, Urs D.; White, Jonathan M.","Molecular recognition involving Kemp’s triacid: selectivity towards the 8-substituted quinoline system as seen in the cocrystalline adducts with 8-aminoquinoline and 8-hydroxyquinoline","Chemical Communications","2000","","23","2349","","10.1039/b004945j","","","0.71069","MoKα","","0.0557","0.0412","","","0.1056","0.1162","","","","","","1.007","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111036","8.662","0.001","10.413","0.002","14.153","0.002","99.06","0.018","103.64","0.013","102.91","0.013","1179.1","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","Kemp's triacid: 8-hydroxyquinoline (1:1)","(cis-cis-1,3,5-trimethylcyclohexane-1,3,5-tricarboxylic acid)(quinolin-8-ol)","","- C21 H25 N O7 -","- C21 H25 N O8 -","- C42 H50 N2 O16 -","2","1","","Smith, Graham; Wermuth, Urs D.; White, Jonathan M.","Molecular recognition involving Kemp’s triacid: selectivity towards the 8-substituted quinoline system as seen in the cocrystalline adducts with 8-aminoquinoline and 8-hydroxyquinoline","Chemical Communications","2000","","23","2349","","10.1039/b004945j","","","1.5418","CuKα","","0.065","0.0605","","","0.1637","0.1676","","","","","","1.51","","","","has coordinates","206958","2020-10-21","18:00:00",""
"7111037","17.6814","0.0006","19.862","0.0007","23.4663","0.0008","90.021","0.001","102.647","0.001","100.41","","7901.9","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C8 H280 Mo54 Na32 O308 -","- C8 Mo54 Na6 O258 -","- C8 Mo54 Na6 O258 -","1","0.5","","Yang, Wenbin; Lu, Canzhong; Lin, Xiang; Zhuang, Honghui","A novel acetated 54-member crown-shaped polyoxomolybdate with unprecedented structural features: Na26[{Na(H2O)2}6({μ3-OH)4MoV20MoVI34O164(μ2-CH3COO)4}]·≈120H2O","Chemical Communications","2000","","17","1623","","10.1039/b004948o","","","0.71073","MoKα","","0.1281","0.0718","","","0.1969","0.2434","","","","","","1.242","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111038","21.455","0.0002","8.8584","0.0002","13.2661","0.0002","90","","93.815","0.001","90","","2515.73","0.07","293","2","293","2","","","","","","","synthesis","5","C 1 2 1","C 2y","5","","","","- C28 H20 N2 O4 Zn -","- C28 H20 N2 O4 Zn -","- C112 H80 N8 O16 Zn4 -","4","1","","Xiong, Ren-Gen; Zuo, Jing-Lin; You, Xiao-Zeng; Bai, Zhi-Ping; Abrahams, Brendan F.; Che, Chi-Ming; Fun, Hoong-Kun","Opto-electronic multifunctional chiral diamondoid-network coordination polymer: bis{4-[2-(4-pyridyl)ethenyl]benzoato}zinc with high thermal stability","Chemical Communications","2000","","20","2061","","10.1039/b004980h","","","0.71073","MoKα","","0.0638","0.0565","","0.1684","0.1638","","","","1.1","1.146","1.146","","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111039","17.316","0.002","15.6017","0.0017","20.774","0.002","90","","105.098","0.009","90","","5418.6","1","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C40 H79 Mo6 N3 O18 -","- C40 H79 Mo6 N3 O18 -","- C160 H316 Mo24 N12 O72 -","4","1","","Moore, Aaron R.; Kwen, Haidoo; Beatty, Alicia M.; Maatta, Eric A.","Organoimido-polyoxometalates as polymer pendants","Chemical Communications","2000","","18","1793","","10.1039/b005022i","","","0.71073","MoKα","","0.0602","0.045","","","0.1268","0.1806","","","","","","1.071","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111040","12.107","0.005","12.348","0.005","20.271","0.004","74.3","0.02","85.2","0.02","79.1","0.02","2863.1","1.8","301.2","","301.2","","","","","","","","","9","P -1","-P 1","2","","","","- C50 H38 F12 N6 O6 P2 Re2 S2 Zn -","- C50 H38 F12 N6 O6 P2 Re2 S2 Zn -","- C100 H76 F24 N12 O12 P4 Re4 S4 Zn2 -","2","1","","Yam, Vivian Wing-Wah; Pui, Yung-Lin; Wong, Keith Man-Chung; Cheung, Kung-Kai","Syntheses and structural characterization of novel luminescent heteronuclear rhenium(i)‒zinc(ii) and ‒cadmium(ii) chalcogenolate complexes","Chemical Communications","2000","","18","1751","","10.1039/b005092j","","","0.7107","MoKalpha","","","0.035","","","0.0425","","","","","1.342","1.342","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7111041","13.691","0.002","15.663","0.003","15.551","0.003","90","","106.34","0.02","90","","3200.1","1","301.2","","301.2","","","","","","","","","9","P 1 2/n 1","-P 2yac","13","","","","- C60 H46 Cd F12 N8 O6 P2 Re2 S2 -","- C60 H46 Cd F16 N8 O6 P2 Re2 S2 -","- C120 H92 Cd2 F32 N16 O12 P4 Re4 S4 -","2","0.5","","Yam, Vivian Wing-Wah; Pui, Yung-Lin; Wong, Keith Man-Chung; Cheung, Kung-Kai","Syntheses and structural characterization of novel luminescent heteronuclear rhenium(i)‒zinc(ii) and ‒cadmium(ii) chalcogenolate complexes","Chemical Communications","2000","","18","1751","","10.1039/b005092j","","","0.7107","MoKalpha","","","0.038","","","0.0563","","","","","1.27","1.27","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7111042","10.2695","0.0004","11.0128","0.0004","13.7391","0.0004","111.151","0.002","93.476","0.002","110.126","0.002","1330.03","0.09","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","Pentacarbonyl-(1-triphenylphosphonio-benzo-[c]-phospholide)chromium(0)","","- C31 H20 Cr O5 P2 -","- C31 H20 Cr O5 P2 -","- C62 H40 Cr2 O10 P4 -","2","1","","Gudat, Dietrich; Häp, Stefan; Szarvas, Laszlo; Nieger, Martin","Ambident σ- and π-donor ability of a neutral 10π-aromatic phosphoniobenzophospholide","Chemical Communications","2000","","17","1637","","10.1039/b005130f","","","0.71073","MoKα","","0.0515","0.0347","","","0.0799","0.0839","","","","","","1.067","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111043","8.5429","0.0004","13.2026","0.0009","21.3056","0.0014","90","","97.658","0.004","90","","2381.6","0.3","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tricarbonyl-(1-triphenylphosphonio-benzo-[c]-phospholide)chromium(0)","","- C29 H20 Cr O3 P2 -","- C29 H20 Cr O3 P2 -","- C116 H80 Cr4 O12 P8 -","4","1","","Gudat, Dietrich; Häp, Stefan; Szarvas, Laszlo; Nieger, Martin","Ambident σ- and π-donor ability of a neutral 10π-aromatic phosphoniobenzophospholide","Chemical Communications","2000","","17","1637","","10.1039/b005130f","","","0.71073","MoKα","","0.0542","0.0361","","","0.0774","0.0824","","","","","","1.031","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111044","15.197","0.003","7.201","0.001","6.672","0.001","90","","90","","90","","730.1","0.2","293","2","293","2","","","","","","","","4","C m c m","-C 2c 2","63","","","","- C4 H4 Fe N8 -","- C4 H4 Fe N8 -","- C16 H16 Fe4 N32 -","4","0.25","","Hao, Xiang; Wei, Yongge; Zhang, Shiwei","Crystal structure and metamagnetic property of a 2-D layered complex, [FeII(N3)2(pyz)]n (pyz = pyrazine)","Chemical Communications","2000","","22","2271","","10.1039/b005137n","","","0.71073","MoKα","","0.0707","0.0647","","","0.1648","0.1741","","","","","","1.101","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111045","15.447","0.003","10.989","0.002","19.907","0.004","90","","90","","90","","3379.2","1.1","180","2","180","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C32 H40 O10 P2 -","- C32 H40 O10 P2 -","- C128 H160 O40 P8 -","4","0.5","","Pettinari, Claudio; Marchetti, Fabio; Cingolani, Augusto; Drozdov, Andrei; Troyanov, Sergei","Unexpected synthesis of (bis(diphenylphosphinoyl)ethane)·2(2,2-dihydroperoxypropane) 1∶2 adduct: a new route to stable organic dihydroperoxides","Chemical Communications","2000","","19","1901","","10.1039/b005221n","","","0.71073","MoKα","","0.0663","0.0362","","0.094","0.0821","","","","0.934","1.044","1.044","","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111046","17.04","0.01","6.84","0.008","21.558","0.01","90","","108.47","0.04","90","","2383","3","123","2","123","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C13 H39 Li N2 Si4 Zn -","- C13 H39 Li N2 Si4 Zn -","- C52 H156 Li4 N8 Si16 Zn4 -","4","0.5","","Forbes, Glenn C.; Kennedy, Alan R.; Mulvey, Robert E.; Rowlings, René B.; Clegg, William; Liddle, Stephen T.; Wilson, Chick C.","‘Inverse crown ether’ complexes extended to group 12 through the syntheses of [Na2Zn2(HMDS)4(O)] and [{K2Zn2(HMDS)4(O2)x(O)y}∞]","Chemical Communications","2000","","18","1759","","10.1039/b005233g","","","0.71069","MoKα","","0.0747","0.0593","","","0.1345","0.1441","","","","","","1.113","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111047","10.711","0.006","12.81","0.006","8.97","0.004","108.96","0.03","99.77","0.04","96.13","0.04","1129.7","1","183","2","183","2","","","","","","","","7","P -1","-P 1","2","","","","- C24 H72 N4 Na2 O Si8 Zn2 -","- C24 H72 N4 Na2 O Si8 Zn2 -","- C24 H72 N4 Na2 O Si8 Zn2 -","1","0.5","","Forbes, Glenn C.; Kennedy, Alan R.; Mulvey, Robert E.; Rowlings, René B.; Clegg, William; Liddle, Stephen T.; Wilson, Chick C.","‘Inverse crown ether’ complexes extended to group 12 through the syntheses of [Na2Zn2(HMDS)4(O)] and [{K2Zn2(HMDS)4(O2)x(O)y}∞]","Chemical Communications","2000","","18","1759","","10.1039/b005233g","","","0.71069","MoKα","","0.0546","0.0399","","","0.1231","0.1305","","","","","","1.072","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111048","8.9898","0.0004","10.9763","0.0005","12.9529","0.0006","97.322","0.002","108.154","0.002","101.162","0.002","1167.11","0.09","160","2","160","2","","","","","","","","7","P -1","-P 1","2","","","","- C24 H72 K2 N4 O1.82 Si8 Zn2 -","- C24 H72 K2 N4 O1.833 Si8 Zn2 -","- C24 H72 K2 N4 O1.833 Si8 Zn2 -","1","0.5","","Forbes, Glenn C.; Kennedy, Alan R.; Mulvey, Robert E.; Rowlings, René B.; Clegg, William; Liddle, Stephen T.; Wilson, Chick C.","‘Inverse crown ether’ complexes extended to group 12 through the syntheses of [Na2Zn2(HMDS)4(O)] and [{K2Zn2(HMDS)4(O2)x(O)y}∞]","Chemical Communications","2000","","18","1759","","10.1039/b005233g","","","0.71073","MoKα","","0.0205","0.0188","","","0.0545","0.0549","","","","","","0.963","","","","has coordinates,has disorder","180224","2020-10-21","18:00:00",""
"7111049","5.2288","0.0007","5.2288","0.0007","14.175","0.003","90","","90","","90","","387.55","0.11","293","2","293","2","","","","","","","","5","I 4/m m m","-I 4 2","139","","","","- C0.25 H0.25 N0.13 O0.38 W0.13 -","- C0.245 H0.5 N0.125 O0.375 W0.125 -","- C7.84 H16 N4 O12 W4 -","32","1","","Yan, Bangbo; Xu, Yan; Goh, Ngoh K.; Chia, Lian S.","Hydrothermal synthesis and crystal structures of two novel hybrid open-frameworks and a two-dimensional network based on tungsten(vi) oxides","Chemical Communications","2000","","21","2169","","10.1039/b005303l","","","0.71073","MoKα","","0.0314","0.0302","","","0.0802","0.0805","","","","","","1.189","","","","has coordinates,has disorder","287900","2023-11-30","17:14:42",""
"7111050","7.4733","0.0015","7.3927","0.0015","22.57","0.004","90","","90","","90","","1246.9","0.4","293","2","293","2","","","","","","","","5","C m c a","-C 2ac 2","64","","","","- C2.5 H2 N0.5 O1.5 W0.5 -","- C2.45 H2.6 N0.5 O1.5 W0.5 -","- C39.2 H41.6 N8 O24 W8 -","16","","","Yan, Bangbo; Xu, Yan; Goh, Ngoh K.; Chia, Lian S.","Hydrothermal synthesis and crystal structures of two novel hybrid open-frameworks and a two-dimensional network based on tungsten(vi) oxides","Chemical Communications","2000","","21","2169","","10.1039/b005303l","","","0.71073","MoKα","","0.0445","0.0336","","","0.0776","0.0811","","","","","","1.047","","","","has coordinates,has disorder","287900","2023-11-30","17:14:42",""
"7111051","7.343","0.002","7.373","0.003","9.889","0.003","93.99","0.02","109.714","0.016","91.23","0.02","502.2","0.3","297","2","297","2","","","","","","","","5","P -1","-P 1","2","","","","- C2 H10 N2 O10 W3 -","- C2 H10 N2 O10 W3 -","- C4 H20 N4 O20 W6 -","2","1","","Yan, Bangbo; Xu, Yan; Goh, Ngoh K.; Chia, Lian S.","Hydrothermal synthesis and crystal structures of two novel hybrid open-frameworks and a two-dimensional network based on tungsten(vi) oxides","Chemical Communications","2000","","21","2169","","10.1039/b005303l","","","0.71073","MoKα","","0.0502","0.0403","","","0.0969","0.1021","","","","","","1.055","","","","has coordinates","287900","2023-11-30","17:14:42",""
"7111052","15.282","0.0008","15.5376","0.0008","20.4796","0.0011","93.011","0.001","106.941","0.001","108.216","0.001","4363.1","0.4","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","","","- C36 H84 Br3 Cu11 O12 P6 Se13 -","- C36 Br3 Cu11 O12 P6 Se13 -","- C72 Br6 Cu22 O24 P12 Se26 -","2","1","","Liu, C. W.; Hung, Chiu-Mine; Chen, Hsiu-Chih; Wang, Ju-Chung; Keng, Tai-Chiun; Guo, Kermin","A novel nonacoordinate bridging selenido ligand in a tricapped trigonal-prismatic geometry. X-Ray structure of Cu11(μ9-Se)(μ3-Br)3[Se2P(OPri)2]6","Chemical Communications","2000","","19","1897","","10.1039/b005366j","","","0.71073","MoKα","","0.0851","0.0639","","0.1535","0.1397","","","","1.097","1.131","1.131","","","","","has coordinates,has disorder","180224","2020-10-21","18:00:00",""
"7111053","24.345","0.005","13.151","0.003","24.991","0.005","90","","91.34","0.03","90","","7999","3","293","2","293","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C36 H84 Br Cu8 F6 O12 P7 Se12 -","- C36.58 H80 Br Cu8 F6 O11.42 P7 Se12 -","- C146.32 H320 Br4 Cu32 F24 O45.68 P28 Se48 -","4","0.5","","Liu, C. W.; Hung, Chiu-Mine; Chen, Hsiu-Chih; Wang, Ju-Chung; Keng, Tai-Chiun; Guo, Kermin","A novel nonacoordinate bridging selenido ligand in a tricapped trigonal-prismatic geometry. X-Ray structure of Cu11(μ9-Se)(μ3-Br)3[Se2P(OPri)2]6","Chemical Communications","2000","","19","1897","","10.1039/b005366j","","","0.71073","MoKα","","0.0647","0.0502","","","0.1096","0.1189","","","","","","1.126","","","","has coordinates,has disorder","180224","2020-10-21","18:00:00",""
"7111056","9.7819","0.0019","10.582","0.003","7.85","0.0016","90","","109.81","0.015","90","","764.5","0.3","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","pyxophane","","","- C20 H16 O4 -","- C20 H16 O4 -","- C40 H32 O8 -","2","0.5","","Behm, Robert; Gokel, George W.; Gloeckner, Charles; Grayson, Michael A.; Gross, Michael L.","Pyxophanes: selective gas phase ion complexation by 1,6,13,18-tetraoxa[6.6]paracyclophane-3,15-diyne","Chemical Communications","2000","","23","2377","","10.1039/b005443g","","","1.5418","CuKα","","0.0772","0.046","","","0.1235","0.1558","","","","","","1.015","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111058","7.9346","0.0004","14.3035","0.0008","13.3949","0.0007","90","","102.181","0.002","90","","1485.99","0.14","193.2","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C18 H16 O4 -","- C18 H16 O4 -","- C72 H64 O16 -","4","1","","Houjou, Hirohiko; Lee, Sung-Kil; Hishikawa, Yukio; Nagawa, Yoshinobu; Hiratani, Kazuhisa","Highly selective formation of 2∶2 macrocycles from a novel hydroxybenzaldehyde derivative and diamines","Chemical Communications","2000","","22","2197","","10.1039/b005536k","","","0.7107","MoKα","","","0.04","","","","0.0779","","","","","","3.547","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7111059","7.737","0.0003","13.7793","0.0006","14.5413","0.0004","90","","101.431","0.001","90","","1519.5","0.1","193.2","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C18 H16 O4 -","- C18 H16 O4 -","- C72 H64 O16 -","4","1","","Houjou, Hirohiko; Lee, Sung-Kil; Hishikawa, Yukio; Nagawa, Yoshinobu; Hiratani, Kazuhisa","Highly selective formation of 2∶2 macrocycles from a novel hydroxybenzaldehyde derivative and diamines","Chemical Communications","2000","","22","2197","","10.1039/b005536k","","","0.7107","MoKα","","","0.0436","","","","0.0734","","","","","","2.607","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7111060","11.4881","0.0001","13.9886","0.0001","22.0242","0.0003","90","","104.524","0.001","90","","3426.23","0.06","173","2","173","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C30 H55 N3 O Si2 Zn -","- C30 H55 N3 O Si2 Zn -","- C120 H220 N12 O4 Si8 Zn4 -","4","2","","Cheng, Ming; Darling, Nicholas A.; Lobkovsky, Emil B.; Coates, Geoffrey W.","Enantiomerically-enriched organic reagents via polymer synthesis: enantioselective copolymerization of cycloalkene oxides and CO2 using homogeneous, zinc-based catalysts","Chemical Communications","2000","","20","2007","","10.1039/b005537i","","","0.71073","MoKα","","0.0666","0.0473","","0.1158","0.1031","","","","0.708","0.718","0.718","","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111061","29.59","0.002","9.9271","0.0007","17.2881","0.0012","90","","116.735","0.001","90","","4535.4","0.5","90","2","90","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Bis(ethylenedithio)tetrathiafulvalene C60 complex","","","- C70 H8 I3 S8 -","- C70 H8 I3 S8 -","- C280 H32 I12 S32 -","4","0.5","","Konarev, D. V.; Lyubovskaya, R. N.; Kovalevsky, A. Yu.; Coppens, P.","Synthesis and crystal structure of a C60 complex with a bis(ethylenedithio)tetrathiafulvalene radical cation salt: (BEDT-TTF·I3)C60","Chemical Communications","2000","","23","2357","","10.1039/b005541g","","","0.71073","MoKα","","0.0495","0.0341","","","0.0867","0.094","","","","","","1.053","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111062","8.7877","0.0006","13.1474","0.0007","8.7626","0.0004","96.347","0.002","113.782","0.004","78.837","0.002","908.3","0.09","288.2","","288.2","","","","","","","","","6","P -1","-P 1","2","","","","- C18 H14 Cl2 F2 N2 O2 -","- C18 H Cl2 F2 N2 O2 -","- C36 H2 Cl4 F4 N4 O4 -","2","1","","Hao, Jian; Ohkura, Hironari; Amii, Hideki; Uneyama, Kenji","A novel intramolecular defluorinative cyclization approach to the synthesis of difluoromethylated quinazolic acid derivatives","Chemical Communications","2000","","19","1883","","10.1039/b005611l","","","0.7107","MoKα","","","0.0619","","","0.0896","","","","","10.376","10.376","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7111063","11.76","0.004","21.356","0.005","25.69","0.008","90","","100.66","0.02","90","","6341","3","150","","150","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C124 H116 Cl8 Fe4 N20 O13 S8 -","- C124 H116 Cl8 Fe4 N20 O13 S8 -","- C248 H232 Cl16 Fe8 N40 O26 S16 -","2","0.5","","Ameerunisha, Sardar; Schneider, Jörg; Meyer, Thomas; Henkel, Gerald; Zacharias, Panthapally S.; Bill, Eckhard","Synthesis and structural characterisation of Fe(ii) and Cu(i) complexes of a new tetrafunctional N-donor ligand with dodecahedral or tetrahedral binding domains","Chemical Communications","2000","","21","2155","","10.1039/b005671p","","","0.71073","MoKα","","0.0997","0.0589","","","0.1297","0.1491","","","","","","1.008","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111064","11.188","0.003","16.587","0.004","17.538","0.004","89.54","0.02","84.4","0.02","87.11","0.02","3235","1.4","150","","150","","","","","","","","","7","P -1","-P 1","2","","","","- C65 H65 Cl2 Cu2 N11 O11 S4 -","- C65 H65 Cl2 Cu2 N11 O11 S4 -","- C130 H130 Cl4 Cu4 N22 O22 S8 -","2","1","","Ameerunisha, Sardar; Schneider, Jörg; Meyer, Thomas; Henkel, Gerald; Zacharias, Panthapally S.; Bill, Eckhard","Synthesis and structural characterisation of Fe(ii) and Cu(i) complexes of a new tetrafunctional N-donor ligand with dodecahedral or tetrahedral binding domains","Chemical Communications","2000","","21","2155","","10.1039/b005671p","","","0.71073","MoKα","","0.0687","0.0435","","","0.0929","0.1037","","","","","","1.018","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111065","7.517","0.001","10.144","0.001","22.79","0.003","90","","90","","90","","1737.8","0.4","150","","150","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C12 H26 Cl3 N3 Zr -","- C12 H26 Cl3 N3 Zr -","- C48 H104 Cl12 N12 Zr4 -","4","1","","Giesbrecht, Garth R.; Shafir, Alex; Arnold, John","Zirconium complexes of a tacn-derived amido ligand and ring-opening to form a new diamido-amino pincer","Chemical Communications","2000","","21","2135","","10.1039/b005675h","","","0.7107","MoKalpha","","0.0661","0.0311","","0.0397","0.0316","","","","","0.76","0.76","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7111066","39.6517","0.0003","39.6517","0.0003","9.7469","0.0001","90","","90","","120","","13271.5","0.2","173","","173","","","","","","","","","4","R -3 :H","-R 3","148","","","","- C33 H47 N3 Zr -","- C33 H47 N3 Zr -","- C594 H846 N54 Zr18 -","18","1","","Giesbrecht, Garth R.; Shafir, Alex; Arnold, John","Zirconium complexes of a tacn-derived amido ligand and ring-opening to form a new diamido-amino pincer","Chemical Communications","2000","","21","2135","","10.1039/b005675h","","","0.7107","MoKalpha","","0.0428","0.0236","","0.0315","0.028","","","","","1.008","1.008","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7111067","8.881","0.0005","25.936","0.002","11.7707","0.0007","90","","112.017","0.001","90","","2513.5","0.3","164","","164","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C26 H39 N3 Zr -","- C26 H39 N3 Zr -","- C104 H156 N12 Zr4 -","4","1","","Giesbrecht, Garth R.; Shafir, Alex; Arnold, John","Zirconium complexes of a tacn-derived amido ligand and ring-opening to form a new diamido-amino pincer","Chemical Communications","2000","","21","2135","","10.1039/b005675h","","","0.7107","MoKalpha","","0.0841","0.0431","","0.0639","0.0535","","","","","1.244","1.244","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7111068","46.3325","0.0012","13.626","0.0004","27.5394","0.0007","90","","118.194","0.001","90","","15323.5","0.7","150","1","150","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C166 H166 N16 Ru4 Si2 -","- C166 H166 N16 Ru4 Si2 -","- C664 H664 N64 Ru16 Si8 -","4","0.5","","Wong, Ken-Tsung; Lehn, Jean-Marie; Peng, Shie-Ming; Lee, Gene-Hsiang","Nanoscale molecular organometallo-wires containing diruthenium cores","Chemical Communications","2000","","22","2259","","10.1039/b005679k","","","0.71073","MoKα","","0.2144","0.1122","","0.3377","0.2771","","","","1.022","1.201","1.201","","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111069","12.567","0.0004","15.9025","0.0006","13.939","0.0005","90","","105.099","0.001","90","","2689.49","0.16","91","2","91","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","NacNacGa","","","- C29 H41 Ga N2 -","- C29 H41 Ga N2 -","- C116 H164 Ga4 N8 -","4","1","","Hardman, Ned J.; Eichler, Barrett E.; Power, Philip P.","Synthesis and characterization of the monomer Ga{(NDippCMe)2CH} (Dipp = C6H3Pri2-2,6): a low valent gallium(i) carbene analogue","Chemical Communications","2000","","20","1991","","10.1039/b005686n","","","0.71073","MoKα","","0.0656","0.0375","","","0.0874","0.101","","","","","","0.942","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111070","17.346","0.002","17.346","0.002","10.428","0.001","90","","90","","90","","3137.6","0.6","298","2","298","2","","","","","","","","5","P 42/m n m","-P 4n 2n","136","","","","- C34 H20 N2 O13 Zn4 -","- C34 H20 N2 O13 Zn4 -","- C136 H80 N8 O52 Zn16 -","4","0.25","","Tao, Jun; Tong, Ming-Liang; Shi, Jian-Xin; Chen, Xiao-Ming; Ng, Seik Weng","Blue photoluminescent zinc coordination polymers with supertetranuclear cores","Chemical Communications","2000","","20","2043","","10.1039/b005753n","","","0.71073","MoKα","","0.0415","0.0294","","","0.0745","0.0859","","","","","","1.038","","","","has coordinates,has disorder","180224","2020-10-21","18:00:00",""
"7111071","17.096","0.007","11.183","0.006","18.607","0.012","90","","103.52","0.01","90","","3459","3","293","2","293","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C32 H24 N4 O14 Zn4 -","- C32 H24 N4 O14 Zn4 -","- C128 H96 N16 O56 Zn16 -","4","1","","Tao, Jun; Tong, Ming-Liang; Shi, Jian-Xin; Chen, Xiao-Ming; Ng, Seik Weng","Blue photoluminescent zinc coordination polymers with supertetranuclear cores","Chemical Communications","2000","","20","2043","","10.1039/b005753n","","","0.71073","MoKα","","0.0603","0.0424","","","0.0991","0.1104","","","","","","1.026","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111072","12.671","0.005","17.562","0.005","14.026","0.005","90","0.005","98.825","0.005","90","0.005","3084.2","1.9","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H54 B2 Li4 N4 -","- C24 H54 B2 Li4 N4 -","- C96 H216 B8 Li16 N16 -","4","1","","Brask, Justin K.; Chivers, Tristram; Schatte, Gabriele","A new route to dilithio boraamidinates: formation and X-ray structures of the dimeric and trimeric clusters {Li2[RB(NBut)2]}x (R = Bun, x = 2 and R = Me, x = 3)","Chemical Communications","2000","","18","1805","","10.1039/b005852l","","","0.71069","MoKα","","0.1826","0.0641","","","0.1322","0.1678","","","","","","0.838","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111073","17.3587","0.0013","12.075","0.0008","19.2718","0.0014","90","","116.073","0.001","90","","3628.4","0.4","193","2","193","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C27 H63 B3 Li6 N6 -","- C27 H63 B3 Li6 N6 -","- C108 H252 B12 Li24 N24 -","4","0.5","","Brask, Justin K.; Chivers, Tristram; Schatte, Gabriele","A new route to dilithio boraamidinates: formation and X-ray structures of the dimeric and trimeric clusters {Li2[RB(NBut)2]}x (R = Bun, x = 2 and R = Me, x = 3)","Chemical Communications","2000","","18","1805","","10.1039/b005852l","","","0.71073","MoKα","","0.0842","0.0611","","","0.1617","0.1775","","","","","","1.051","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111074","11.2175","0.0003","22.0485","0.0005","11.6287","0.0002","90","","112.272","0.002","90","","2661.54","0.11","173","2","173","2","","","","","","","synthesis as described","4","P 1 21/c 1","-P 2ybc","14","[Sr(P3C2tBu2)2]","","","- C20 H36 P6 Sr -","- C20 H36 P6 Sr -","- C80 H144 P24 Sr4 -","4","1","","Francis, Matthew D.; Hitchcock, Peter B.; Nixon, John F.","Synthesis and structural characterisation of the first hexaphosphastrontocene [Sr(η5-P3C2But2)2] and its pyrazine adduct","Chemical Communications","2000","","20","2027","","10.1039/b005855f","","x-ray","0.71073","MoKα","","0.0592","0.0398","","","0.083","0.0911","","","","","","1.002","","","","has coordinates,has disorder","180224","2020-10-21","18:00:00",""
"7111075","9.8797","0.0003","11.554","0.0003","15.8655","0.0004","71.134","0.002","74.932","0.002","68.19","0.002","1570.8","0.08","173","2","173","2","","","","","","","synthesis as described","5","P -1","-P 1","2","[{Sr(P3C2tBu2)2(C4H4N2)}n]","","","- C24 H40 N2 P6 Sr -","- C24 H40 N2 P6 Sr -","- C48 H80 N4 P12 Sr2 -","2","1","","Francis, Matthew D.; Hitchcock, Peter B.; Nixon, John F.","Synthesis and structural characterisation of the first hexaphosphastrontocene [Sr(η5-P3C2But2)2] and its pyrazine adduct","Chemical Communications","2000","","20","2027","","10.1039/b005855f","","x-ray","0.71073","MoKα","","0.0586","0.0405","","","0.0758","0.0823","","","","","","1.035","","","","has coordinates,has disorder","180224","2020-10-21","18:00:00",""
"7111076","13.0505","0.0005","13.0505","0.0005","29.9705","0.0007","90","","90","","120","","4420.6","0.3","293","2","293","2","","","","","","","","6","P 61","P 61","169","","","","- C29 H37 B N3 O3 P -","- C29 H37 B N3 O3 P -","- C174 H222 B6 N18 O18 P6 -","6","1","","Marchi, Caroline; Delapierre, Guillaume; Fotiadu, Frédéric; Buono, Gérard","First totally diastereoselective opening of chiral triquinphosphoranes. A new access to enantiopure oxazaphospholidines","Chemical Communications","2000","","22","2227","","10.1039/b005884j","","","0.7107","MoKα","","0.073","0.0595","","","0.1509","0.1746","","","","","","1.185","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111078","9.829","0.001","22.615","0.001","10.618","0.001","90","","117.474","0.005","90","","2094","0.3","173","","173","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","compound 7","","","- C42 H70 N4 Pt2 -","- C42 H62 N4 Pt2 -","- C84 H124 N8 Pt4 -","2","0.5","","Siri, Olivier; Braunstein, Pierre","First binuclear complex of an N,N′,N″,N‴-tetraalkyl 2,5-diamino-1,4-benzoquinonediimine","Chemical Communications","2000","","22","2223","","10.1039/b005952h","","","0.71073","Mo-Kα","","0.085","0.047","","0.164","","0.068","","","3.166","","","1.289","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111079","14.549","0.004","5.907","0.002","16.345","0.006","90","","105.78","0.02","90","","1351.8","0.8","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C26 H37 N O9 -","- C26 H37 N O9 -","- C52 H74 N2 O18 -","2","1","","Duff, Fraser J.; Vivien, Vincent; Wightman, Richard H.","Synthesis of aza-C-disaccharides using cycloaddition reactions of a functionalized cyclic nitrone","Chemical Communications","2000","","21","2127","","10.1039/b005984f","","","0.71073","MoKα","","0.1421","0.0708","","","0.1401","0.1709","","","","","","1.012","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111080","5.417","0.001","25.006","0.004","9.051","0.001","90","","96.87","0.01","90","","1217.2","0.3","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C23 H35 N O10 -","- C23 H35 N O10 -","- C46 H70 N2 O20 -","2","1","","Duff, Fraser J.; Vivien, Vincent; Wightman, Richard H.","Synthesis of aza-C-disaccharides using cycloaddition reactions of a functionalized cyclic nitrone","Chemical Communications","2000","","21","2127","","10.1039/b005984f","","","0.71073","MoKα","","0.0323","0.0305","","","0.0815","0.083","","","","","","1.055","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111081","14.395","0.004","33.405","0.009","19.277","0.006","90","","108.67","0.02","90","","8782","4","233","2","233","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C108 H42 Cl18 O14 -","- C108 H42 Cl18 O14 -","- C432 H168 Cl72 O56 -","4","1","","van Eis, Maurice J.; Seiler, Paul; Diederich, François; Alvarado, Robert J.; Echegoyen, Luis","First tether-directed regioselective bis-functionalisation of C70: effects of cation complexation on the redox properties of diastereoisomeric fullerene crown ether conjugates","Chemical Communications","2000","","19","1859","","10.1039/b006066f","","","1.5418","CuKα","","0.105","0.077","","","0.2052","0.2339","","","","","","1.048","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111082","6.5","0.001","7.957","0.004","16.507","0.002","76.73","0.02","89.38","0.01","85.06","0.02","827.8","0.5","293","2","293","2","","","","","","","Hydrothermal synthesis","6","P -1","-P 1","2","","","","- C28 H22 Co3 N4 O22 Pd2 -","- C28 H14 Co3 N4 O22 Pd2 -","- C28 H14 Co3 N4 O22 Pd2 -","1","0.5","","Gerrard, Lee A.; Wood, Paul T.","Hydrothermal crystal engineering using hard and soft acids and bases: synthesis and X-ray crystal structures of the metal hydroxide-based phases M3M′2(OH)2[NC5H3(CO2)2-2,4]4(H2O)4 (M = Co, Ni, Zn; M′ = Pd, Pt)","Chemical Communications","2000","","21","2107","","10.1039/b006094l","","","0.71073","MoKα","","0.0464","0.0365","","0.1584","0.0991","","","","1.065","1.107","1.107","","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111083","6.529","0.001","8.124","0.002","16.719","0.003","75.94","0.03","88.73","0.03","84.78","0.03","856.7","0.3","293","2","293","2","","","","","","","Hydrothermal synthesis","6","P -1","-P 1","2","","","","- C28 H22 N4 O22 Pd2 Zn3 -","- C28 H14 N4 O22 Pd2 Zn3 -","- C28 H14 N4 O22 Pd2 Zn3 -","1","0.5","","Gerrard, Lee A.; Wood, Paul T.","Hydrothermal crystal engineering using hard and soft acids and bases: synthesis and X-ray crystal structures of the metal hydroxide-based phases M3M′2(OH)2[NC5H3(CO2)2-2,4]4(H2O)4 (M = Co, Ni, Zn; M′ = Pd, Pt)","Chemical Communications","2000","","21","2107","","10.1039/b006094l","","","0.71073","MoKα","","0.0601","0.0412","","0.1348","0.1","","","","0.976","1.061","1.061","","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111084","13.3874","0.0004","13.9184","0.0007","12.095","0.0007","90","","90","","90","","2253.68","0.19","173","","173","","","","","","","","","7","P b c n","-P 2n 2ab","60","","","","- C18 H24 Cl2 Co N2 O2 S2 -","- C16 H16 Cl2 Co0.5 N O2 S2 -","- C64 H64 Cl8 Co2 N4 O8 S8 -","4","0.5","","Jouaiti, Abdelaziz; Hosseini, Mir Wais; De Cian, André","Design, synthesis and structural investigation of a 1-D directional coordination network based on the self-assembly of an unsymmetrical mono-tridentate ligand and cobalt cation","Chemical Communications","2000","","19","1863","","10.1039/b006099m","","","0.71073","Mo-Kα","","0.057","0.036","","0.125","","0.075","","","2.209","","","1.376","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111085","16.2084","0.0007","16.3039","0.0007","23.9367","0.0011","91.241","0.001","94.88","0.001","90.067","0.001","6301.1","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C130 H90 N3 O22 P7 Rh10 -","- C130 H90 N3 O22 P7 Rh10 -","- C260 H180 N6 O44 P14 Rh20 -","2","1","","Ragaini, Fabio; Sironi, Angelo; Fumagalli, Alessandro","Deactivation of a [PPN][Rh(CO)4]-based catalytic system [PPN+ = (PPh3)2N+]. The first decomposition reaction of PPN+ and the formation of [Rh10P(CO)22]3−","Chemical Communications","2000","","21","2117","","10.1039/b006135m","","","0.71073","MoKα","","0.098","0.0634","","","0.1494","0.1696","","","","","","1.035","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111086","8.539","0.002","11.828","0.003","12.989","0.004","90","","95.07","0.02","90","","1306.7","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H12 B Cl N2 -","- C13 H12 B Cl N2 -","- C52 H48 B4 Cl4 N8 -","4","1","","Charoy, Laurent; Valleix, Alain; Le Gall, Thierry; Pham van Chuong, Paul; Mioskowski, Charles; Toupet, Loïc","Synthesis of benzylcyanoborane adducts of amines and separation of their enantiomers; SN2 substitution at boron atom","Chemical Communications","2000","","22","2275","","10.1039/b006265k","","","0.71069","MoKα","","0.1543","0.0665","","","0.1758","0.2206","","","","","","0.94","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111087","11.645","0.003","16.506","0.002","6.074","0.002","90","","90","","90","","1167.5","0.5","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C11 H17 B N2 -","- C11 H17 B N2 -","- C44 H68 B4 N8 -","4","1","","Charoy, Laurent; Valleix, Alain; Le Gall, Thierry; Pham van Chuong, Paul; Mioskowski, Charles; Toupet, Loïc","Synthesis of benzylcyanoborane adducts of amines and separation of their enantiomers; SN2 substitution at boron atom","Chemical Communications","2000","","22","2275","","10.1039/b006265k","","","0.71069","MoKα","","0.1332","0.0372","","","0.095","0.122","","","","","","0.874","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111088","20.523","0.004","11.22","0.002","21.304","0.004","90","","107.33","0.03","90","","4682.9","1.7","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","(PPh4)2(Ni(edt-CN)2)","Bis(tetraphenylphosphonium) bis(1-cyano-1,2-dithioethylene)nickelate","","- C54 H42 N2 Ni P2 S4 -","- C54 H42 N2 Ni P2 S4 -","- C216 H168 N8 Ni4 P8 S16 -","4","1","","Fourmigué, Marc; Bertran, Josep N.","[Ni(edt-CN)2]−·, a novel paramagnetic nickel dithiolene complex analog of Ni(mnt)2−· with two cyano groups only","Chemical Communications","2000","","21","2111","","10.1039/b006440h","","","0.71073","MoKα","","0.0996","0.0581","","","0.1491","0.1628","","","","","","1.022","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111089","11.394","0.0012","11.51","0.0011","12.8262","0.0013","64.264","0.01","72.777","0.012","83.074","0.012","1447.2","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","PPh4, Ni(edt-CN)2","Bis(2-cyano-1,2-ethylenedithiolate)Nickelate, tetraphenylphosphonium","","- C30 H22 N2 Ni P S4 -","- C30 H22 N2 Ni P S4 -","- C60 H44 N4 Ni2 P2 S8 -","2","1","","Fourmigué, Marc; Bertran, Josep N.","[Ni(edt-CN)2]−·, a novel paramagnetic nickel dithiolene complex analog of Ni(mnt)2−· with two cyano groups only","Chemical Communications","2000","","21","2111","","10.1039/b006440h","","","0.71073","MoKα","","0.0608","0.0343","","","0.0655","0.0713","","","","","","0.893","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111090","11.054","0.004","16.173","0.004","10.284","0.003","105.96","0.02","114.61","0.02","80.47","0.03","1604.4","0.9","293.2","","293.2","","","","","","","","","7","P -1","-P 1","2","","","","- C54 H34 Cu2 F24 Gd2 N4 O16 -","- C54 H34 Cu2 F24 Gd2 N4 O16 -","- C54 H34 Cu2 F24 Gd2 N4 O16 -","1","0.5","","Kido, Takafumi; Nagasato, Shigeyuki; Sunatsuki, Yukinari; Matsumoto, Naohide","A cyclic tetranuclear Cu2Gd2 complex with an S = 8 ground state derived from ferromagnetic spin-coupling between copper(ii) and gadolinium(iii) ions arrayed alternately","Chemical Communications","2000","","21","2113","","10.1039/b006445i","","","0.7107","MoKα","","0.0333","0.033","","0.034","","0.034","","","3.542","","","3.54","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7111091","10.1071","0.0012","13.1712","0.0017","14.0181","0.0018","90","","90","","90","","1866.1","0.4","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C15 H23 Mo2 N S3 -","- C15 H23 Mo2 N S3 -","- C60 H92 Mo8 N4 S12 -","4","1","","Schollhammer, Philippe; Cabon, Nolwenn; Pétillon, François Y.; Talarmin, Jean; Muir, Kenneth W.","Hydride transfer reactions in dimolybdenum compounds: a simple route to the novel μ-η1∶η1-tetrahydroboride complex [Mo2Cp2(μ-SMe)3(μ-BH4)]","Chemical Communications","2000","","21","2137","","10.1039/b006457m","","","0.71073","MoKα","","0.0732","0.0569","","","0.1466","0.158","","","","","","1.095","","","","has coordinates,has disorder","180224","2020-10-21","18:00:00",""
"7111092","11.7445","0.0013","10.4279","0.0007","14.196","0.0017","90","","100.774","0.01","90","","1707.9","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H23 B Mo2 S3 -","- C13.0123 H22.2733 B Mo2 S3 -","- C52.0492 H89.0932 B4 Mo8 S12 -","4","1","","Schollhammer, Philippe; Cabon, Nolwenn; Pétillon, François Y.; Talarmin, Jean; Muir, Kenneth W.","Hydride transfer reactions in dimolybdenum compounds: a simple route to the novel μ-η1∶η1-tetrahydroboride complex [Mo2Cp2(μ-SMe)3(μ-BH4)]","Chemical Communications","2000","","21","2137","","10.1039/b006457m","","","0.71073","MoKα","","0.0585","0.0274","","","0.0585","0.0704","","","","","","1.084","","","","has coordinates,has disorder","180224","2020-10-21","18:00:00",""
"7111093","4.7895","0.0014","23.242","0.007","8.138","0.003","90","","94.24","0.006","90","","903.4","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","tin phosphonopropionate-oxalate","","","- C8 H8 O14 P2 Sn4 -","- C8 H8 O14 P2 Sn4 -","- C16 H16 O28 P4 Sn8 -","2","0.5","","Stock, Norbert; Stucky, Galen D.; Cheetham, Anthony K.","The hybrid open-framework of tin(ii) phosphonopropionate oxalate, Sn4(O3PCH2CH2CO2)2(C2O4)","Chemical Communications","2000","","22","2277","","10.1039/b006511k","","","0.71073","MoKα","","0.0373","0.0252","","","0.0518","0.0543","","","","","","0.966","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111094","11.2095","0.0016","17.362","0.003","20.493","0.003","90","","91.614","0.003","90","","3986.8","1.1","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C31 H32 F12 N12 Ni O3 P2 -","- C31 H32 F12 N12 Ni O3 P2 -","- C124 H128 F48 N48 Ni4 O12 P8 -","4","1","","Barclay, Tosha M.; Hicks, Robin G.; Lemaire, Martin T.; Thompson, Laurence K.","Structure and magnetic properties of a nickel(ii) complex of a tridentate verdazyl radical: strong ferromagnetic metal-radical exchange coupling","Chemical Communications","2000","","21","2141","","10.1039/b006520j","","","0.71073","MoKα","","0.0737","0.0527","","","0.1547","0.1722","","","","","","1.046","","","","has coordinates,has disorder","180224","2020-10-21","18:00:00",""
"7111095","11.456","0.002","13.352","0.003","14.019","0.003","89.456","0.004","79.991","0.005","87.587","0.004","2109.8","0.8","180","2","180","2","","","","","","","","4","P -1","-P 1","2","","","","- C45 H72 N4 Zr -","- C45 H72 N4 Zr -","- C90 H144 N8 Zr2 -","2","1","","Morton, Colin; O’Shaughnessy, Paul; Scott, Peter","Control of metal/ligand stoichiometry and structure in aminopyridinato complexes of zirconium: N-alkyl is better than trimethylsilyl","Chemical Communications","2000","","21","2099","","10.1039/b006603f","","","0.71073","MoKα","","0.1054","0.0674","","","0.1495","0.1584","","","","","","0.99","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111096","9.4318","0.0002","9.4318","0.0002","27.989","0.0008","90","","90","","90","","2489.87","0.1","95","2","95","2","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","","","","- C14 H19 N O2 -","- C14 H19 N O2 -","- C112 H152 N8 O16 -","8","1","","Alexander, Jacob S.; Baldwin, John E.; Burrell, Richard C.; Ruhlandt-Senge, Karin","(1R,2S)-(+)-cis-1-Methoxycarbonyl-2-methylcyclobutane","Chemical Communications","2000","","22","2201","","10.1039/b006639g","","","0.71073","MoKα","","0.0348","0.0306","","","0.0747","0.077","","","","","","1.039","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111097","6.384","0.001","7.007","0.001","9.941","0.001","76","","76","","80","","415.52","0.1","294","","294","","","","","","","","","3","P -1","-P 1","2","","","","- C18 H14 N8 -","- C18 H14 N8 -","- C18 H14 N8 -","1","0.5","","Jouaiti, Abdelaziz; Loï, Marielle; Hosseini, Mir Wais; De Cian, André","Metallacyclophanes formed by a tetrapyrazolyl ligand and copper(ii) cation","Chemical Communications","2000","","21","2085","","10.1039/b006665f","","","0.71073","Mo-Kα","","0.057","0.04","","0.051","","0.049","","","1.113","","","1.066","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111098","19.7081","0.0007","17.9293","0.0006","17.1966","0.0006","90","","90","","90","","6076.5","0.4","173","","173","","","","","","","","","8","C m c a","-C 2ac 2","64","","","","- C42 H32 Cl4 Cu2 F12 N16 O12 S4 -","- C40 H28 Cl4 Cu F11 N16 O11 S2 -","- C160 H112 Cl16 Cu4 F44 N64 O44 S8 -","4","","","Jouaiti, Abdelaziz; Loï, Marielle; Hosseini, Mir Wais; De Cian, André","Metallacyclophanes formed by a tetrapyrazolyl ligand and copper(ii) cation","Chemical Communications","2000","","21","2085","","10.1039/b006665f","","","0.71073","Mo-Kα","","0.116","0.077","","0.299","","0.096","","","4.397","","","1.3","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7111099","10.0302","0.0005","11.3568","0.0006","23.5388","0.0007","90","","90","","90","","2681.3","0.2","294","","294","","","","","","","","","6","I m m m","-I 2 2","71","","","","- C40 H38 Cl12 Cu3 N16 O2 -","- C35.5 H26 Cl4 Cu0.625 N16 O -","- C71 H52 Cl8 Cu1.25 N32 O2 -","2","0.125","","Jouaiti, Abdelaziz; Loï, Marielle; Hosseini, Mir Wais; De Cian, André","Metallacyclophanes formed by a tetrapyrazolyl ligand and copper(ii) cation","Chemical Communications","2000","","21","2085","","10.1039/b006665f","","","0.71073","Mo-Kα","","0.05","0.042","","0.064","","0.052","","","1.285","","","1.061","","","","has coordinates","180224","2020-10-21","18:00:00",""
"7111100","10.174","0.003","28.313","0.005","13.865","0.004","90","","92.06","0.03","90","","3991.3","1.8","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C35 H44 F6 N6 O11 Si Zn -","- C35 H44 F6 N6 O11 Si Zn -","- C140 H176 F24 N24 O44 Si4 Zn4 -","4","1","","Long, De-Liang; Blake, Alexander J.; Champness, Neil R.; Schröder, Martin","Can 4,4′-bipyridine N,N’-dioxide play the same important role as 4,4′-bipyridine in the construction of metal coordination networks and crystal engineering?","Chemical Communications","2000","","22","2273","","10.1039/b006679f","","","0.71073","MoKα","","0.139","0.083","","","0.131","0.166","","","","","","1.255","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7111101","8.8202","0.0009","11.6805","0.001","14.006","0.002","104.589","0.006","96.265","0.006","99.082","0.006","1362.1","0.3","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C60 H48 N14 O18 Zn -","- C60 H48 N14 O18 Zn -","- C60 H48 N14 O18 Zn -","1","0.5","","Long, De-Liang; Blake, Alexander J.; Champness, Neil R.; Schröder, Martin","Can 4,4′-bipyridine N,N’-dioxide play the same important role as 4,4′-bipyridine in the construction of metal coordination networks and crystal engineering?","Chemical Communications","2000","","22","2273","","10.1039/b006679f","","","0.71073","MoKα","","0.145","0.069","","","0.146","0.179","","","","","","0.97","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7111102","6.073","","13.045","0.001","10.104","0.001","90","","98.28","0.01","90","","792.12","0.1","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C17 H21 N O3 -","- C17 H21 N O3 -","- C34 H42 N2 O6 -","2","1","","Bailey, Patrick D.; Rosair, Georgina M.; Taylor, David; McDonald, I. M.","An unusual oxidative rearrangement of azabicyclo[2.2.1]heptenes, providing a stereoselective route to 2′- and 3′-hydroxycyclopentylglycines","Chemical Communications","2000","","24","2451","","10.1039/b006683o","","","0.71073","MoKα","","0.0306","0.0303","","","0.0775","0.0778","","","","","","1.076","","","","has coordinates","180225","2020-10-21","18:00:00",""
"7111103","11.638","0.003","12.174","0.003","13.542","0.003","90","","93.688","0.003","90","","1914.7","0.8","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H16 B2 F5 O P -","- C18 H16 B2 F5 O P -","- C72 H64 B8 F20 O4 P4 -","4","1","","Burke, Jacquelyn M.; Fox, Mark A.; Goeta, Andrés E.; Hughes, Andrew K.; Marder, Todd B.","Why are B2O2 rings rare?","Chemical Communications","2000","","22","2217","","10.1039/b006685k","","","0.71073","MoKα","","0.0763","0.0482","","","0.1137","0.1287","","","","","","1.032","","","","has coordinates","180225","2020-10-21","18:00:00",""
"7111104","17.7905","0.0014","17.6238","0.0013","20.2731","0.0016","90","","111.519","0.002","90","","5913.3","0.8","158","2","158","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C64 H64 Fe N9 O5 -","- C64 H64 Fe N9.001 O5.001 -","- C256 H256 Fe4 N36.004 O20.004 -","4","1","","Cheng, Lin; Khan, Masood A.; Richter-Addo, George B.; Powell, Douglas R.","The first unambiguous determination of a nitrosyl-to-nitrite conversion in an iron nitrosyl porphyrin","Chemical Communications","2000","","23","2301","","10.1039/b006775j","","","0.71073","MoKα","","0.1313","0.0709","","","0.1841","0.2134","","","","","","1.003","","","","has coordinates,has disorder","180225","2020-10-21","18:00:00",""
"7111105","18.7122","0.0008","19.0244","0.0008","18.4955","0.0008","90","","91.543","0.002","90","","6581.8","0.5","133","2","133","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C70 H70 Cl3 Fe N10 O6 -","- C69.934 H69.9338 Cl2.802 Fe N10 O6 -","- C279.736 H279.735 Cl11.208 Fe4 N40 O24 -","4","0.5","","Cheng, Lin; Khan, Masood A.; Richter-Addo, George B.; Powell, Douglas R.","The first unambiguous determination of a nitrosyl-to-nitrite conversion in an iron nitrosyl porphyrin","Chemical Communications","2000","","23","2301","","10.1039/b006775j","","","0.71073","MoKα","","0.0882","0.0675","","","0.1891","0.2098","","","","","","1.074","","","","has coordinates,has disorder","180225","2020-10-21","18:00:00",""
"7111106","18.56","0.002","19.035","0.003","18.543","0.002","90","","90.707","0.01","90","","6550.6","1.4","163","2","163","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C74 H74 Fe N11 O6 -","- C75 H69 Fe N10 O6 -","- C300 H276 Fe4 N40 O24 -","4","0.5","","Cheng, Lin; Khan, Masood A.; Richter-Addo, George B.; Powell, Douglas R.","The first unambiguous determination of a nitrosyl-to-nitrite conversion in an iron nitrosyl porphyrin","Chemical Communications","2000","","23","2301","","10.1039/b006775j","","","0.71073","MoKα","","0.1117","0.0687","","0.2019","0.1638","","","","1.041","1.099","1.099","","","","","has coordinates,has disorder","180225","2020-10-21","18:00:00",""
"7111107","18.583","0.003","19.081","0.003","18.267","0.002","90","","91.113","0.01","90","","6475.9","1.6","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C70 H71 Cl2 Fe N10 O6 -","- C70 H71 Cl2 Fe N10 O6 -","- C280 H284 Cl8 Fe4 N40 O24 -","4","0.5","","Cheng, Lin; Khan, Masood A.; Richter-Addo, George B.; Powell, Douglas R.","The first unambiguous determination of a nitrosyl-to-nitrite conversion in an iron nitrosyl porphyrin","Chemical Communications","2000","","23","2301","","10.1039/b006775j","","","0.71073","MoKα","","0.176","0.081","","0.2286","0.1676","","","","1.03","1.148","1.148","","","","","has coordinates,has disorder","180225","2020-10-21","18:00:00",""
"7111108","9.384","0.002","24.807","0.005","10.901","0.002","90","","111.9","0.03","90","","2354.5","1","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,4,6-tri-tert-butyl-1,3,5-methoxy-1,3,5-triphosphacyclohexane","","- C18 H39 O3 P3 -","- C18 H39 O3 P3 -","- C72 H156 O12 P12 -","4","1","","Krein, M.; Bergsträßer, U.; Peters, C.; Ruf, S. G.; Regitz, M.","Unusual addition reactions of lithium alkoxides to 2,4,6-tri-tert-butyl-1,3,5-triphosphabenzene","Chemical Communications","2000","","20","2015","","10.1039/b006795o","","","0.71073","MoKα","","0.0618","0.0478","","0.1315","0.1223","","","","1.279","1.437","1.437","","","","","has coordinates","180225","2020-10-21","18:00:00",""
"7111109","20.433","0.005","33.873","0.004","10.025","0.004","90","","110.12","0.02","90","","6515","3","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C72 H98 N8 -","- C72 H98 N8 -","- C288 H392 N32 -","4","0.5","","Chambrier, Isabelle; Cook, Michael J.; Wood, Paul T.","Conformationally stressed phthalocyanines: the non-planarity of the 1,4,8,11,15,18,22,25-octaisopentyl derivative","Chemical Communications","2000","","21","2133","","10.1039/b006935n","","","0.71073","MoKα","","0.2028","0.1073","","0.3911","0.2959","","","","0.939","1.175","1.175","","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"7111110","17.0538","0.001","20.0343","0.0012","17.74","0.0011","90","","90","","90","","6061.1","0.6","158","2","158","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C48 H105 Nd3 O12 -","- C48 H88 Nd3 O12 -","- C192 H352 Nd12 O48 -","4","0.5","","Gromada, Jérome; Chenal, Thomas; Mortreux, André; Carpentier, Jean-François; Ziller, Joseph W.; Leising, Frédéric","Rare earth alkoxides as inorganic precursors for olefin polymerization: an alternative to traditional lanthanocene chemistry","Chemical Communications","2000","","22","2183","","10.1039/b006941h","","","0.71073","MoKα","","0.0615","0.041","","","0.1044","0.1183","","","","","","1.059","","","","has coordinates,has disorder","180225","2020-10-21","18:00:00",""
"7111111","7.3415","0.0015","8.5508","0.0018","17.879","0.004","88.527","0.003","85.499","0.004","67.684","0.003","1035.1","0.4","193","2","193","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H10 N20 P2 -","- C12 H10 N20 P2 -","- C24 H20 N40 P4 -","2","1","","Aubauer, Christoph; Klapötke, Thomas M.; Nöth, Heinrich; Schulz, Axel; Suter, Max; Weigand, Jan","1,3-Diphenyl-2,2,2,4,4,4-hexazido-1,3-diaza-2,4-diphosphetidine: synthesis and structural characterisation of the first nitrogen-penta-coordinated phosphorus with three azide-groups","Chemical Communications","2000","","24","2491","","10.1039/b006944m","","","0.71073","MoKα","","0.092","0.0488","","","0.1148","0.1273","","","","","","0.879","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7111115","7.4933","0.0008","19.145","0.002","7.4944","0.0008","90","","120.006","0.002","90","","931.04","0.17","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C2 H12 Ge8 N2 O17 -","- C2 H13 Ge8 N2 O17 -","- C4 H26 Ge16 N4 O34 -","2","1","","Cascales, Concepción; Gutierrez-Puebla, Enrique; Iglesias, Marta; Monge, M. Angeles; Ruiz-Valero, Caridad; Snejko, Natalia","Ge8O16[(OH)−(MeNH3)+(MeNH2)]: one OH-templated germanium zeotype","Chemical Communications","2000","","21","2145","","10.1039/b007054h","","","0.71073","MoKα","","0.0645","0.0528","","0.1074","0.1033","","","","0.873","0.936","0.936","","","","","has coordinates","180225","2020-10-21","18:00:00",""
"7111116","28.7821","0.0007","12.528","0.0003","23.7374","0.0004","90","","90","","90","","8559.3","0.3","123","2","123","2","","","","","","","","5","F d d 2","F 2 -2d","43","Fe(bipy)3[Mn(dca)3]2","Iron(II) tris(2,2'-bipyridine) Bis(manganese(II) tris(dicyanamide))","","- C42 H24 Fe Mn2 N24 -","- C42 H24 Fe Mn2 N24 -","- C336 H192 Fe8 Mn16 N192 -","8","0.5","","Batten, Stuart R.; Jensen, Paul; Moubaraki, Boujemaa; Murray, Keith S.","Anionic metal dicyanamide networks with paramagnetic counter-cations","Chemical Communications","2000","","23","2331","","10.1039/b007080g","","","0.71073","MoKα","","0.0622","0.0424","","","0.0654","0.0699","","","","","","1.012","","","","has coordinates","180225","2020-10-21","18:00:00",""
"7111117","28.8799","0.0006","12.4011","0.0003","23.514","0.0003","90","","90","","90","","8421.4","0.3","123","2","123","2","","","","","","","","4","F d d 2","F 2 -2d","43","Fe(bipy)3[Fe(dca)3]2","Iron(II) tris(2,2'-bipyridine) Bis(iron(II) tris(dicyanamide))","","- C42 H24 Fe3 N24 -","- C42 H24 Fe3 N24 -","- C336 H192 Fe24 N192 -","8","0.5","","Batten, Stuart R.; Jensen, Paul; Moubaraki, Boujemaa; Murray, Keith S.","Anionic metal dicyanamide networks with paramagnetic counter-cations","Chemical Communications","2000","","23","2331","","10.1039/b007080g","","","0.71073","MoKα","","0.0382","0.029","","","0.0583","0.0608","","","","","","1.043","","","","has coordinates","180225","2020-10-21","18:00:00",""
"7111118","28.8625","0.0005","12.5231","0.0002","23.9239","0.0003","90","","90","","90","","8647.2","0.2","123","2","123","2","","","","","","","","5","F d d 2","F 2 -2d","43","Ni(bipy)3[Mn(dca)3]2","Nickel(II) tris(2,2'-bipyridine) Bis(manganese(II) tris(dicyanamide))","","- C42 H24 Mn2 N24 Ni -","- C42 H24 Mn2 N24 Ni -","- C336 H192 Mn16 N192 Ni8 -","8","0.5","","Batten, Stuart R.; Jensen, Paul; Moubaraki, Boujemaa; Murray, Keith S.","Anionic metal dicyanamide networks with paramagnetic counter-cations","Chemical Communications","2000","","23","2331","","10.1039/b007080g","","","0.71073","MoKα","","0.033","0.0259","","","0.0541","0.0564","","","","","","1.024","","","","has coordinates","180225","2020-10-21","18:00:00",""
"7111122","5.9335","0.0003","10.886","0.005","7.7611","0.0004","90","","102.066","0.001","90","","490.2","0.2","298","","298","","","","","","","","?","6","P 1 21/n 1","-P 2yn","14","","","","- C H5 N O3 P Zn -","- C H5 N O3 P Zn -","- C4 H20 N4 O12 P4 Zn4 -","4","1","","Rodgers, Jennifer A.; Harrison, William T. A.","Ethylenediamine zinc hydrogen phosphite, [H2N(CH2)2NH2]0.5·ZnHPO3, containing two independent, interpenetrating, mixed inorganic/organic networks","Chemical Communications","2000","","23","2385","","10.1039/b007268k","","","0.71073","MoKα","","","0.0217","","","0.0263","","","","","1.0219","1.0219","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7111124","22.6251","0.0018","4.8003","0.0004","9.2901","0.0011","90","","101.291","0.005","90","","989.44","0.16","173","","173","","","","","","","","?","4","C 1 c 1","C -2yc","9","","","","- C8 H10 O4 Zn -","- C8 H10 O4 Zn -","- C32 H40 O16 Zn4 -","4","1","","Vela, Michael J.; Snider, Barry B.; Foxman, Bruce M.; Buchholz, Vera; Enkelmann, Volker","Solid-state polymerization of bis(but-3-enoato)zinc: the generation of a stereoregular oligomer","Chemical Communications","2000","","22","2225","","10.1039/b007334m","","","0.71073","MoKα","","","0.0371","","","0.04","","","","","1.1435","1.1435","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7111128","17.504","0.008","15.015","0.007","27.566","0.014","90","","91.162","0.01","90","","7243","6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","9,12-bis-(4-fluorophenyl)-1,2-carborane","","- C14 H18 B10 F2 -","- C14 H18 B10 F2 -","- C224 H288 B160 F32 -","16","4","","Lee, Hans; Knobler, Carolyn B.; Hawthorne, M. Frederick","Supramolecular self-assembly directed by carborane C‒H‥F interactions","Chemical Communications","2000","","24","2485","","10.1039/b007353i","","","1.5418","CuK\α","","0.1194","0.0746","","","0.1917","0.2281","","","","","","1.011","","","","has coordinates","180225","2020-10-21","18:00:00",""
"7111129","6.883","0.004","9.709","0.005","13.926","0.007","84.801","0.019","81.414","0.017","78.499","0.018","899.9","0.8","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","9,12-bis-(3,5-difluorophenyl)-1,2-carborane","","- C14 H16 B10 F4 -","- C14 H16 B10 F4 -","- C28 H32 B20 F8 -","2","1","","Lee, Hans; Knobler, Carolyn B.; Hawthorne, M. Frederick","Supramolecular self-assembly directed by carborane C‒H‥F interactions","Chemical Communications","2000","","24","2485","","10.1039/b007353i","","","1.5418","CuK\α","","0.1055","0.0616","","","0.1492","0.1755","","","","","","1.016","","","","has coordinates","181910","2020-10-21","18:00:00",""
"7111130","11.209","0.001","10.149","0.001","7.5641","0.0008","90","","70.368","0.009","90","","810.47","0.14","294.2","","294.2","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C19 H22 O3 -","- C19 H22 O3 -","- C38 H44 O6 -","2","1","","Cheung, Eugene; Kang, Ting; Scheffer, John R.; Trotter, James","Latent chemical behavior revealed in the crystalline state: novel photochemistry of a cis-9-decalyl aryl ketone","Chemical Communications","2000","","23","2309","","10.1039/b007398i","","","1.5418","CuKα","","0.0623","0.0407","","0.0464","","0.0444","","","2.554","","","2.756","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7111131","13.881","0.005","6.362","0.002","18.179","0.008","90","","97.77","0.04","90","","1590.7","1","294.2","","294.2","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C19 H24 O3 -","- C19 H24 O3 -","- C76 H96 O12 -","4","1","","Cheung, Eugene; Kang, Ting; Scheffer, John R.; Trotter, James","Latent chemical behavior revealed in the crystalline state: novel photochemistry of a cis-9-decalyl aryl ketone","Chemical Communications","2000","","23","2309","","10.1039/b007398i","","","0.7107","MoKα","","0.2021","0.0616","","","0.1725","0.2159","","","","","","1.024","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7111132","8.083","0.003","17.365","0.007","6.182","0.002","90.99","0.03","109.53","0.03","79.04","0.03","801.9","0.5","294.2","","294.2","","","","","","","","","3","P -1","-P 1","2","","","","- C19 H24 O3 -","- C19 H24 O3 -","- C38 H48 O6 -","2","1","","Cheung, Eugene; Kang, Ting; Scheffer, John R.; Trotter, James","Latent chemical behavior revealed in the crystalline state: novel photochemistry of a cis-9-decalyl aryl ketone","Chemical Communications","2000","","23","2309","","10.1039/b007398i","","","1.5418","CuKα","","0.0706","0.06","","0.0694","","0.0604","","","3.602","","","3.393","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7111133","19.7473","0.0003","10.8189","0.0003","23.8391","0.0007","90","","114.033","0.001","90","","4651.6","0.2","123","2","123","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","4'-(4-octyloxyphenyl)-4,2': 6',4''-terpyridine","","","- C29 H31 N3 O -","- C29 H31 N3 O -","- C232 H248 N24 O8 -","8","1","","Cave, Gareth W. V.; Raston, Colin L.","Toward benign syntheses of pyridines involving sequential solvent free aldol and Michael addition reactions","Chemical Communications (Cambridge, United Kingdom)","2000","","22","2199","2200","10.1039/b007431o","","","0.71073","MoKα","","0.1116","0.0625","","","0.1456","0.1848","","","","","","1.089","","","","has coordinates","206958","2020-10-21","18:00:00",""
"7111136","10.909","0.003","11.518","0.003","11.098","0.003","90","","90.548","0.018","90","","1394.4","0.6","292","2","292","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C B4 F6 O -","- C B4 F6 O -","- C8 B32 F48 O8 -","8","2","","Jeffery, John C.; Norman, Nicholas C.; Pardoe, Jennifer A. J.; Timms, Peter L.","Synthesis and structures of carbonyl adducts of the boranes B(BX2)3 (X = F, Cl)","Chemical Communications","2000","","23","2367","","10.1039/b007484p","","","0.71073","MoKα","","0.0993","0.0419","","","0.0939","0.1102","","","","","","0.831","","","","has coordinates","180225","2020-10-21","18:00:00",""
"7111137","11.15","0.005","11.15","0.005","7.586","0.004","90","","90","","120","","816.8","0.7","292","2","292","2","","","","","","","","4","R 3 m :H","R 3 -2""","160","","","","- C B4 Cl6 O -","- C B4 Cl6 O -","- C3 B12 Cl18 O3 -","3","0.166667","","Jeffery, John C.; Norman, Nicholas C.; Pardoe, Jennifer A. J.; Timms, Peter L.","Synthesis and structures of carbonyl adducts of the boranes B(BX2)3 (X = F, Cl)","Chemical Communications","2000","","23","2367","","10.1039/b007484p","","","0.71073","MoKα","","0.0417","0.0391","","","0.0932","0.0939","","","","","","0.973","","","","has coordinates","180225","2020-10-21","18:00:00",""
"7111138","16.411","0.004","14.897","0.003","22.093","0.004","90","","95.055","0.012","90","","5380","2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C41.5 H45 Cl9 Fe2 Pd2 S4 -","- C41.5 H44 Cl9 Fe2 Pd2 S4 -","- C166 H176 Cl36 Fe8 Pd8 S16 -","4","1","","Gibson, Vernon C.; Long, Nicholas J.; White, Andrew J. P.; Williams, Charlotte K.; Williams, David J.","New unsymmetrical thioether- and thiolate-substituted ferrocene ligands and an unusual bridged-Pd dimer complex","Chemical Communications","2000","","23","2359","","10.1039/b007511f","","","0.71073","MoKα","","0.1748","0.0784","","0.2196","0.1612","","","","0.989","1.144","1.144","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7111139","7.869","0.003","10.919","0.003","12.754","0.005","90.44","0.03","103.26","0.03","95.81","0.03","1060.6","0.7","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H66 Cl2 N4 P2 Pd -","- C36 H66 Cl2 N4 P2 Pd -","- C36 H66 Cl2 N4 P2 Pd -","1","0.5","","Cloke, F. Geoffrey N.; Hitchcock, Peter B.; Nixon, John F.; Wilson, D. James","First catalytic dihydroamination of a phosphaalkyne. Crystal and molecular structure of trans-[PdCl2{P(PriNH)2CH2But}2]","Chemical Communications","2000","","23","2387","","10.1039/b007512o","","","0.71073","MoKα","","0.0447","0.0381","","0.1041","0.0991","","","","1.033","1.046","1.046","","","","","has coordinates","180225","2020-10-21","18:00:00",""
"7111140","17.3386","0.0007","13.7599","0.0005","9.461","0.0004","90","","90","","90","","2257.18","0.16","180","2","180","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C16 H29 O4 P3 W -","- C16 H29 O4 P3 W -","- C64 H116 O16 P12 W4 -","4","0.5","","Armstrong, David R.; Feeder, Neil; Hopkins, Alexander D.; Mays, Martin J.; Wood, Jody A.; Woods, Anthony D.; Wright, Dominic S.; Moncrieff, David","Electrophilic ring-opening of [(RP)nAs]− anions; a simple route to functionalised neutral phosphines of the type [(ButP)(ButRP)2]","Chemical Communications","2000","","24","2483","","10.1039/b007553l","","","0.71069","MoKα","","0.0436","0.0267","","0.0664","0.0616","","","","1.076","1.108","1.108","","","","","has coordinates","180225","2020-10-21","18:00:00",""
"7111141","10.768","0.005","15.464","0.005","15.529","0.005","90","0.005","90","0.005","90","0.005","2585.8","1.7","163","2","163","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C13 H13 N S3 -","- C13 H13 N S3 -","- C104 H104 N8 S24 -","8","1","","Hanton, Lyall R.; Turnbull, Julia M.; Richardson, Christopher; Robinson, Ward T.","Thiophene S-binding of a conformationally constrained thiophenophane leading to the formation of a copper(i) coordination polymer","Chemical Communications","2000","","24","2465","","10.1039/b007579p","","","0.71069","MoKα","","0.0471","0.0288","","","0.0649","0.068","","","","","","0.95","","","","has coordinates","180225","2020-10-21","18:00:00",""
"7111142","10.727","0.005","21.194","0.009","7.553","0.003","90","","90","","90","","1717.2","1.3","163","2","163","2","","","","","","","","7","P b a m","-P 2 2ab","55","","","","- C13 H13 Cu F6 N P S3 -","- C13 H13 Cu F N P S3 -","- C52 H52 Cu4 F4 N4 P4 S12 -","4","0.5","","Hanton, Lyall R.; Turnbull, Julia M.; Richardson, Christopher; Robinson, Ward T.","Thiophene S-binding of a conformationally constrained thiophenophane leading to the formation of a copper(i) coordination polymer","Chemical Communications","2000","","24","2465","","10.1039/b007579p","","","0.71073","MoKα","","0.09","0.0876","","","0.1809","0.1818","","","","","","1.314","","","","has coordinates,has disorder","180225","2020-10-21","18:00:00",""
"7111145","16.6647","0.0006","24.7585","0.0005","19.9024","0.0007","90","","91.224","0.005","90","","8209.7","0.4","173","","173","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C69 H69 Ag8 O34 S8 -","- C69 H43 Ag8 O34 S8 -","- C276 H172 Ag32 O136 S32 -","4","1","","Akdas, Huriye; Graf, Ernest; Hosseini, Mir Wais; De Cian, André; Harrowfield, Jack McB.","Design, synthesis and structural investigation of a 2-D coordination network based on the self-assembly of the tetracarboxylate derivative of tetrathiacalix[4]arene and silver cation","Chemical Communications","2000","","22","2219","","10.1039/b007761p","","","0.71073","Mo-Kα","","0.191","0.059","","0.487","","0.062","","","38.167","","","1.119","","","","has coordinates","180225","2020-10-21","18:00:00",""
"7111146","16.2594","0.0008","20.0097","0.001","9.2417","0.0005","90","","90","","90","","3006.7","0.3","173","2","173","2","","","","","","","","3","C m c 21","C 2c -2","36","","","","- C36 H20 Cl8 -","- C36 H20 Cl8 -","- C144 H80 Cl32 -","4","0.5","","Sygula, Andrzej; Marcinow, Zbigniew; Guzei, Ilia; Rabideau, Peter W.; Fronczek, Frank R.","The first crystal structure characterization of a semibuckminsterfullerene, and a novel synthetic route","Chemical Communications","2000","","24","2439","","10.1039/b007771m","","","0.71073","MoKα","","0.081","0.0761","","","0.2122","0.2177","","","","","","1.068","","","","has coordinates","180225","2020-10-21","18:00:00",""
"7111155","13.087","0.0006","26.1626","0.0003","24.449","0.001","90","","97.616","0.003","90","","8297.2","0.5","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C71.5 H129 O12 Si9 Ti -","- C71.5 H125 O12 Si9 Ti -","- C286 H500 O48 Si36 Ti4 -","4","1","","Edelmann, Frank T.; Gießmann, Stephan; Fischer, Axel","A novel route to advanced model systems for silica-immobilized olefin polymerization catalysts","Chemical Communications","2000","","21","2153","","10.1039/b007854i","","","0.71073","MoKα","","0.086","0.0538","","","0.1355","0.1532","","","","","","1.022","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7111156","12.0428","0.0003","22.4605","0.0009","25.5404","0.0009","106.667","0.003","99.602","0.003","100.045","0.003","6342.2","0.4","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C110.5 H200 O24 Si16 Ti -","- C110.5 H196 O24 Si16 Ti -","- C221 H392 O48 Si32 Ti2 -","2","1","","Edelmann, Frank T.; Gießmann, Stephan; Fischer, Axel","A novel route to advanced model systems for silica-immobilized olefin polymerization catalysts","Chemical Communications","2000","","21","2153","","10.1039/b007854i","","","0.71073","MoKα","","0.1335","0.0802","","","0.1635","0.1943","","","","","","1.043","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7111157","61.6208","0.0006","15.6174","0.0006","15.3123","0.0009","90","","90","","90","","14735.9","1","143","2","143","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C110 H202 O27 Si16 Ti3 -","- C110 H202 O27 Si16 Ti3 -","- C440 H808 O108 Si64 Ti12 -","4","1","","Edelmann, Frank T.; Gießmann, Stephan; Fischer, Axel","A novel route to advanced model systems for silica-immobilized olefin polymerization catalysts","Chemical Communications","2000","","21","2153","","10.1039/b007854i","","","0.71073","MoKα","","0.1851","0.1189","","","0.2995","0.345","","","","","","1.061","","","","has coordinates","180225","2020-10-21","18:00:00",""
"7111165","14.9284","0.0012","20.1058","0.0015","18.9613","0.0015","90","","100.73","0.001","90","","5591.7","0.8","203","2","203","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C50 H75 Ga5 Pt2 -","- C50 H75 Ga5 Pt2 -","- C200 H300 Ga20 Pt8 -","4","1","","Weiß, Dana; Winter, Manuela; Fischer, Roland A.; Yu, Chen; Wichmann, Karin; Frenking, Gernot","[Pt2(GaCp*)2(μ2-GaCp*)3]: structure and bonding situation of the first homoleptic platinum complex with terminal and bridging Cp*Ga ligands","Chemical Communications","2000","","24","2495","","10.1039/b008133g","","","0.71073","MoKα","","0.0842","0.0425","","","0.0758","0.0879","","","","","","0.959","","","","has coordinates,has disorder","180225","2020-10-21","18:00:00",""
"7115104","8.234","0.001","9.768","0.002","8.85","0.002","90","","109.51","0.01","90","","670.9","0.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","zinc phosphonate-aminopropionate","","- C3 H6 N O5 P Zn -","- C3 H6 N O5 P Zn -","- C12 H24 N4 O20 P4 Zn4 -","4","1","","Hartman, Stacy J.; Todorov, Evgeny; Cruz, Carlos; Sevov, Slavi C.","Frameworks of amino acids: synthesis and characterization of two zinc phosphono-amino-carboxylates with extended structures","Chemical Communications","2000","","13","1213","","10.1039/b001275k","","","0.71073","MoKα","","0.0598","0.0473","","","0.143","0.1487","","","","","","1.24","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115105","5.2022","0.0006","35","0.003","8.1165","0.0004","90","","94.156","0.015","90","","1473.9","0.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","zinc phosphonate-aminobutyrate","","- C4 H8 N O5 P Zn -","- C4 H8 N O5 P Zn -","- C32 H64 N8 O40 P8 Zn8 -","8","2","","Hartman, Stacy J.; Todorov, Evgeny; Cruz, Carlos; Sevov, Slavi C.","Frameworks of amino acids: synthesis and characterization of two zinc phosphono-amino-carboxylates with extended structures","Chemical Communications","2000","","13","1213","","10.1039/b001275k","","","0.71073","MoKα","","0.2714","0.0845","","","0.1596","0.2129","","","","","","0.835","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115106","17.4715","0.0015","9.8009","0.0011","20.0372","0.0008","90","","90.004","0.006","90","","3431.1","0.5","183","2","183","2","","","","","","","","5","P 1 n 1","P -2yac","7","","","","- C62 H92 Br Cl8 N7 -","- C62 H98 Br Cl8 N7 -","- C124 H196 Br2 Cl16 N14 -","2","1","","Cafeo, Grazia; Kohnke, Franz H.; Torre, Giovanna L. La; White, Andrew J. P.; Williams, David J.","The complexation of halide ions by a calix[6]pyrrole","Chemical Communications","2000","","13","1207","","10.1039/b002239j","","","1.54178","CuKα","","0.0555","0.054","","0.1447","0.1417","","","","1.051","1.058","1.058","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7115107","17.5921","0.0009","9.9697","0.0007","20.0503","0.0011","90","","90.55","0.004","90","","3516.4","0.4","293","2","293","2","","","","","","","","4","P 1 n 1","P -2yac","7","","","","- C62 H98 Cl9 N7 -","- C62 H98 Cl9 N7 -","- C124 H196 Cl18 N14 -","2","1","","Cafeo, Grazia; Kohnke, Franz H.; Torre, Giovanna L. La; White, Andrew J. P.; Williams, David J.","The complexation of halide ions by a calix[6]pyrrole","Chemical Communications","2000","","13","1207","","10.1039/b002239j","","","1.54178","CuKα","","0.0637","0.0534","","0.1635","0.1474","","","","1.05","1.077","1.077","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7115108","10.0838","0.0017","20.023","0.003","22.504","0.004","95.518","0.003","95.25","0.003","93.827","0.004","4490.6","1.3","300","2","300","2","","","","","","","","5","P -1","-P 1","2","","","","- C92 H72 N16 O8 Ru4 -","- C92 H72 N16 O8 Ru4 -","- C184 H144 N32 O16 Ru8 -","2","1","","Ren, Tong; Zou, Gang; Alvarez, Julio C.","Facile electronic communication between bimetallic termini bridged by elemental carbon chains","Chemical Communications","2000","","13","1197","","10.1039/b002777o","","","0.71073","MoKα","","0.1594","0.0747","","","0.1852","0.2116","","","","","","0.821","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115109","9.8632","0.0004","18.413","0.001","17.507","0.001","90","","90","","90","","3179.5","0.3","170","","170","","","","","","","","[Ti(NBu-t)(N2NN')] + H2N-2,6-C6H3Pri2 in C6D6","5","P b c m","-P 2c 2b","57","","[Ti(N-2,6-C6H3Pri2)(N2NN')]","","- C28 H49 N5 Si2 Ti -","- C28 H48.5 N5 Si2 Ti -","- C112 H194 N20 Si8 Ti4 -","4","0.5","","Skinner, Michael E. G.; Cowhig, David A.; Mountford, Philip","A new and versatile diamide‒diamine donor ligand set in early transition metal chemistry","Chemical Communications","2000","","13","1167","","10.1039/b002455o","","","0.71069","MoKα","","","0.0574","","","0.0434","","","","","1.1174","1.1174","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7115110","8.428","0.0001","14.338","0.0004","21.502","0.0006","90","","93.295","0.002","90","","2594.02","0.11","150","","150","","","","","","","","[Zr(CH2SiMe3)2Cl2] + H2N2NN'","6","P 1 21/n 1","-P 2yn","14","","[Zr(N2NN')Cl2]","","- C19 H35 Cl2 N4 Si2 Zr -","- C19 H35 Cl2 N4 Si2 Zr -","- C76 H140 Cl8 N16 Si8 Zr4 -","4","1","","Skinner, Michael E. G.; Cowhig, David A.; Mountford, Philip","A new and versatile diamide–diamine donor ligand set in early transition metal chemistry","Chemical Communications","2000","","13","1167","","10.1039/b002455o","","","0.71069","MoKα","","","0.0278","","","0.0269","","","","","1.099","1.099","","","","","has coordinates","288252","2023-12-12","14:26:25",""
"7115111","17.024","0.006","29.192","0.007","11.183","0.004","90","","90","","90","","5558","3","296.2","","296.2","","","","","","","","","4","F d d 2","F 2 -2d","43","","","","- C16 H14 N2 O2 -","- C16 H14 N2 O2 -","- C256 H224 N32 O32 -","16","1","","Sakamoto, Masami; Kinbara, Ai; Yagi, Tadao; Mino, Takashi; Fujita, Tsutomu; Yamaguchi, Kentaro","A novel photocycloaddition of substituted pyridines with benzofuran","Chemical Communications","2000","","13","1201","","10.1039/b002396p","","","1.5418","CuKα","","","0.0584","","","0.0658","","","","","3.193","3.193","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7115112","9.903","0.002","10.132","0.002","7.43","0.001","91.75","0.01","105.73","0.02","108.74","0.01","673.9","0.2","296.2","","296.2","","","","","","","","","4","P -1","-P 1","2","","","","- C16 H14 N2 O2 -","- C16 H14 N2 O2 -","- C32 H28 N4 O4 -","2","1","","Sakamoto, Masami; Kinbara, Ai; Yagi, Tadao; Mino, Takashi; Fujita, Tsutomu; Yamaguchi, Kentaro","A novel photocycloaddition of substituted pyridines with benzofuran","Chemical Communications","2000","","13","1201","","10.1039/b002396p","","","1.5418","CuKα","","","0.0546","","","0.066","","","","","5.068","5.068","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7115113","14.655","0.001","10.656","0.001","13.976","0.001","90","","100.25","0.01","90","","2147.7","0.3","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","[9]-thiohelicene","[9]-thiohelicene","","- C28 H12 S5 -","- C28 H12 S5 -","- C112 H48 S20 -","4","0.5","","Caronna, Tullio; Sinisi, Roberta; Malpezzi, Luciana; Meille, Stefano V.; Mele, Andrea; Catellani, Marinella","Photochemical synthesis and structural properties of high membered thiohelicenes","Chemical Communications","2000","","13","1139","","10.1039/b002581j","","","1.54178","CuKα","","0.0487","0.0423","","","0.1218","0.1248","","","","","","1.071","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115114","30.806","0.0007","30.806","0.0007","30.806","0.0007","90","","90","","90","","29235.2","1.2","180","2","180","2","","","","","","","","5","I a -3","-I 2b 2c 3","206","","","","- C79 H74 N12 O Zn4 -","- C77.94 H66 N12 O Zn4 -","- C1247.04 H1056 N192 O16 Zn64 -","16","0.333333","","Davies, Robert P.; Linton, David J.; Snaith, Ronald; Wheatley, Andrew E. H.","Selective oxygen capture in lithium zincate chemistry: the syntheses and solid-state structures of (μ-O)Zn4[N(2-C5H4N)Bz]6 and But(μ3-O)Li3(μ6-O)Zn3[N(2-C5H4N)Me]6 (Bz = benzyl)","Chemical Communications","2000","","18","1819","","10.1039/b005238h","","","0.71069","MoKα","","0.1941","0.0849","","","0.1987","0.2608","","","","","","0.993","","","","has coordinates,has disorder","180265","2020-10-21","18:00:00",""
"7115115","16.964","0.002","16.964","0.002","16.964","0.002","90","","90","","90","","4881.9","1","180","2","180","2","","","","","","","","6","P 21 3","P 2ac 2ab 3","198","Compound X","","","- C44 H59 Li3 N12 O3 Zn3 -","- C43.96 H58.92 Li3 N12 O2.99 Zn3 -","- C175.84 H235.68 Li12 N48 O11.96 Zn12 -","4","0.333333","","Davies, Robert P.; Linton, David J.; Snaith, Ronald; Wheatley, Andrew E. H.","Selective oxygen capture in lithium zincate chemistry: the syntheses and solid-state structures of (μ-O)Zn4[N(2-C5H4N)Bz]6 and But(μ3-O)Li3(μ6-O)Zn3[N(2-C5H4N)Me]6 (Bz = benzyl)","Chemical Communications","2000","","18","1819","","10.1039/b005238h","","","0.71069","MoKα","","0.0827","0.0744","","","0.2093","0.2168","","","","","","1.19","","","","has coordinates,has disorder","180265","2020-10-21","18:00:00",""
"7115116","14.822","0.001","7.7784","0.0006","17.655","0.001","90","","107.73","0.002","90","","1938.8","0.2","173.2","","173.2","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C20 H28 Cr N2 O -","- C20 H28 Cr N2 O -","- C80 H112 Cr4 N8 O4 -","4","1","","Jandciu, Eric W.; Legzdins, Peter; McNeil, W. Stephen; Patrick, Brian O.; Smith, Kevin M.","Cr(NAr)(O)(NPri2)(Ar): a strongly-bent monoimido complex resulting from nitrosyl ligand cleavage","Chemical Communications","2000","","18","1809","","10.1039/b004340k","","","0.7107","MoKα","","0.0884","0.0884","","0.1335","","0.1335","","","1.176","","","1.176","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7115117","16.63","0.05","16.62","0.09","16.01","0.03","90","","90","","120","","3832","2","293","2","293","2","","","","","","","","4","P 3","P 3","143","","","","- C56 H56 N12 O15 -","- C53 H51 N11 O15 -","- C159 H153 N33 O45 -","3","1","","Mukhopadhyay, Pritam; Bharadwaj, Parimal K.; Savitha, G.; Krishnan, Anu; Das, Puspendu K.","The first D‒π‒A octupolar cryptand molecule to exhibit bulk non-linearity","Chemical Communications","2000","","18","1815","","10.1039/b004679p","","","0.71073","MoKα","","0.1122","0.0457","","","0.1027","0.1459","","","","","","1.289","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115118","10.7751","0.0003","16.2798","0.0007","11.6992","0.0003","90","","102.264","0.002","90","","2005.4","0.12","293","2","293","2","","","","","","","synthesis as described","4","P 1 21/n 1","-P 2yn","14","[(CtBu)3P3Se3]","","","- C15 H27 P3 Se3 -","- C15 H27 P3 Se3 -","- C60 H108 P12 Se12 -","4","1","","Hitchcock, Peter B.; Nixon, John F.; Sakarya, Nurgün","Syntheses of the novel cage compounds P3Se3C3But3 and P3Se4C3But3 and an unusual insertion reaction of [PtCl2(PMe3)] into the Se‒Se bond of the latter to give the six-coordinate Pt(iv) complex [PtCl2(PMe3)P3Se4C3But3]","Chemical Communications","2000","","18","1745","","10.1039/b005123n","","x-ray","0.71073","MoKα","","0.0551","0.038","","","0.0826","0.0901","","","","","","1.048","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115119","9.902","0.002","10.34","0.004","12.76","0.004","69.17","","71.11","0.02","61.57","","1054.7","0.6","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C15 H27 P3 Se4 -","- C15 H27 P3 Se4 -","- C30 H54 P6 Se8 -","2","1","","Hitchcock, Peter B.; Nixon, John F.; Sakarya, Nurgün","Syntheses of the novel cage compounds P3Se3C3But3 and P3Se4C3But3 and an unusual insertion reaction of [PtCl2(PMe3)] into the Se‒Se bond of the latter to give the six-coordinate Pt(iv) complex [PtCl2(PMe3)P3Se4C3But3]","Chemical Communications","2000","","18","1745","","10.1039/b005123n","","","0.71073","MoKα","","0.0568","0.0367","","","0.0758","0.0868","","","","","","1.044","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115120","34.5455","0.0006","34.5455","0.0006","16.7221","0.0002","90","","90","","120","","17282.4","0.5","293","2","293","2","","","","","","","synthesis as described","6","R -3 :H","-R 3","148","sep699","","","- C18 H36 Cl2 P4 Pt Se4 -","- C18 H36 Cl2 P4 Pt Se4 -","- C324 H648 Cl36 P72 Pt18 Se72 -","18","1","","Hitchcock, Peter B.; Nixon, John F.; Sakarya, Nurgün","Syntheses of the novel cage compounds P3Se3C3But3 and P3Se4C3But3 and an unusual insertion reaction of [PtCl2(PMe3)] into the Se‒Se bond of the latter to give the six-coordinate Pt(iv) complex [PtCl2(PMe3)P3Se4C3But3]","Chemical Communications","2000","","18","1745","","10.1039/b005123n","","x-ray","0.71073","MoKα","","0.0692","0.0386","","","0.0825","0.095","","","","","","1.036","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115121","10.216","0.007","11.372","0.006","11.788","0.007","82.76","0.01","72.7","0.01","75.57","0.01","1264.3","1.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C48 H32 Co2 N8 O17 V6 -","- C48 H32 Co2 N8 O17 V6 -","- C48 H32 Co2 N8 O17 V6 -","1","0.5","","Zhang, Xian-Ming; Tong, Ming-Liang; Chen, Xiao-Ming","Hydrothermal synthesis and crystal structures of two bimetallic chain-like and cluster complexes [{Co(phen)2}2V6O17]n and [{Cu(phen)2}4V10O29]·6H2O","Chemical Communications","2000","","18","1817","","10.1039/b005880g","","","0.71073","MoKα","","0.11","0.0671","","","0.1664","0.1916","","","","","","1.021","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115122","14.726","0.003","14.612","0.003","25.31","0.005","90","","105.81","0.03","90","","5240","2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C96 H76 Cu4 N16 O35 V10 -","- C96 H64 Cu4 N16 O35 V10 -","- C192 H128 Cu8 N32 O70 V20 -","2","0.5","","Zhang, Xian-Ming; Tong, Ming-Liang; Chen, Xiao-Ming","Hydrothermal synthesis and crystal structures of two bimetallic chain-like and cluster complexes [{Co(phen)2}2V6O17]n and [{Cu(phen)2}4V10O29]·6H2O","Chemical Communications","2000","","18","1817","","10.1039/b005880g","","","0.71073","MoKα","","0.1093","0.0522","","","0.1324","0.1547","","","","","","0.956","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115123","11.957","0.004","12.383","0.003","17.046","0.006","88.36","0.02","74.21","0.02","84.1","0.02","2415.8","1.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C45 H42 Cl4 N4 O P2 Re -","- C45 H42 Cl4 N4 O P2 Re -","- C90 H84 Cl8 N8 O2 P4 Re2 -","2","1","","Bhattacharyya, Sibaprasad; Chakraborty, Indranil; Dirghangi, Bimal Kumar; Chakravorty, Animesh","Oxygen atom transfer from RevO to tertiary diphosphines: spacer length and chemical differentiation of products","Chemical Communications","2000","","18","1813","","10.1039/b004565i","","","0.71073","MoKα","","0.0648","0.0467","","0.1533","0.1273","","","","1.125","1.115","1.115","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7115124","10.11","0.006","10.668","0.005","20.76","0.007","89.47","0.03","80.08","0.04","81.41","0.04","2180.5","1.8","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C44 H40 Cl4 N4 O P2 Re -","- C44 H40 Cl4 N4 O P2 Re -","- C88 H80 Cl8 N8 O2 P4 Re2 -","2","1","","Bhattacharyya, Sibaprasad; Chakraborty, Indranil; Dirghangi, Bimal Kumar; Chakravorty, Animesh","Oxygen atom transfer from RevO to tertiary diphosphines: spacer length and chemical differentiation of products","Chemical Communications","2000","","18","1813","","10.1039/b004565i","","","0.71073","MoKα","","0.0755","0.0542","","0.1477","0.1279","","","","1.07","1.053","1.053","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7115125","35.353","0.011","12.73","0.006","16.84","0.007","90","","104.68","0.03","90","","7331","5","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C35 H31 Cl4 N4 O2 P2 Re -","- C35 H31 Cl4 N4 O2 P2 Re -","- C280 H248 Cl32 N32 O16 P16 Re8 -","8","1","","Bhattacharyya, Sibaprasad; Chakraborty, Indranil; Dirghangi, Bimal Kumar; Chakravorty, Animesh","Oxygen atom transfer from RevO to tertiary diphosphines: spacer length and chemical differentiation of products","Chemical Communications","2000","","18","1813","","10.1039/b004565i","","","0.71073","MoKα","","0.12","0.0585","","0.1369","0.106","","","","1.115","1.129","1.129","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7115126","5.931","0.001","6.2","0.001","15.951","0.003","84.3","0.04","89.97","0.04","62.28","0.04","516","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","(1R*,2S*,4R*)-4-tert-butyl-2-hydroxy-1-cyclopentanecarboxylic acid","","- C10 H18 O3 -","- C10 H18 O3 -","- C20 H36 O6 -","2","1","","Kálmán, Alajos; Fábián, László; Argay, Gyula","Supramolecular similarities between a diastereomer pair and their truncated derivative: common tetrameric synthon and isostructurality","Chemical Communications","2000","","22","2255","","10.1039/b005422o","","","0.7107","MoKα","","0.091","0.0477","","","0.1249","0.1776","","","","","","1.147","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115127","16.862","0.002","6.104","0.001","10.519","0.003","90","","107.03","0.04","90","","1035.2","0.4","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(1S*,2R*,4R*)-4-tert-butyl-2-hydroxy-1-cyclopentanecarboxylic acid","","- C10 H18 O3 -","- C10 H18 O3 -","- C40 H72 O12 -","4","1","","Kálmán, Alajos; Fábián, László; Argay, Gyula","Supramolecular similarities between a diastereomer pair and their truncated derivative: common tetrameric synthon and isostructurality","Chemical Communications","2000","","22","2255","","10.1039/b005422o","","","1.54178","CuKα","","0.0732","0.0541","","","0.1415","0.1688","","","","","","0.951","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115128","11.693","0.002","7.225","0.001","7.902","0.002","90","","103.7","0.03","90","","648.6","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","cis(1R*,2S*)-2-hydroxy-1-cyclopentanecarboxamide","","- C6 H11 N O2 -","- C6 H11 N O2 -","- C24 H44 N4 O8 -","4","1","","Kálmán, Alajos; Fábián, László; Argay, Gyula","Supramolecular similarities between a diastereomer pair and their truncated derivative: common tetrameric synthon and isostructurality","Chemical Communications","2000","","22","2255","","10.1039/b005422o","","","1.54178","CuKα","","0.0437","0.0406","","","0.1238","0.1272","","","","","","1.138","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7115129","22.25","0.004","9.1085","0.0017","12.503","0.002","90","","96.359","0.003","90","","2518.3","0.8","173","2","173","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C28 H20 Cd N2 O4 -","- C28 H20 Cd N2 O4 -","- C112 H80 Cd4 N8 O16 -","4","1","","Lin, Wenbin; Ma, Ling; Evans, Owen R.","NLO-active zinc(ii) and cadmium(ii) coordination networks with 8-fold diamondoid structures","Chemical Communications","2000","","22","2263","","10.1039/b007335k","","","0.71073","MoKα","","0.1012","0.0845","","","0.2175","0.2319","","","","","","1.039","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115130","21.522","0.003","8.8667","0.0011","13.0464","0.0016","90","","95.207","0.002","90","","2479.4","0.6","173","2","173","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C28 H20 N2 O4 Zn -","- C28 H20 N2 O4 Zn -","- C112 H80 N8 O16 Zn4 -","4","1","","Lin, Wenbin; Ma, Ling; Evans, Owen R.","NLO-active zinc(ii) and cadmium(ii) coordination networks with 8-fold diamondoid structures","Chemical Communications","2000","","22","2263","","10.1039/b007335k","","","0.71073","MoKα","","0.1105","0.0642","","","0.1422","0.1615","","","","","","0.977","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115131","15.574","0.002","15.574","0.002","10.395","0.002","90","","90","","90","","2521.3","0.7","293","2","293","2","","","","","","","","6","P 4/n m m :2","-P 4a 2a","129","","","","- C32 H69 Ba I Li4 O9 -","- C16 Ba0.5 I0.5 Li2 O4.5 -","- C64 Ba2 I2 Li8 O18 -","4","0.25","","Fromm, Katharina M.; Gueneau, Estelle D.; Goesmann, H.","Synthesis and crystal structure of [IBa(OBut)4{Li(thf)}4(OH)]: a mixed ligand heterometallic cluster with an unusual low coordination number for barium","Chemical Communications","2000","","22","2187","","10.1039/b005638n","","","0.71073","MoKα","","0.1138","0.0807","","","0.2014","0.2343","","","","","","1.033","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7115132","17.863","0.001","13.7651","0.0008","19.835","0.001","90","","98.235","0.002","90","","4826.9","0.5","296.2","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C24 H24 B Bi F4 -","- C24 H24 B Bi F4 -","- C192 H192 B8 Bi8 F32 -","8","2","","Matano, Yoshihiro","First synthesis of alkynyltriphenylbismuthonium salts and their dual reaction modes in sulfonylation","Chemical Communications","2000","","22","2233","","10.1039/b006881k","","","0.7107","MoKα","","","0.0393","","","","0.1078","","","","","","0.845","","","","has coordinates","182221","2020-10-21","18:00:00",""
"7115133","18.598","0.004","27.575","0.008","37.106","0.008","90","","92.318","0.01","90","","19014","8","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C115 H184 Ca4 Co4 N8 O85 -","- C115 H104 Ca4 Co4 N8 O85 -","- C460 H416 Ca16 Co16 N32 O340 -","4","0.5","","Harrison, Roger G.; Dalley, N. Kent; Nazarenko, Alex Y.","Metal-promoted assembly of organic-based cages into a porous material","Chemical Communications","2000","","15","1387","","10.1039/b003187i","","","0.71073","MoKα","","0.1352","0.0889","","0.3184","0.2501","","","","1.055","1.113","1.113","","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115134","16.77","0.005","17.049","0.006","24.405","0.009","88.12","0.03","85.11","0.03","69.756","0.015","6523","4","150","2","220","2","","","","","","","","5","P -1","-P 1","2","","","","- C83.5 H155 Cl3.5 Cr12 O53 -","- C80 H148 Cr12 O52 -","- C160 H296 Cr24 O104 -","2","1","","Parsons, Simon; Smith, Andrew A.; Winpenny, Richard E. P.","A novel dodecanuclear chromium(iii) cage: structural control by choice of leaving group","Chemical Communications","2000","","7","579","","10.1039/b001140l","","","1.54184","CuKα","","0.1918","0.0975","","","0.2196","0.2644","","","","","","0.944","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"7115135","13.2214","0.0006","17.0958","0.0008","18.0413","0.0008","90","","90","","90","","4077.9","0.3","100","","100","","","","","","","","see paper","4","P 21 21 21","P 2ac 2ab","19","cyclo[(L)Pro-AMB]~3~ water solvate","cyclo-tris[(L)-prolyl-alpha-3-amino-4(methoxycarbonyl)benzoyl] water solvate","","- C42 H44 N6 O13 -","- C42 H42 N6 O13 -","- C168 H168 N24 O52 -","4","1","","Kubik, Stefan; Goddard, Richard","Intramolecular conformational control in a cyclic peptide composed of alternating l-proline and substituted 3-aminobenzoic acid subunits","Chemical Communications","2000","","7","633","","10.1039/b000568l","","","0.71073","MoKα","","0.1317","0.0595","","","0.1229","0.1438","","","","","","0.978","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115136","10.5607","0.0006","17.6047","0.001","22.7991","0.0013","90","","90","","90","","4238.8","0.4","100","","100","","","","","","","","see paper","4","P 21 21 21","P 2ac 2ab","19","cyclo[(L)Pro-AMB]~3~ acetone solvate","cyclo-tris[(L)-prolyl-alpha-3-amino-4(methoxycarbonyl)-benzoyl] acetone solvate","","- C45 H48 N6 O13 -","- C45 H48 N6 O13 -","- C180 H192 N24 O52 -","4","1","","Kubik, Stefan; Goddard, Richard","Intramolecular conformational control in a cyclic peptide composed of alternating l-proline and substituted 3-aminobenzoic acid subunits","Chemical Communications","2000","","7","633","","10.1039/b000568l","","","0.71073","MoKα","","0.1511","0.073","","","0.1439","0.1715","","","","","","0.949","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115137","10.135","0.0002","15.031","0.0004","16.441","0.0005","84.388","0.013","82.94","0.016","76.774","0.015","2413.4","0.2","180","2","180","2","","","","","","","","7","P -1","-P 1","2","bj9949","","","- C73 H76 B2 F8 N2 O41 Ru12 -","- C73 H76 B2 F8 N2 O41 Ru12 -","- C73 H76 B2 F8 N2 O41 Ru12 -","1","0.5","","Johnson, Brian F. G.; Judkins, Catherine M. G.; Matters, Justin M.; Shephard, Douglas S.; Parsons, Simon","New linked and threaded cluster compounds","Chemical Communications","2000","","16","1549","","10.1039/b003291n","","","0.71069","MoKα","","0.0419","0.0286","","","0.0596","0.0636","","","","","","1.04","","","","has coordinates,has disorder","180265","2020-10-21","18:00:00",""
"7115138","19.1672","0.0008","14.8037","0.0006","27.0061","0.0008","90","","90","","90","","7662.9","0.5","180","2","180","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C31 H24 O20 Ru6 -","- C31 H24 O20 Ru6 -","- C248 H192 O160 Ru48 -","8","2","","Johnson, Brian F. G.; Judkins, Catherine M. G.; Matters, Justin M.; Shephard, Douglas S.; Parsons, Simon","New linked and threaded cluster compounds","Chemical Communications","2000","","16","1549","","10.1039/b003291n","","","0.71069","MoKα","","0.0928","0.0682","","0.1796","0.1537","","","","1.019","1.065","1.065","","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115139","9.9611","0.0005","16.669","0.001","18.2217","0.0011","116.565","0.003","90.077","0.003","94.599","0.003","2695.1","0.3","230","2","230","2","","","","","","","","4","P -1","-P 1","2","","","","- C42 H39 O22 Ru6 -","- C42 H39 O22 Ru6 -","- C84 H78 O44 Ru12 -","2","1","","Johnson, Brian F. G.; Judkins, Catherine M. G.; Matters, Justin M.; Shephard, Douglas S.; Parsons, Simon","New linked and threaded cluster compounds","Chemical Communications","2000","","16","1549","","10.1039/b003291n","","","0.71069","MoKα","","0.1177","0.0692","","0.2188","0.1701","","","","1.03","1.081","1.081","","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115140","12.312","0.005","9.58","0.007","52.612","0.016","90","","94.33","0.03","90","","6188","6","220","2","220","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C53 H48 F6 N O22 P Ru6 -","- C53 H48 F6 N O22 P Ru6 -","- C212 H192 F24 N4 O88 P4 Ru24 -","4","1","","Johnson, Brian F. G.; Judkins, Catherine M. G.; Matters, Justin M.; Shephard, Douglas S.; Parsons, Simon","New linked and threaded cluster compounds","Chemical Communications","2000","","16","1549","","10.1039/b003291n","","","0.71073","MoKα","","0.2473","0.129","","0.3657","0.307","","","","1.085","1.335","1.335","","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"7115141","19.2737","0.0009","26.459","0.0012","30.2609","0.0014","90","","93.874","0.001","90","","15396.7","1.2","143","2","143","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","[La3(?3-trenterpy)2(Otf)4(H2O)2](Otf)5.2H2O.2CH3CN","","","- C121 H104 F27 La3 N28 O37 S9 -","- C121 H90 F27 La3 N28 O35 S9 -","- C484 H360 F108 La12 N112 O140 S36 -","4","0.5","","Bretonnière, Yann; Mazzanti, Marinella; Wietzke, Raphael; Pécaut, Jacques","Unprecedented self-assembly of M3L2 trinuclear lanthanide complexes assisted by a flexible tripodal ligand containing terpyridine binding units","Chemical Communications","2000","","16","1543","","10.1039/b004152l","","","0.71073","MoKα","","0.2163","0.0947","","","0.2492","0.2881","","","","","","1.326","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115142","13.108","0.002","15.195","0.002","21.461","0.003","83.57","0.02","76.71","0.02","65.43","0.02","3782.7","1.1","301.2","","301.2","","","","","","","","","5","P -1","-P 1","2","","","","- C78 H72 Au2 O8 P2 -","- C78 H70 Au2 O8 P2 -","- C156 H140 Au4 O16 P4 -","2","1","","Yam, Vivian Wing-Wah; Cheung, Kai-Leung; Yuan, Li-Hua; Wong, Keith Man-Chung; Cheung, Kung-Kai","Synthesis, structural characterization and binding studies of a novel dinuclear gold(i) calix[4]crown acetylide complex","Chemical Communications","2000","","16","1513","","10.1039/b003536j","","","0.7107","MoKalpha","","","0.0546","","","0.0814","","","","","2.164","2.164","","","","","has coordinates","288197","2023-12-08","18:09:39",""
"7115143","14.9859","0.0018","10.4594","0.0008","22.028","0.002","90","","102.073","0.011","90","","3376.4","0.6","160","2","160","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C42 H41 I L O2 Zr -","- C42 H41 Li O2 Zr -","- C168 H164 Li4 O8 Zr4 -","4","1","","Choukroun, Robert; Zhao, Jianshe; Lorber, Christian; Cassoux, Patrick; Donnadieu, Bruno","Li[Cp2Zr(C≡CPh)(η2:1,2-PhC2C≡CPh)]: an anionic zirconium(II) intermediate for carbon–carbon coupling","Chemical Communications (Cambridge, United Kingdom)","2000","","16","1511","1512","10.1039/b004478o","","","0.710733","MoKα","","0.0312","0.0272","","","0.0722","0.0749","","","","","","1.043","","","","has coordinates","275255","2022-05-09","02:42:42",""
"7115144","18.44","0.003","9.831","0.003","25.145","0.004","90","","111.491","0.01","90","","4241.5","1.6","173","2","173","2","","","","","","","","7","P 1 2/n 1","-P 2yac","13","","","","- C33 H48 N2 O5 P2 Si4 W -","- C33 H48 N2 O5 P2 Si4 W -","- C132 H192 N8 O20 P8 Si16 W4 -","4","1","","Streubel, Rainer; Wilkens, Hendrik; Ruthe, Frank; Jones, Peter G.","Unexpected dimerisation of a 2H-azaphosphirene complex","Chemical Communications","2000","","24","2453","","10.1039/b007107m","","","0.71073","MoKα","","0.1494","0.0537","","","0.0581","0.0731","","","","","","0.763","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7115145","10.7691","0.0002","7.0107","0.0002","16.7519","0.0004","90","","91.402","0.002","90","","1264.37","0.05","273","","273","","","","","","","","crystallization from methanol","4","P 1 21/n 1","-P 2yn","14","","1,2,3-Trihydroxybenzene : hexamethylenetetramine","","- C12 H18 N4 O3 -","- C12 H18 N4 O3 -","- C48 H72 N16 O12 -","4","1","","Tremayne, Maryjane; Glidewell, Christopher","Direct-space structure solution from laboratory powder diffraction data of an organic cocrystal: 1,2,3-trihydroxybenzene‒HMTA (1/1)","Chemical Communications","2000","","24","2425","","10.1039/b007189g","powder diffraction","","1.54056","laboratory","","","","","","","","","","5.75","","","","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115146","15.1525","0.0017","21.858","0.002","22.13","0.002","109.449","0.003","93.78","0.003","96.523","0.003","6824.3","1.2","115","2","115","2","","","","","","","","6","P -1","-P 1","2","","","","- C84 H74 Cl40 Mn12 O59 P2 -","- C83.5 H63 Cl40.6 Mn12 O48 P2 -","- C167 H126 Cl81.2 Mn24 O96 P4 -","2","1","","Soler, Monica; Chandra, Swapan K.; Davidson, Ernest R.; Christou, George; Ruiz, Daniel; Hendrickson, David N.","A third isolated oxidation state for the Mn12 family of single-molecule magnets","Chemical Communications","2000","","24","2417","","10.1039/b006519f","","","0.71073","MoKα","","","0.0638","","","","0.0631","","","","","","1.4599","","","","has coordinates,has disorder","180265","2020-10-21","18:00:00",""
"7115147","6.072","0.006","24.506","0.006","14.217","0.003","90","","99.35","0.04","90","","2087","2","180","2","180","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C25 H26 O6 -","- C25 H26 O6 -","- C100 H104 O24 -","4","1","","Kim, Tae-Hyun; Feeder, Neil; Holmes, Andrew B.; Dokolas, Peter; Giles, Mark; Walther, Mathias","Cyclopolymerisation of an oriented 4,6-bis(4-vinylbenzyl)-myo-inositol orthoformate","Chemical Communications","2000","","24","2419","","10.1039/b007057m","","","0.71069","MoKα","","0.1155","0.0559","","0.1257","0.1037","","","","1.014","1.142","1.142","","","","","has coordinates,has disorder","180265","2020-10-21","18:00:00",""
"7115148","18.341","0.002","13.424","0.001","19.033","0.002","90","","110.65","0.01","90","","4385","0.8","173","2","173","2","","","","","","","selfmade","4","P 1 21/c 1","-P 2ybc","14","tetra(disyl)diphosphine","","","- C28 H76 P2 Si8 -","- C28 H76 P2 Si8 -","- C112 H304 P8 Si32 -","4","1","","Hinchley, Sarah L.; Morrison, Carole A.; Rankin, David W. H.; Macdonald, Charles L. B.; Wiacek, Robert J.; Cowley, Alan H.; Lappert, Michael F.; Gundersen, Grete; Clyburne, Jason A. C.; Power, Philip P.","Persistent phosphinyl radicals from a bulky diphosphine: an example of a molecular jack-in-the-box","Chemical Communications","2000","","20","2045","","10.1039/b004889p","","","0.71073","MoKα","","0.0451","0.0375","","0.1203","0.1159","","","","1.705","1.783","1.783","","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115149","12.333","0.003","13.439","0.003","14.021","0.004","109.87","0.01","91.58","0.02","114.21","0.01","1955.2","0.9","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","","","- C35 H54 Al2 Li2 N2 O5 -","- C35 H54 Al2 Li2 N2 O5 -","- C70 H108 Al4 Li4 N4 O10 -","2","1","","Davies, Robert P.; Linton, David J.; Snaith, Ronald; Wheatley, Andrew E. H.","Selective oxygen capture to give a unique mixed-anion lithium aluminate: the synthesis and solid-state structure of {[PhC(O)N(Me)Al(Me)(But)OMe]Li·[PhC(O)N(Me)Al(Me)(OBut)OMe]Li}2","Chemical Communications","2000","","3","193","","10.1039/a909135a","","","1.54178","CuKα","","0.0703","0.064","","","0.1707","0.1766","","","","","","1.031","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115150","26.4161","0.0006","8.0416","0.0001","20.3515","0.0004","90","","111.194","0.001","90","","4030.81","0.13","293","2","293","2","","","","","","","hydrothermal synthesis","6","C 1 2/c 1","-C 2yc","15","","","","- C20 H31 Ga4 N4 O31 P7 -","- C20 H29 Ga4 N4 O31 P7 -","- C80 H116 Ga16 N16 O124 P28 -","4","0.5","","Chen, Ching-Yeh; Lo, Fang-Rey; Kao, Hsien-Ming; Lii, Kwang-Hwa","[Ga4(C10H9N2)2(PO4)(H0.5PO4)2(HPO4)2(H2PO4)2(H2O)2]·H2O: a novel one-dimensional chain structure containing four different types of monophosphate","Chemical Communications","2000","","12","1061","","10.1039/b002182m","","","0.71073","MoKα","","0.0803","0.0429","","0.0903","0.0776","","","","1.068","1.108","1.108","","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115151","13.8843","0.0004","15.7193","0.0004","18.149","0.0006","90","","90","","90","","3961","0.2","120","2","120","2","","","","","","","","7","P n n a","-P 2a 2bc","52","","","","- C9 H17 Ag B11 I Mo O3 -","- C9 H17 Ag B11 I Mo O3 -","- C72 H136 Ag8 B88 I8 Mo8 O24 -","8","1","","Patmore, Nathan J.; Weller, Andrew S.; Steed, Jonathan W.","Transition metal complexes of the weakly coordinating carborane anion [CB11H12]−: the first isolation and structural characterisation of an intermediate in a silver salt metathesis reaction","Chemical Communications","2000","","12","1055","","10.1039/b002585m","","","0.71073","MoKα","","0.0725","0.0563","","","0.1101","0.1145","","","","","","1.229","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115152","10.733","0.011","14.085","0.01","26.138","0.009","90","","90.99","0.05","90","","3951","5","170","2","170","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C28 H60 K2 N4 O3 P2 Se2 -","- C28 H60 K2 N4 O3 P2 Se2 -","- C112 H240 K8 N16 O12 P8 Se8 -","4","1","","Chivers, Tristram; Krahn, Mark; Parvez, Masood","An extended network of twenty-membered K6Se6P4N4 rings: X-ray structure of {[(THF)K[ButN(Se)P(μ-NBut)2P(Se)NBut]K(THF)2]2}\ιnfty","Chemical Communications","2000","","6","463","","10.1039/b000357n","","","0.71069","MoKα","","0.2959","0.064","","","0.1652","0.238","","","","","","1.03","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115153","16.476","0.002","9.142","0.003","21.687","0.005","90","","91.22","0.02","90","","3265.8","1.4","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","[N{C(SiMe3)2(SiMe2py)}(PPh3)]","","","- C32 H43 N Ni P Si3 -","- C32 H43 N Ni P Si3 -","- C128 H172 N4 Ni4 P4 Si12 -","4","1","","Eaborn, Colin; Hill, Michael S.; Hitchcock, Peter B.; Smith, J. David","The first structurally characterised σ-bonded organonickel(i) compound. Crystal structures of [Ni{C(SiMe3)2(SiMe2C5H4N-2)}(PPh3)], [Ni{C(SiMe3)(SiMe2C5H4N-2)(SiMe2O)}]2 and [Pd(μ-Cl){C(SiMe3)2(SiMe2C5H4N-2)}]2","Chemical Communications","2000","","8","691","","10.1039/b000374n","","","0.71073","MoKα","","0.0886","0.049","","","0.102","0.1177","","","","","","1.022","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115154","8.86","0.0008","10.122","0.001","10.6164","0.0011","91.437","0.006","111.283","0.007","92.595","0.005","885.36","0.16","173","2","173","2","","","","","","","synthesis as described","6","P -1","-P 1","2","[{Ni{C(SiMe3)(SiMe2O)(SiMe2C5H4N)}}2]","","","- C26 H50 N2 Ni2 O2 Si6 -","- C26 H50 N2 Ni2 O2 Si6 -","- C26 H50 N2 Ni2 O2 Si6 -","1","0.5","","Eaborn, Colin; Hill, Michael S.; Hitchcock, Peter B.; Smith, J. David","The first structurally characterised σ-bonded organonickel(i) compound. Crystal structures of [Ni{C(SiMe3)2(SiMe2C5H4N-2)}(PPh3)], [Ni{C(SiMe3)(SiMe2C5H4N-2)(SiMe2O)}]2 and [Pd(μ-Cl){C(SiMe3)2(SiMe2C5H4N-2)}]2","Chemical Communications","2000","","8","691","","10.1039/b000374n","","x-ray","0.71073","MoKα","","0.079","0.0655","","","0.1542","0.1599","","","","","","1.179","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115155","13.465","0.005","23.39","0.012","25.032","0.009","90","","90","","90","","7884","6","173","2","173","2","","","","","","","synthesis as described","6","P b c a","-P 2ac 2ab","61","","","","- C28 H56 Cl2 N2 Pd2 Si6 -","- C22.512 H45.024 Cl1.608 N1.608 Pd1.608 Si5.216 -","- C180.096 H360.192 Cl12.864 N12.864 Pd12.864 Si41.728 -","8","1","","Eaborn, Colin; Hill, Michael S.; Hitchcock, Peter B.; Smith, J. David","The first structurally characterised σ-bonded organonickel(i) compound. Crystal structures of [Ni{C(SiMe3)2(SiMe2C5H4N-2)}(PPh3)], [Ni{C(SiMe3)(SiMe2C5H4N-2)(SiMe2O)}]2 and [Pd(μ-Cl){C(SiMe3)2(SiMe2C5H4N-2)}]2","Chemical Communications","2000","","8","691","","10.1039/b000374n","","x-ray","0.71073","MoKα","","0.1539","0.0824","","","0.1875","0.2264","","","","","","0.979","","","","has coordinates,has disorder","180265","2020-10-21","18:00:00",""
"7115156","16.708","0.002","16.708","0.002","16.708","0.002","90","","90","","90","","4664.2","1","293","2","293","2","","","","","","","","4","I -4 3 m","I -4 2 3","217","","","","- As2 H18 O35 V10 -","- As3 O52.5 V15 -","- As12 O210 V60 -","4","0.0833333","","Bu, Wei-Ming; Ye, Ling; Fan, Yu-Guo; Xu, Ji-Qing; Yang, Guo-Yu; Shao, Mei-Cheng","A three-dimensional neutral framework of a novel decavanadium cluster bridged by an AsO4 tetrahedron: [AsVIV8VV2O26(μ-H2O)]·8H2O","Chemical Communications","2000","","14","1279","","10.1039/b003359f","","","0.71073","MoKα","","0.1099","0.0569","","0.1392","0.0775","","","","1.133","1.199","1.199","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7115157","11.4675","0.0004","21.2128","0.0009","16.9247","0.0006","90","","101.769","0.003","90","","4030.5","0.3","173","2","173","2","","","","","","","synthesis as described","4","P 1 21/n 1","-P 2yn","14","[C60(O)F18]","","","- C67 H8 F18 O -","- C67 H8 F18 O -","- C268 H32 F72 O4 -","4","1","","Boltalina, Olga V.; Troshin, Pavel A.; de La Vaissière, Benoit; Fowler, Patrick W.; Sandall, John P. B.; Hitchcock, Peter B.; Taylor, Roger","C60F18O, the first characterised intramolecular fullerene ether","Chemical Communications","2000","","14","1325","","10.1039/b003753m","","x-ray","0.71073","MoKα","","0.0754","0.0515","","","0.1041","0.1139","","","","","","1.108","","","","has coordinates,has disorder","180265","2020-10-21","18:00:00",""
"7115158","32.223","0.0019","32.223","0.0019","20.8273","0.0018","90","","90","","120","","18728","2","193","2","193","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C51 H30 Ag3 Cl6 N14.92 O12 -","- C51 H30 Ag3 Cl6 N14.99 O12 -","- C612 H360 Ag36 Cl72 N179.88 O144 -","12","0.666667","","Bu, Xian-He; Tanaka, Kentaro; Shionoya, Mitsuhiko; Biradha, Kumar; Yamaguchi, Tadashi; Nishimura, Mayumi; Ito, Tasuku","A novel polymeric AgI complex consisting of two three-dimensional networks which are enantiometric and interpenetrating","Chemical Communications","2000","","19","1953","","10.1039/b003183f","","","0.71073","MoKα","","0.1764","0.0848","","","0.2331","0.264","","","","","","1.369","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115159","11.792","0.003","11.993","0.002","12.279","0.004","106.04","0.02","90.24","0.03","106.87","0.03","1590.4","0.8","293","2","293","2","","","","","","","methylene chloride","6","P -1","-P 1","2","","","","- C52 H36 Cl8 N12 O20 Zn -","- C52 H22 Cl8 N12 O20 Zn -","- C52 H22 Cl8 N12 O20 Zn -","1","0.5","","Palacio, Magali; Mansuy-Mouries, Virginie; Loire, Guillaume; Le Barch-Ozette, Karine; Leduc, Philippe; Battioni, Pierrette; Mansuy, Daniel; Barkigia, Kathleen M.; Fajer, Jack","A new general method for selective β-polynitration of porphyrins; preparation and redox properties of Zn-porphyrins bearing one through to eight β-nitro substituents and X-ray structure of the first Zn β-pernitro porphyrin","Chemical Communications","2000","","19","1907","","10.1039/b004160m","","","1.54178","CuKα","","0.2087","0.0936","","0.3169","0.2343","","","","1.031","1.18","1.18","","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115160","13.8826","0.0015","12.8019","0.0014","25.952","0.003","90","","100.306","0.002","90","","4537.9","0.9","98","2","98","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C55 H23 F15 Mn N4 O P -","- C55 H23 F15 Mn N4 O P -","- C220 H92 F60 Mn4 N16 O4 P4 -","4","1","","Bendix, Jesper; Gray, Harry B.; Golubkov, Galina; Gross, Zeev","High-field (high-frequency) EPR spectroscopy and structural characterization of a novel manganese(iii) corrole","Chemical Communications","2000","","19","1957","","10.1039/b006299p","","","0.71073","MoKα","","0.1167","0.0443","","","0.0628","0.0754","","","","","","0.857","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7115161","40.78","0.02","15.808","0.005","12.336","0.004","90","","98.48","0.02","90","","7865","5","293","2","293","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C68 H84 B5 F20 N5 O8 -","- C68 H84 B4 F16 N5 O12 -","- C272 H336 B16 F64 N20 O48 -","4","1","","Loeb, Stephen J.; Wisner, James A.","[2]Rotaxane molecular shuttles employing 1,2-bis(pyridinium)ethane binding sites and dibenzo-24-crown-8 ethers","Chemical Communications","2000","","19","1939","","10.1039/b004784h","","","0.71073","MoKα","","0.1982","0.0997","","","0.2451","0.2999","","","","","","0.929","","","","has coordinates,has disorder","180265","2020-10-21","18:00:00",""
"7115162","11.8709","0.0002","20.8196","0.0003","21.6065","0.0004","90","","98.715","0.0011","90","","5278.34","0.15","150","2","150","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","[1-(pyrid-2-yl)-3-(2',5'-dimethoxyphen-1-yl)pyrazole][hydrido- tris-(3-cyclohexylpyrazol-1-yl}borato]copper(II) tetrafluoroborate dichloroform solvate","","- C45 H57 B2 Cl6 Cu F4 N9 O2 -","- C45 H57 B2 Cl6 Cu F4 N9 O2 -","- C180 H228 B8 Cl24 Cu4 F16 N36 O8 -","4","1","","Liu, Xiaoming; Kilner, Colin A.; Thornton-Pett, Mark; Halcrow, Malcolm A.; Yellowlees, Lesley J.; Chia, Li Mei Lindy; Trofimenko, Swiatoslaw","An intramolecular π‒π interaction has no effect on the lifetime of an aryl radical cation","Chemical Communications","2000","","19","1947","","10.1039/b006005o","","","0.71073","MoKα","","0.0704","0.0527","","","0.1358","0.1508","","","","","","1.019","","","","has coordinates,has disorder","180265","2020-10-21","18:00:00",""
"7115163","7.976","0.001","10.444","0.001","16.887","0.001","100.22","0.01","99.23","0.01","94.71","0.01","1357.6","0.2","298","2","573","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H34 N4 O8 Pb -","- C20 H34 N4 O8 Pb -","- C40 H68 N8 O16 Pb2 -","2","1","","Hamill, Jennifer T.; Hardacre, Chris; Nieuwenhuyzen, Mark; Seddon, Kenneth R.; Thompson, Sarah A.; Ellis, Brian","Comment on the preparation of the ionic liquid 1-ethyl-3-methylimidazolium ethanoate: a unique monomeric, homoleptic pentacoordinate lead ethanoate complex","Chemical Communications","2000","","19","1929","","10.1039/b005095o","","","0.71073","MoKα","","0.0948","0.0556","","","0.1365","0.1815","","","","","","1.051","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115164","9.3949","0.0002","13.779","0.0003","14.2939","0.0003","90","","99.33","0.002","90","","1825.9","0.07","123.2","","273.2","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H54 Al2 N2 P2 Si4 -","- C26 H56 Al2 N2 P2 Si4 -","- C104 H224 Al8 N8 P8 Si16 -","4","1","","Andrews, Philip C.; Raston, Colin L.; Roberts, Brett A.","Stabilised (H2)Al‒E(H)R species, E = P or As, R− = C(SiMe3)2(6-Me-2-pyridyl)−","Chemical Communications","2000","","19","1961","","10.1039/b003990j","","","0.7107","MoKα","","0.057","0.0494","","0.0557","","0.0512","","","3.242","","","2.823","","","","has coordinates","206958","2020-10-21","18:00:00",""
"7115165","9.4334","0.0002","13.7645","0.0003","14.4634","0.0002","90","","99.734","0.001","90","","1850.98","0.06","123.2","","273.2","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C13 H27 Al As N Si2 -","- C26 H54 Al2 As2 N2 Si4 -","- C104 H216 Al8 As8 N8 Si16 -","4","1","","Andrews, Philip C.; Raston, Colin L.; Roberts, Brett A.","Stabilised (H2)Al‒E(H)R species, E = P or As, R− = C(SiMe3)2(6-Me-2-pyridyl)−","Chemical Communications","2000","","19","1961","","10.1039/b003990j","","","0.7107","MoKα","","0.0295","0.0295","","0.03","","0.03","","","2.368","","","2.368","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7115166","17.974","0.0006","21.189","0.0009","29.793","0.001","90","","90","0.01","90","","11346.7","0.7","294","","294","","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C57 H49 F12 N6 O3 P2 Ru -","- C57 H38 F12 N6 O3 P2 Ru -","- C456 H304 F96 N48 O24 P16 Ru8 -","8","1","","Baranoff, Etienne; Collin, Jean-Paul; Furusho, Yoshio; Laemmel, Anne-Chantal; Sauvage, Jean-Pierre","A photochromic system based on photochemical or thermal chelate exchange on Ru(phen)2L2+ (L = diimine or dinitrile ligand)","Chemical Communications","2000","","19","1935","","10.1039/b004982o","","","0.71073","Mo-Kα","","0.187","0.066","","0.848","","0.095","","","9.82","","","1.553","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115167","9.4057","0.0006","13.8445","0.0011","18.9676","0.0014","92.243","0.004","99.513","0.004","103.536","0.004","2360.5","0.3","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H31 N2 O3 -","- C26 H31 N2 O3 -","- C104 H124 N8 O12 -","4","2","","Jones, Raymond C. F.; Martin, Jason N.; Smith, Paul; Gelbrich, Tomas; Light, Mark E.; Hursthouse, Michael B.","Synthesis of ene-1,1-diamines and pyrrolo[1,2-a]imidazolediones by 4,5-dihydroimidazole N-oxide cycloaddition and isoxazoline ring opening","Chemical Communications","2000","","19","1949","","10.1039/b005530l","","","0.71073","MoKα","","0.1129","0.0621","","","0.1511","0.1803","","","","","","1.011","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115168","26.9087","0.001","6.8778","0.0004","24.978","0.001","90","","106.211","0.003","90","","4438.9","0.4","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C25 H30 N2 O3 -","- C25 H30 N2 O3 -","- C200 H240 N16 O24 -","8","1","","Jones, Raymond C. F.; Martin, Jason N.; Smith, Paul; Gelbrich, Tomas; Light, Mark E.; Hursthouse, Michael B.","Synthesis of ene-1,1-diamines and pyrrolo[1,2-a]imidazolediones by 4,5-dihydroimidazole N-oxide cycloaddition and isoxazoline ring opening","Chemical Communications","2000","","19","1949","","10.1039/b005530l","","","0.71073","MoKα","","0.1882","0.0662","","","0.0909","0.1059","","","","","","1.007","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115169","6.5728","0.0004","6.4941","0.0003","18.299","0.001","90","","94.246","0.008","90","","778.94","0.07","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- Mo Sb2 Se -","- Mo Sb2 Se -","- Mo8 Sb16 Se8 -","8","2","","Kleinke, Holger","Replacement of selenium by antimony in MoSe2: interconnection of the MoSbSe layers by Sb‒Sb bonding","Chemical Communications","2000","","19","1941","","10.1039/b005062h","","","0.71073","MoKα","","0.0384","0.0205","","0.0468","0.0437","","","","1.038","1.229","1.229","","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115170","10.54","0.008","34.655","0.007","32.571","0.005","90","","90.19","0.04","90","","11897","10","200","2","200","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C53 H30 Cl3 N O16 P2 Ru6 Sn -","- C53 H30 Cl3 N O16 P2 Ru6 Sn -","- C424 H240 Cl24 N8 O128 P16 Ru48 Sn8 -","8","2","","Hermans, Sophie; Johnson, Brian F. G.","High yield synthesis and crystal structures of the Ru6‒Sn cluster compounds [Ru6C(CO)16SnCl2] and [Ru6C(CO)16SnCl3]−","Chemical Communications","2000","","19","1955","","10.1039/b004585n","","","0.71069","MoKα","","0.1923","0.0904","","","0.1837","0.2341","","","","","","1.008","","","","has coordinates,has disorder","180265","2020-10-21","18:00:00",""
"7115171","16.74","0.006","16.5","0.007","20.941","0.009","90","","90.96","0.02","90","","5783","4","180","2","180","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C17 Cl2 O16 Ru6 Sn -","- C17 Cl2 O16 Ru6 Sn -","- C136 Cl16 O128 Ru48 Sn8 -","8","1","","Hermans, Sophie; Johnson, Brian F. G.","High yield synthesis and crystal structures of the Ru6‒Sn cluster compounds [Ru6C(CO)16SnCl2] and [Ru6C(CO)16SnCl3]−","Chemical Communications","2000","","19","1955","","10.1039/b004585n","","","0.71073","MoKα","","0.0413","0.033","","0.0624","0.0601","","","","1.036","1.099","1.099","","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115172","32.31","0.02","13.63","0.01","17.54","0.01","90","","111.68","0.04","90","","7178","8","113.2","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C29 H67 Fe N O4 P4 -","- C27 H56 Fe N O3.5 P4 -","- C216 H448 Fe8 N8 O28 P32 -","8","1","","Hirano, Masafumi; Kiyota, Sayori; Imoto, Masataka; Komiya, Sanshiro","Michael addition of N-bonded enolato ligands to acrylonitrile in iron and ruthenium complexes","Chemical Communications","2000","","17","1679","","10.1039/b004099l","","","0.7107","MoKα","","","0.0536","","","","0.0976","","","","","","1.03","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7115173","12.699","0.003","12.699","0.002","11.995","0.002","90","","90","","120","","1675.2","0.6","293","2","293","2","","","","","","","","5","P 32 2 1","P 32 2""","154","","","","- C17 H32 I2 P2 Pt -","- C17 H32 I2 P2 Pt -","- C51 H96 I6 P6 Pt3 -","3","0.5","","Fernandez, Elena; Gillon, Amy; Heslop, Katie; Horwood, Emily; Hyett, David J.; Orpen, A. Guy; Pringle, Paul G.","Rationally designed improvement of the bis(phospholano)ethane ligand for asymmetric hydrogenation leads to a reappraisal of the factors governing the enantioselectivity of Duphos catalysts","Chemical Communications","2000","","17","1663","","10.1039/b002994g","","","0.71073","MoKα","","0.041","0.0343","","","0.0799","0.0818","","","","","","1.079","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115174","8.347","0.0019","13.844","0.004","10.3968","0.0019","90","0.013","111.574","0.011","90","0.02","1117.2","0.5","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C17 H32 I2 P2 Pt -","- C17 H32 I2 P2 Pt -","- C34 H64 I4 P4 Pt2 -","2","1","","Fernandez, Elena; Gillon, Amy; Heslop, Katie; Horwood, Emily; Hyett, David J.; Orpen, A. Guy; Pringle, Paul G.","Rationally designed improvement of the bis(phospholano)ethane ligand for asymmetric hydrogenation leads to a reappraisal of the factors governing the enantioselectivity of Duphos catalysts","Chemical Communications","2000","","17","1663","","10.1039/b002994g","","","0.71073","MoKα","","0.0509","0.0361","","","0.0701","0.0733","","","","","","0.927","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115175","15.975","0.002","9.298","0.001","12.726","0.002","90","","90","","90","","1890.3","0.4","291","2","291","2","","","","","","","","7","P c a 21","P 2c -2ac","29","","","","- C6 H20 Cl2 Cu La N O17 -","- C6 H12 Cl2 Cu La N O17 -","- C24 H48 Cl8 Cu4 La4 N4 O68 -","4","1","","Liu, Qin-De; Li, Jun-Ran; Gao, Song; Ma, Bao-Qing; Zhou, Qing-Zhong; Liu, Hui; Yu, Kai-Bei","Anion controlled 2D assembly of a La‒Cu cation array and its unusual magnetic properties","Chemical Communications","2000","","17","1685","","10.1039/b003293j","","","0.71073","MoKα","","0.031","0.0273","","","0.0698","0.0711","","","","","","1.04","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115176","14.398","0.0004","14.979","0.0004","16.567","0.0004","116.205","0.001","97.249","0.0011","92.672","0.0012","3159.02","0.15","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C68 H68 Bi N9 O17 -","- C68 H66 Bi N9 O17 -","- C136 H132 Bi2 N18 O34 -","2","1","","Michaudet, Lydie; Richard, Philippe; Boitrel, Bernard","Synthesis and crystal structure of an unprecedented bismuth porphyrin containing ester pendant arms","Chemical Communications","2000","","17","1589","","10.1039/b004394j","","","0.7107","MoKα","","0.0955","0.0552","","","0.0876","0.1007","","","","","","1.028","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7117432","8.5261","","5.3562","","8.9064","","90","","90","","90","","406.733","","","","","","","","","","","","","4","P c 21 n","P -2n -2ac","33","","Rb (Cu P O4)","","- Cu O4 P Rb -","- Cu O4 P Rb -","- Cu4 O16 P4 Rb4 -","4","1","","Henry, P.F.; Hughes, R.W.; Weller, M.T.; Ward, S.C.","Rb Cu P O4 - a maximum copper tetrahedral framework adopting the zeotype ABW structure","Chemical Communications","2000","2000","","1959","1960","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7117433","11.9061","","11.9061","","11.9061","","90","","90","","90","","1687.75","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","(Zn2.9 O2.7) Zn6 (Al12 Si12 O48)","","- Al12 O50.7 Si12 Zn8.9 -","- Al12 O50.7 Si12 Zn8.9 -","- Al12 O50.7 Si12 Zn8.9 -","1","0.0208333","","Readman, J.E.; Gameson, I.; Hriljac, J.A.; Anderson, P.A.; Edwards, P.P.","Synthesis and structure of zinc oxide clusters encapsulated in zeolite LTA","Chemical Communications","2000","2000","","595","596","","","","","","","","","","","","","","","","","","","","","","has coordinates","141107","2020-10-21","18:00:00",""
"7117434","10.2578","","4.7063","","5.6017","","90","","96.467","","90","","268.708","","","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","Li (Sb3 O8)","","- Li O8 Sb3 -","- Li O8 Sb3 -","- Li2 O16 Sb6 -","2","0.5","","Lopes, M.E.; Kirk, C.A.; Blake, S.M.; Marr, J.; West, A.R.","Li Sb3 O8: the first tetrarutile structure","Chemical Communications","2000","2000","","1951","1952","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7118238","16.708","","16.708","","16.708","","90","","90","","90","","4664.16","","","","","","","","","","","","","4","I -4 3 m","I -4 2 3","217","","((H2 O) (As O4) V10 O22) (H2 O)8","","- As H18 O35 V10 -","- As O35 V10 -","- As6 O210 V60 -","6","0.125","","Bu, W.-M.; Ye, L.; Yang, G.-Y.; Xu, J.-Q.; Shao, M.-C.; Fan, Y.-G.","A three-dimensional neutral framework of a novel decavanadium cluster bridged by an As O4 tetrahedron: (As V(IV)8 V(V) O26 (mue-H2 O)) * 8(H2 O)","Chemical Communications","2000","2000","","1279","1280","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7118391","16.42059","","20.05399","","5.0464","","90","","90","","90","","1661.77","","","","","","","","","","","","","2","C 2 2 2","C 2 2","21","","Si32 O64","","- O64 Si32 -","- O64 Si32 -","- O64 Si32 -","1","0.125","","Plevert, J.; Kubota, Y.; Honda, T.; Okubo, T.; Sugi, Y.","GUS-1: a mordenite-like molecular sieve with the 12-ring channel of ZSM-12","Chemical Communications","2000","2000","","2363","2364","","","","","","","","","","","","","","","","","","","","","","has coordinates","174031","2020-10-21","18:00:00",""
"7118896","18.749","0.007","12.78","0.005","21.716","0.008","90","","99.729","0.005","90","","5129","3","170","2","170","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C44 H43 Ag3 N9 O10.5 S4 -","- C44 H43 Ag3 N9 O10.5 S4 -","- C176 H172 Ag12 N36 O42 S16 -","4","1","","Caradoc-Davies, Paula L.; Hanton, Lyall R.; Lee, Kitty","Extension of a π-stacked N~2~S ligand to form bi- and tri-nuclear silver(I) complexes","Chemical Communications (Cambridge, United Kingdom)","2000","","9","783","784","10.1039/a910342m","","","0.71073","MoKα","","0.138","0.0588","","","0.1196","0.1512","","","","","","1.037","","","","has coordinates,has disorder","178222","2020-10-21","18:00:00",""
"7125468","8.7286","0.0004","7.0783","0.0004","8.6377","0.0004","90","","93.7219","0.0018","90","","532.54","0.05","100","","100","","","","","","","","see text","2","P 1 21/n 1","-P 2yn","14","","Tetrasulfur tetranitride","","- N4 S4 -","- N4 S4 -","- N16 S16 -","4","1","","Scherer, Wolfgang; Spiegler, Michael; Pedersen, Bjørn; Tafipolsky, Maxim; Hieringer, Wolfgang; Reinhard, Björn; Downs, Anthony J.; McGrady, G. Sean","Molecular recognition in the solid state: topology of experimental and theoretical charge densities for tetrasulfur tetranitride","Chemical Communications","2000","","7","635","","10.1039/a910209o","","","0.71073","MoKα","","0.04","0.025","","","","","","","","","","1.628","","","","has coordinates","243865","2020-10-21","18:00:00",""
"7203852","18.275","0.002","18.275","0.002","7.383","0.001","90","","90","","120","","2135.4","0.4","293","","293","","","","","","","","","4","P 31","P 31","144","","","","- C29 H49 N O6 -","- C29 H46 N O6 -","- C87 H138 N3 O18 -","3","1","","Sofia Candeloro De Sanctis; Angelo A. D'Archivio; Luciano Galantini; Enrico Gavuzzo; Edoardo Giglio","On the role of hydronium ions in the protonated micellar aggregates of bile salts","J. Chem. Soc., Perkin Trans. 2","2000","","2","403","407","10.1039/a902558h","","","1.54178","CuKα","","","0.044","","","0.056","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203853","9.965","0.001","8.132","0.001","17.301","0.002","90","","90.9","0.01","90","","1401.8","0.3","293","","293","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C26 H49 N O8 S -","- C26 H42 N O8 S -","- C52 H84 N2 O16 S2 -","2","1","","Sofia Candeloro De Sanctis; Angelo A. D'Archivio; Luciano Galantini; Enrico Gavuzzo; Edoardo Giglio","On the role of hydronium ions in the protonated micellar aggregates of bile salts","J. Chem. Soc., Perkin Trans. 2","2000","","2","403","407","10.1039/a902558h","","","1.54178","CuKα","","","0.066","","","0.083","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203854","9.659","0.003","8.334","0.002","17.308","0.005","90","","91.18","0.02","90","","1393","0.7","293","","293","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C26 H49 N O8 S -","- C26 H49 N O8 S -","- C52 H98 N2 O16 S2 -","2","1","","Sofia Candeloro De Sanctis; Angelo A. D'Archivio; Luciano Galantini; Enrico Gavuzzo; Edoardo Giglio","On the role of hydronium ions in the protonated micellar aggregates of bile salts","J. Chem. Soc., Perkin Trans. 2","2000","","2","403","407","10.1039/a902558h","","","0.71069","MoKα","","","0.036","","","0.046","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203855","4.7487","0.0007","5.9711","0.0009","17.017","0.003","90","","90","","90","","482.52","0.13","90","2","90","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","N,N-Dimethylthioformamide","","","- C3 H7 N S -","- C3 H7 N S -","- C12 H28 N4 S4 -","4","1","","Borrmann, Horst; Persson, Ingmar; Sandström, Magnus; Stlhandske, Christina M. V.","The crystal and liquid structures of N,N-dimethylthioformamide and N,N-dimethylformamide showing a stronger hydrogen bonding effect for C‒H · · · S than for C‒H · · · O †","Journal of the Chemical Society, Perkin Transactions 2","2000","","2","393","","10.1039/a904531g","","","0.56086","AgKα","","0.0223","0.0195","","","0.0463","0.0468","","","","","","0.952","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203856","5.9455","0.0009","7.0042","0.001","10.4041","0.0019","77.238","0.013","88.132","0.014","75.28","0.012","408.56","0.12","90","2","90","2","","","","","","","","4","P -1","-P 1","2","N,N-Dimethylformamide","","","- C3 H7 N O -","- C3 H7 N O -","- C12 H28 N4 O4 -","4","2","","Borrmann, Horst; Persson, Ingmar; Sandström, Magnus; Stlhandske, Christina M. V.","The crystal and liquid structures of N,N-dimethylthioformamide and N,N-dimethylformamide showing a stronger hydrogen bonding effect for C‒H · · · S than for C‒H · · · O †","Journal of the Chemical Society, Perkin Transactions 2","2000","","2","393","","10.1039/a904531g","","","0.56086","AgKα","","0.0515","0.0331","","","0.0868","0.0913","","","","","","0.906","","","","has coordinates","180369","2020-10-21","18:00:00",""
"7203857","13.288","0.004","27.298","0.005","6.235","0.006","90","","90","","90","","2262","2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C21 H32 N2 O6 -","- C21 H32 N2 O6 -","- C84 H128 N8 O24 -","4","1","","Kozsda-Kovács, Éva; Keserü, György Miklós; Böcskei, Zsolt; Szilágyi, Ildikó; Simon, Kálmán; Bertók, Béla; Fogassy, Elemér","Role of the solvent in optical resolution of trans-chrysanthemic acid via diastereomeric salt formation with (1R,2R)-1-(4-nitrophenyl)-2-dimethylaminopropane-1,3-diol","Journal of the Chemical Society, Perkin Transactions 2","2000","","1","149","","10.1039/a904682h","","","1.54178","CuKα","","0.1175","0.0562","","0.1918","0.1502","","","","1.064","1.173","1.173","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203858","13.209","0.018","26.587","0.021","7.218","0.021","90","","90","","90","","2535","8","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C22 H36 N2 O7 -","- C22 H36 N2 O7 -","- C88 H144 N8 O28 -","4","1","","Kozsda-Kovács, Éva; Keserü, György Miklós; Böcskei, Zsolt; Szilágyi, Ildikó; Simon, Kálmán; Bertók, Béla; Fogassy, Elemér","Role of the solvent in optical resolution of trans-chrysanthemic acid via diastereomeric salt formation with (1R,2R)-1-(4-nitrophenyl)-2-dimethylaminopropane-1,3-diol","Journal of the Chemical Society, Perkin Transactions 2","2000","","1","149","","10.1039/a904682h","","","1.54178","CuKα","","0.3433","0.0628","","0.2161","0.1021","","","","1.094","1.416","1.416","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203859","9.923","0.01","7.658","0.01","15.573","0.01","90","","107.02","0.1","90","","1132","2","293","2","293","2","","","","","","","preparation","4","P 1 21 1","P 2yb","4","d-trans chrysanthemic acid DMAD salt","(1R,3R)-2,2-dimethyl-3-(methylpropenyl)-cyclopropanecarboxylic acid (1R,2R)-1-(4-nitrophenyl)- -2-dimethylamino-1,3-propanediol salt","","- C21 H32 N2 O6 -","- C21 H32 N2 O6 -","- C42 H64 N4 O12 -","2","1","","Kozsda-Kovács, Éva; Keserü, György Miklós; Böcskei, Zsolt; Szilágyi, Ildikó; Simon, Kálmán; Bertók, Béla; Fogassy, Elemér","Role of the solvent in optical resolution of trans-chrysanthemic acid via diastereomeric salt formation with (1R,2R)-1-(4-nitrophenyl)-2-dimethylaminopropane-1,3-diol","Journal of the Chemical Society, Perkin Transactions 2","2000","","1","149","","10.1039/a904682h","","","0.71069","MoKα","","0.1323","0.0989","","0.3124","0.2649","","","","1.017","1.105","1.105","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203860","9.2457","0.0019","7.3465","0.0016","9.929","0.002","90","","100.702","0.005","90","","662.7","0.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[H3NC2H4NH2]TiOPO4","","","- C4 H18 N4 O10 P2 Ti2 -","- C4 H18 N4 O10 P2 Ti2 -","- C8 H36 N8 O20 P4 Ti4 -","2","0.5","","Zhao, Yongnan; Zhu, Guangshan; Jiao, Xiuling; Liu, Wang; Pang, Wenqin","Template synthesis and characterization of a new 2-D layered titanium phosphate","Journal of Materials Chemistry","2000","10","2","463","","10.1039/a904837e","","","0.71073","MoKα","","0.048","0.0331","","","0.0892","0.0985","","","","","","0.71","","","","has coordinates","180369","2020-10-21","18:00:00",""
"7203861","10.043","0.003","15.989","0.004","18.308","0.006","90","","90","","90","","2939.9","1.5","293","2","293","2","","","","","","","","6","P c a b","-P 2bc 2ac","61","","","","- C3 H16 Ga3 N2 O15 P3 -","- C3 Ga3 N2 O15 P3 -","- C24 Ga24 N16 O120 P24 -","8","1","","Chantal Brouca-Cabarrecq; Alain Mosset","New potential open-framework materials in gallophosphate systems. Preparation and crystal structure of [NH3(CH2)3NH3]Ga3(PO4)3(OH)2·H2O and [NH2(CH2)3NH2]Ga3(PO4)3(H2O)","J. Mater. Chem.","2000","10","2","445","450","10.1039/a905099j","","","0.7093","","","0.1277","0.0436","","0.1351","0.1164","","","","0.992","1.197","1.197","","","","","has coordinates","180369","2020-10-21","18:00:00",""
"7203862","18.062","0.004","19.795","0.009","9.931","0.002","90","","90","","90","","3550.7","1.9","296.2","","296.2","","","","","","","","","4","P b c a","-P 2ac 2ab","61","2-bromo-3-diphenylmethylene-2,3-dihydro-1,4-naphthoquinone","","","- C23 H15 Br O2 -","- C23 H15 Br O2 -","- C184 H120 Br8 O16 -","8","1","","Oshima, Takumi; Tamada, Kazushi; Tamura, Hatsue; Nagai, Toshikazu","Kinetic study of thermolysis of diarylhomonaphthoquinones. Endo/exo substituent and solvent effects","Journal of the Chemical Society, Perkin Transactions 2","2000","","1","135","","10.1039/a905223b","","","0.7107","MoKα","","0.26","0.063","","","0.11","0.17","","","","","","0.936","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203863","12.121","0.004","6.319","0.002","10.882","0.004","90","0","102.69","0.03","90","0","813.1","0.5","293","","","","","","","","","","Saigo laboratory","4","P 1 21 1","P 2yb","4","","","","?","- C18 H21 N O3 -","- C36 H42 N2 O6 -","2","1","","Kinbara, Kazushi; Kobayashi, Yuka; Saigo, Kazuhiko","Chiral discrimination of 2-arylalkanoic acids by (1S,2R)-1-aminoindan-2-ol through the formation of a consistent columnar supramolecular hydrogen-bond network †","Journal of the Chemical Society, Perkin Transactions 2","2000","","1","111","","10.1039/a905566e","","","1.54178","CuK-alpha","","","0.061","","","0.075","","","","","1.16","1.16","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203864","12.294","0.005","6.388","0.004","11.134","0.005","90","0","103.71","0.03","90","0","849.5","0.7","293","","","","","","","","","","Saigo laboratory","4","P 1 21 1","P 2yb","4","","","","?","- C19 H23 N O3 -","- C38 H46 N2 O6 -","2","1","","Kinbara, Kazushi; Kobayashi, Yuka; Saigo, Kazuhiko","Chiral discrimination of 2-arylalkanoic acids by (1S,2R)-1-aminoindan-2-ol through the formation of a consistent columnar supramolecular hydrogen-bond network †","Journal of the Chemical Society, Perkin Transactions 2","2000","","1","111","","10.1039/a905566e","","","1.54178","CuK-alpha","","","0.086","","","0.086","","","","","1.051","1.051","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203865","14.584","0.004","6.175","0.003","10.852","0.003","90","0","107.8","0.02","90","0","930.5","0.6","293","","","","","","","","","","Saigol laboratory","4","P 1 21 1","P 2yb","4","","","","?","- C19 H25 N O5 -","- C38 H50 N2 O10 -","2","1","","Kinbara, Kazushi; Kobayashi, Yuka; Saigo, Kazuhiko","Chiral discrimination of 2-arylalkanoic acids by (1S,2R)-1-aminoindan-2-ol through the formation of a consistent columnar supramolecular hydrogen-bond network †","Journal of the Chemical Society, Perkin Transactions 2","2000","","1","111","","10.1039/a905566e","","","1.54178","CuK-alpha","","","0.045","","","0.057","","","","","1.146","1.146","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203866","12.351","0.003","6.17","0.002","11.431","0.002","90","0","99.1","0.02","90","0","860.1","0.4","293","","","","","","","","","","Saigo laboratory","4","P 1 21 1","P 2yb","4","","","","?","- C19 H23 N O3 -","- C38 H46 N2 O6 -","2","1","","Kinbara, Kazushi; Kobayashi, Yuka; Saigo, Kazuhiko","Chiral discrimination of 2-arylalkanoic acids by (1S,2R)-1-aminoindan-2-ol through the formation of a consistent columnar supramolecular hydrogen-bond network †","Journal of the Chemical Society, Perkin Transactions 2","2000","","1","111","","10.1039/a905566e","","","1.54178","CuK-alpha","","","0.043","","","0.047","","","","","1.05","1.05","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203867","16.848","0.004","5.947","0.002","8.58","0.002","90","0","101.75","0.02","90","0","841.7","0.4","293","","","","","","","","","","Saigol laboratory","4","P 1 21 1","P 2yb","4","","","","?","- C19 H23 N O3 -","- C38 H46 N2 O6 -","2","1","","Kinbara, Kazushi; Kobayashi, Yuka; Saigo, Kazuhiko","Chiral discrimination of 2-arylalkanoic acids by (1S,2R)-1-aminoindan-2-ol through the formation of a consistent columnar supramolecular hydrogen-bond network †","Journal of the Chemical Society, Perkin Transactions 2","2000","","1","111","","10.1039/a905566e","","","1.54178","CuK-alpha","","","0.101","","","0.132","","","","","1.767","1.767","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203868","17.045","0.004","6.148","0.002","17.931","0.004","90","0","101.22","0.02","90","0","1843.1","0.9","293","","","","","","","","","","Saigo laboratory","4","A 1 2 1","A 2y","5","","","","?","- C20 H25 N O3 -","- C80 H100 N4 O12 -","4","1","","Kinbara, Kazushi; Kobayashi, Yuka; Saigo, Kazuhiko","Chiral discrimination of 2-arylalkanoic acids by (1S,2R)-1-aminoindan-2-ol through the formation of a consistent columnar supramolecular hydrogen-bond network †","Journal of the Chemical Society, Perkin Transactions 2","2000","","1","111","","10.1039/a905566e","","","1.54178","CuK-alpha","","","0.049","","","0.052","","","","","1.252","1.252","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203869","19.831","0.002","5.786","0.001","16.453","0.002","90","0","110.57","0.01","90","0","1767.5","0.4","293","","","","","","","","","","Saigo laboratory","4","C 1 2 1","C 2y","5","","","","?","- C20 H25 N O3 -","- C80 H100 N4 O12 -","4","1","","Kinbara, Kazushi; Kobayashi, Yuka; Saigo, Kazuhiko","Chiral discrimination of 2-arylalkanoic acids by (1S,2R)-1-aminoindan-2-ol through the formation of a consistent columnar supramolecular hydrogen-bond network †","Journal of the Chemical Society, Perkin Transactions 2","2000","","1","111","","10.1039/a905566e","","","1.54178","CuK-alpha","","","0.061","","","0.074","","","","","1.75","1.75","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203870","15.787","0.002","6.3359","0.0008","9.353","0.001","90","0","99.428","0.008","90","0","922.9","0.19","293","","","","","","","","","","Saigo laboratory","5","P 1 21 1","P 2yb","4","","","","?","- C19 H20 F3 N O4 -","- C38 H40 F6 N2 O8 -","2","1","","Kinbara, Kazushi; Kobayashi, Yuka; Saigo, Kazuhiko","Chiral discrimination of 2-arylalkanoic acids by (1S,2R)-1-aminoindan-2-ol through the formation of a consistent columnar supramolecular hydrogen-bond network †","Journal of the Chemical Society, Perkin Transactions 2","2000","","1","111","","10.1039/a905566e","","","1.54178","CuK-alpha","","","0.047","","","0.056","","","","","1.017","1.017","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203871","8.4201","0.0017","16.681","0.003","21.656","0.004","90","","90","","90","","3041.7","1","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C16 H24 N2 -","- C16 H24 N2 -","- C128 H192 N16 -","8","1","","Kuhn, Norbert; Kotowski, Heike; Steimann, Manfred; Speiser, Bernd; Würde, Marc; Henkel, Gerald","Synthesis, oxidation and protonation of octamethyl-1,1'-bipyrrole","Journal of the Chemical Society, Perkin Transactions 2","2000","","2","353","","10.1039/a905603c","","","0.71073","MoKα","","0.0645","0.0366","","","0.093","0.1043","","","","","","1.281","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203872","8.376","0.003","11.618","0.005","12.271","0.004","86.16","0.03","84.31","0.03","72.48","0.03","1132.2","0.8","150","","150","","","","","","","","","4","P -1","-P 1","2","","","","- C16 H25 I4 N2 -","- C16 H25 I4 N2 -","- C32 H50 I8 N4 -","2","1","","Kuhn, Norbert; Kotowski, Heike; Steimann, Manfred; Speiser, Bernd; Würde, Marc; Henkel, Gerald","Synthesis, oxidation and protonation of octamethyl-1,1'-bipyrrole","Journal of the Chemical Society, Perkin Transactions 2","2000","","2","353","","10.1039/a905603c","","","0.71073","MoKα","","","0.031","","","0.0382","","","","","","","","","","","has coordinates","180369","2020-10-21","18:00:00",""
"7203873","12.915","0.003","10.298","0.003","17.648","0.003","90","","101.08","0.02","90","","2303.4","1","473.2","","473.2","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C29 H23 O3 P -","- C29 H23 O3 P -","- C116 H92 O12 P4 -","4","1","","Aitken, R. Alan; Karodia, Nazira; Lightfoot, Philip","The solid state conformation of oxo stabilised ylides: X-ray structures of four new polyoxo phosphorus ylides","Journal of the Chemical Society, Perkin Transactions 2","2000","","2","333","","10.1039/a905747a","","","0.7107","MoKalpha","","","0.0399","","","0.0402","","","","","2.96","2.96","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203874","11.681","0.002","14.54","0.002","10.415","0.002","101.15","0.01","115.38","0.01","91.95","0.01","1554.3","0.5","293.2","","293.2","","","","","","","","","5","P -1","-P 1","2","","","","- C35.5 H26 Cl O4 P -","- C36 H27 Cl2 O4 P -","- C72 H54 Cl4 O8 P2 -","2","1","","Aitken, R. Alan; Karodia, Nazira; Lightfoot, Philip","The solid state conformation of oxo stabilised ylides: X-ray structures of four new polyoxo phosphorus ylides","Journal of the Chemical Society, Perkin Transactions 2","2000","","2","333","","10.1039/a905747a","","","0.7107","MoKalpha","","","0.1156","","","0.1556","","","","","7.958","7.958","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203875","10.08","0.01","14.23","0.02","17.18","0.01","85.5","0.1","81.4","0.1","76.2","0.07","2364","4","200","","473.2","","","","","","","","","5","P -1","-P 1","2","","","","- C48 H38 Cl6 O8 P2 -","- C48 H38 Cl6 O8 P2 -","- C96 H76 Cl12 O16 P4 -","2","1","","Aitken, R. Alan; Karodia, Nazira; Lightfoot, Philip","The solid state conformation of oxo stabilised ylides: X-ray structures of four new polyoxo phosphorus ylides","Journal of the Chemical Society, Perkin Transactions 2","2000","","2","333","","10.1039/a905747a","","","0.7107","MoKalpha","","","0.0617","","","0.0644","","","","","1.742","1.742","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203876","32.65","0.01","15.601","0.005","19.141","0.008","90","","102.95","0.03","90","","9502","6","493.2","","493.2","","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C55.75 H44 O4 P2 -","- C57.5 H44 O4 P2 -","- C460 H352 O32 P16 -","8","2","","Aitken, R. Alan; Karodia, Nazira; Lightfoot, Philip","The solid state conformation of oxo stabilised ylides: X-ray structures of four new polyoxo phosphorus ylides","Journal of the Chemical Society, Perkin Transactions 2","2000","","2","333","","10.1039/a905747a","","","0.7107","MoKalpha","","","0.1068","","","0.1419","","","","","5.174","5.174","","","","","has coordinates","208379","2020-10-21","18:00:00",""
"7203877","5.3472","0.0003","7.3229","0.0006","12.1705","0.0007","90","","102.379","0.005","90","","465.48","0.05","293","","293","","","","","","","","","5","P 1 21 1","P 2yb","4","","L-p-boronophenylalanine","","- C9 H12 B N O4 -","- C9 H12 B N O4 -","- C18 H24 B2 N2 O8 -","2","1","","Shull, Brian K.; Spielvogel, David E.; Gopalaswamy, Ramesh; Sankar, Sabapathy; Boyle, Paul D.; Head, Gerald; Devito, Kevin","Evidence for spontaneous, reversible paracyclophane formation. Aprotic solution structure of the boron neutron capture therapy drug, L-p-boronophenylalanine","Journal of the Chemical Society, Perkin Transactions 2","2000","","3","557","","10.1039/a906038c","","","0.71073","MolybdenumKα","","0.031","0.031","","0.043","0.043","","","","","1.6","1.6","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203878","17.646","0.002","23.396","0.003","11.5285","0.0009","90","","90","","90","","4759.5","0.9","294.2","","294.2","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C38 H70 N8 O12 -","- C38 H66 N8 O12 -","- C152 H264 N32 O48 -","4","1","","Cusack, Rodney M.; Grøndahl, Lisbeth; Abbenante, Giovanni; Fairlie, David P.; Gahan, Lawrence R.; Hanson, Graeme R.; Hambley, Trevor W.","Conformations of cyclic octapeptides and the influence of heterocyclic ring constraints upon calcium binding †","Journal of the Chemical Society, Perkin Transactions 2","2000","","2","323","","10.1039/a906090a","","","1.5418","CuKα","","0.0467","0.0467","","0.0441","0.0441","","","","1.901","1.901","1.901","","","","","has coordinates","209482","2020-10-21","18:00:00",""
"7203879","11.856","0.005","8.486","0.004","9.043","0.004","90","","106.89","0.01","90","","870.6","0.7","298","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C6 H18 I4 N2 Pb -","- C6 H18 I4 N2 Pb -","- C12 H36 I8 N4 Pb2 -","2","0.5","","Mousdis, G. A.; Papavassiliou, G. C.; Raptopoulou, C. P.; Terzis, A.","Preparation and characterization of [H3N(CH2)6NH3]PbI4 and similar compounds with a layered perovskite structure","Journal of Materials Chemistry","2000","10","2","515","","10.1039/a906161d","","","0.71073","MoKα","","0.0298","0.0284","","0.0769","0.0758","","","","1.174","1.179","1.179","","","","","has coordinates","180369","2020-10-21","18:00:00",""
"7203880","12.02","0.01","8.045","0.008","8.342","0.009","90","","105.66","0.03","90","","776.7","1.3","298","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C6 H18 Br4 N2 Pb -","- C6 Br4 N2 Pb -","- C12 Br8 N4 Pb2 -","2","0.5","","Mousdis, G. A.; Papavassiliou, G. C.; Raptopoulou, C. P.; Terzis, A.","Preparation and characterization of [H3N(CH2)6NH3]PbI4 and similar compounds with a layered perovskite structure","Journal of Materials Chemistry","2000","10","2","515","","10.1039/a906161d","","","0.71073","MoKα","","0.0427","0.0333","","0.0887","0.0828","","","","1.093","1.113","1.113","","","","","has coordinates","180369","2020-10-21","18:00:00",""
"7203881","9.658","","15.375","","9.975","","90","","103","","90","","1443.24","","293.2","","293.2","","","","","","","","Rachel Suissa","2","P 1 21/c 1","-P 2ybc","14","","","","?","- C19 H17 -","- C76 H68 -","4","1","","Tapuhi, Yitzhak; Rachel Suissa, Michal; Cohen, Shmuel; Biedermann, P. Ulrich; Levy, Amalia; Agranat, Israel","The stereochemistry of overcrowded homomerous bistricyclic aromatic enes with alkylidene bridges","Journal of the Chemical Society, Perkin Transactions 2","2000","","1","93","","10.1039/a906696i","","","0.7107","MoKalpha","","","0.034","","","0.036","","","","","3.41","3.41","","","","","has coordinates","180369","2020-10-21","18:00:00",""
"7203882","12.139","","8.26","","11.816","","90","","90","","90","","1184.77","","293.2","","293.2","","","","","","","","Rachel Suissa","2","P 1 21/n 1","-P 2yn","14","","","","?","- C16 H15 -","- C64 H60 -","4","1","","Tapuhi, Yitzhak; Rachel Suissa, Michal; Cohen, Shmuel; Biedermann, P. Ulrich; Levy, Amalia; Agranat, Israel","The stereochemistry of overcrowded homomerous bistricyclic aromatic enes with alkylidene bridges","Journal of the Chemical Society, Perkin Transactions 2","2000","","1","93","","10.1039/a906696i","","","0.7107","MoKalpha","","","0.054","","","0.065","","","","","1.75","1.75","","","","","has coordinates","180369","2020-10-21","18:00:00",""
"7203883","8.7123","0.0012","9.3","0.0013","13.4414","0.0019","88.445","0.004","75.459","0.003","64.682","0.003","948.9","0.2","160","2","160","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H24 Cl N O -","- C22 H24 Cl N O -","- C44 H48 Cl2 N2 O2 -","2","1","","Moisés Canle L.; William Clegg; Ibrahim Demirtas; Mark R. J. Elsegood; Howard Maskill","Preparations, X-ray crystal structure determinations, and base strength measurements of substituted tritylamines","J. Chem. Soc., Perkin Trans. 2","2000","","1","85","92","10.1039/a906755h","","","0.71073","MoKα","","0.0725","0.0466","","","0.1025","0.1139","","","","","","1.022","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203884","16.574","0.002","12.5221","0.0018","17.769","0.003","90","","105.757","0.003","90","","3549.2","0.9","160","2","160","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C22 H21 N O2 -","- C22 H21 N O2 -","- C176 H168 N8 O16 -","8","1","","Moisés Canle L.; William Clegg; Ibrahim Demirtas; Mark R. J. Elsegood; Howard Maskill","Preparations, X-ray crystal structure determinations, and base strength measurements of substituted tritylamines","J. Chem. Soc., Perkin Trans. 2","2000","","1","85","92","10.1039/a906755h","","","0.71073","MoKα","","0.085","0.0511","","","0.1354","0.1579","","","","","","1.075","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203885","9.229","0.0018","9.6725","0.0018","18.7","0.003","90","","90","","90","","1669.3","0.5","160","2","160","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C21 H19 N O2 -","- C21 H19 N O2 -","- C84 H76 N4 O8 -","4","1","","Moisés Canle L.; William Clegg; Ibrahim Demirtas; Mark R. J. Elsegood; Howard Maskill","Preparations, X-ray crystal structure determinations, and base strength measurements of substituted tritylamines","J. Chem. Soc., Perkin Trans. 2","2000","","1","85","92","10.1039/a906755h","","","0.71073","MoKα","","0.0976","0.0598","","","0.1385","0.1575","","","","","","1.035","","","","has coordinates,has disorder","180369","2020-10-21","18:00:00",""
"7203886","10.497","0.002","18.498","0.002","19.597","0.002","90","","102.78","0.017","90","","3711","0.9","160","2","160","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H23 N O3 -","- C22 H23 N O3 -","- C176 H184 N8 O24 -","8","2","","Moisés Canle L.; William Clegg; Ibrahim Demirtas; Mark R. J. Elsegood; Howard Maskill","Preparations, X-ray crystal structure determinations, and base strength measurements of substituted tritylamines","J. Chem. Soc., Perkin Trans. 2","2000","","1","85","92","10.1039/a906755h","","","1.54184","CuKα","","0.0634","0.0435","","","0.0969","0.1105","","","","","","1.061","","","","has coordinates","180369","2020-10-21","18:00:00",""
"7203887","35.636","0.004","9.226","0.001","17.779","0.002","90","","92.64","0.01","90","","5839.1","1.1","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C37 H30 N2 O5 -","- C37 H30 N2 O5 -","- C296 H240 N16 O40 -","8","1","","Kumar, Subodh; Paul, Dharam; Hundal, Geeta; Hundal, Maninder Singh; Singh, Harjit","Heterocalixarenes Part 3: Bis-oxo-bridged calix[1]cyclicurea[3]arene and calix[1]cyclicurea[1]pyridine[2]arenes. Synthesis, X-ray crystal structure and conformational analysis 1","Journal of the Chemical Society, Perkin Transactions 1","2000","","6","1037","","10.1039/a906883j","","","0.71073","MoKα","","0.1286","0.0717","","0.2484","0.1967","","","","0.994","1.099","1.099","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203888","12.331","0.002","13.205","0.005","14.693","0.004","90","","90","","90","","2392.5","1.2","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C7 H11 N5 O8 -","- C7 H11 N5 O8 -","- C56 H88 N40 O64 -","8","1","","Blackburn, G. Michael; Beadham, Ian G.; Adams, Harry; Hutchinson, Alistair P.; Nicklin, Stephen","Synthesis of haptens and their protein conjugates for immunological determination of nitrate esters and nitramines","Journal of the Chemical Society, Perkin Transactions 1","2000","","2","225","","10.1039/a906884h","","","0.71073","MoKα","","0.0934","0.0619","","","0.1604","0.2401","","","","","","1.579","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203889","12.339","0.009","6.574","0.004","11.163","0.016","90","","109.86","0.08","90","","851.7","1.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C4 H7 N5 O6 -","- C4 H7 N5 O6 -","- C16 H28 N20 O24 -","4","1","","Blackburn, G. Michael; Beadham, Ian G.; Adams, Harry; Hutchinson, Alistair P.; Nicklin, Stephen","Synthesis of haptens and their protein conjugates for immunological determination of nitrate esters and nitramines","Journal of the Chemical Society, Perkin Transactions 1","2000","","2","225","","10.1039/a906884h","","","0.71073","MoKα","","0.0455","0.0394","","","0.1027","0.1104","","","","","","1.074","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203890","10.251","0.001","9.291","0.001","14.606","0.001","90","","104.329","0.008","90","","1347.8","0.2","294.2","","294.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H19 N O4 S -","- C13 H17 N O4 S -","- C52 H68 N4 O16 S4 -","4","1","","Sohár, Pál; Forró, Enik; Lázár, László; Bernáth, Gábor; Sillanpää, Reijo; Fülöp, Ferenc","Synthesis and stereochemistry of stereoisomeric 1,2,3-oxathiazino[4,3-a]isoquinolines","Journal of the Chemical Society, Perkin Transactions 2","2000","","2","287","","10.1039/a907236e","","","0.7107","MoKα","","0.0364","0.036","","0.0392","","0.039","","","1.937","","","1.94","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203891","9.239","0.0007","10.0433","0.0008","8.7398","0.0006","96.68","0.007","112.885","0.005","81.562","0.007","737.48","0.1","294.2","","294.2","","","","","","","","","5","P -1","-P 1","2","","","","- C14 H19 N O4 S -","- C14 H19 N O4 S -","- C28 H38 N2 O8 S2 -","2","1","","Sohár, Pál; Forró, Enik; Lázár, László; Bernáth, Gábor; Sillanpää, Reijo; Fülöp, Ferenc","Synthesis and stereochemistry of stereoisomeric 1,2,3-oxathiazino[4,3-a]isoquinolines","Journal of the Chemical Society, Perkin Transactions 2","2000","","2","287","","10.1039/a907236e","","","0.7107","MoKα","","0.035","0.035","","0.0439","","0.044","","","1.686","","","1.69","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203892","8.3082","0.0007","12.308","0.001","7.5713","0.0005","105.084","0.006","92.26","0.007","104.576","0.007","718.91","0.1","296.2","","296.2","","","","","","","","","5","P -1","-P 1","2","","","","- C14 H19 N O4 S -","- C14 H19 N O4 S -","- C28 H38 N2 O8 S2 -","2","1","","Sohár, Pál; Forró, Enik; Lázár, László; Bernáth, Gábor; Sillanpää, Reijo; Fülöp, Ferenc","Synthesis and stereochemistry of stereoisomeric 1,2,3-oxathiazino[4,3-a]isoquinolines","Journal of the Chemical Society, Perkin Transactions 2","2000","","2","287","","10.1039/a907236e","","","0.7107","MoKα","","0.0327","0.033","","0.0435","","0.043","","","1.809","","","1.81","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203893","15.46","0.005","16.781","0.007","15.429","0.006","115.28","0.03","90.88","0.03","90.88","0.03","3618","3","198.2","","198.2","","","","","","","","","4","P -1","-P 1","2","","","","- C86 H80 Mn N8 -","- C86 H80 Mn N8 -","- C172 H160 Mn2 N16 -","2","1","","Sugiura, Ken-ichi; Mikami, Shinji; Johnson, Mitchell T.; Miller, Joel S.; Iwasaki, Kentaro; Umishita, Kazunori; Hino, Shojun; Sakata, Yoshiteru","Structure and magnetic properties of meso-tetrakis(2,4,6-trimethylphenyl)porphyrinatomanganese(iii) 7,7,8,8-tetracyano-2,5-dimethyl-p-quinodimethanide with a 2.3 K Tc. The first example of cis coordination of a tetracyano-p-quinodimethanide","Journal of Materials Chemistry","2000","10","4","959","","10.1039/a907241a","","","0.7107","MoKα","","0.0756","0.0756","","","0.0926","0.0926","","","","","","1.384","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203894","12.437","0.003","9.569","0.002","19.543","0.004","90","0","106.9","0.1","90","0","2225.4","1.5","295","","295","","","","","","","","?","5","P 1 21/c 1","-P 2ybc","14","","1-Diethylphosphnyl-2-Phenyl-3-Phenylamino Indole","","- C24 H25 N2 O3 P -","- C24 H25 N2 O3 P -","- C96 H100 N8 O12 P4 -","4","1","","Stefania Canestrari; Alexander Mar'in; Paolo Sgarabotto; Lara Righi; Lucedio Greci","New insights on the reaction of trialkyl phosphites with 2-phenyl-3-phenylimino-3H-indole N-oxide: an indolic nitrone. Crystal structures of 1-diethylphosphoryl-2-phenyl-3-phenylamino-1H-indole and 2-phenyl-4-phenylimino-4H-3,1-benzoxazine","J. Chem. Soc., Perkin Trans. 2","2000","","4","833","838","10.1039/a907601h","","","1.54178","X","","","0.044","","","","0.049","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203895","10.627","0.002","4.667","0.002","30.968","0.003","90","0","93","0.1","90","0","1533.8","0.7","295","","295","","","","","","","","?","4","P 1 21/c 1","-P 2ybc","14","","N-2-Phenyl-3,1-Benzoxazine-4-Phenylimino","","- C20 H14 N2 O -","- C20 H14 N2 O -","- C80 H56 N8 O4 -","4","1","","Stefania Canestrari; Alexander Mar'in; Paolo Sgarabotto; Lara Righi; Lucedio Greci","New insights on the reaction of trialkyl phosphites with 2-phenyl-3-phenylimino-3H-indole N-oxide: an indolic nitrone. Crystal structures of 1-diethylphosphoryl-2-phenyl-3-phenylamino-1H-indole and 2-phenyl-4-phenylimino-4H-3,1-benzoxazine","J. Chem. Soc., Perkin Trans. 2","2000","","4","833","838","10.1039/a907601h","","","1.54178","X","","","0.045","","","","0.047","","","","","","1.415","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203896","10.7545","0.0002","11.0123","0.0002","6.8433","0.0001","90","","90","","90","","810.46","0.02","200","2","200","2","","","","","","","","3","P 21 21 2","P 2 2ab","18","","(34)","","- C18 H28 N2 -","- C18 H28 N2 -","- C36 H56 N4 -","2","0.5","","von Hirschheydt, Thomas; Wolfart, Volker; Gleiter, Rolf; Irngartinger, Hermann; Oeser, Thomas; Rominger, Frank; Eisenträger, Frank","A short survey of bicyclic diamines ‒ syntheses and properties of N,N'-bridged-1,10-diazabicyclooctadeca-5,14-diynes","Journal of the Chemical Society, Perkin Transactions 2","2000","","2","175","","10.1039/a907609c","","","0.71073","MoKα","","0.0394","0.0305","","","0.0711","0.0747","","","","","","1.042","","","","has coordinates","180369","2020-10-21","18:00:00",""
"7203897","11.1299","0.0009","12.4995","0.001","15.52","0.0013","101.348","0.001","93.019","0.002","102.137","0.001","2059.6","0.3","200","2","200","2","","","","","","","","4","P -1","-P 1","2","","(35)","","- C19 H35.5 N2 O4.06 -","- C19 H35.5 N2 O4.052 -","- C76 H142 N8 O16.208 -","4","2","","von Hirschheydt, Thomas; Wolfart, Volker; Gleiter, Rolf; Irngartinger, Hermann; Oeser, Thomas; Rominger, Frank; Eisenträger, Frank","A short survey of bicyclic diamines ‒ syntheses and properties of N,N'-bridged-1,10-diazabicyclooctadeca-5,14-diynes","Journal of the Chemical Society, Perkin Transactions 2","2000","","2","175","","10.1039/a907609c","","","0.71073","MoKα","","0.1538","0.0613","","","0.1279","0.1659","","","","","","1.004","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203898","30.666","0.014","12.356","0.002","15.188","0.007","90","","91.13","0.03","90","","5754","4","223","2","223","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","1,10-Diazabicyclo[8.8.5]tricosa-5,14-diyne (37)","","- C21 H34 N2 -","- C21 H34 N2 -","- C252 H408 N24 -","12","1.5","","von Hirschheydt, Thomas; Wolfart, Volker; Gleiter, Rolf; Irngartinger, Hermann; Oeser, Thomas; Rominger, Frank; Eisenträger, Frank","A short survey of bicyclic diamines ‒ syntheses and properties of N,N'-bridged-1,10-diazabicyclooctadeca-5,14-diynes","Journal of the Chemical Society, Perkin Transactions 2","2000","","2","175","","10.1039/a907609c","","","0.71073","MoKα","","0.091","0.0499","","","0.1331","0.1515","","","","","","1.029","","","","has coordinates,has disorder","180369","2020-10-21","18:00:00",""
"7203899","16.5939","0.0008","28.3186","0.0013","8.6029","0.0004","90","","90","","90","","4042.6","0.3","200","2","200","2","","","","","","","","3","F d d 2","F 2 -2d","43","","(38)","","- C22 H36 N2 -","- C22 H36 N2 -","- C176 H288 N16 -","8","0.5","","von Hirschheydt, Thomas; Wolfart, Volker; Gleiter, Rolf; Irngartinger, Hermann; Oeser, Thomas; Rominger, Frank; Eisenträger, Frank","A short survey of bicyclic diamines ‒ syntheses and properties of N,N'-bridged-1,10-diazabicyclooctadeca-5,14-diynes","Journal of the Chemical Society, Perkin Transactions 2","2000","","2","175","","10.1039/a907609c","","","0.71073","MoKα","","0.0505","0.0406","","","0.1074","0.1144","","","","","","1.056","","","","has coordinates,has disorder","180369","2020-10-21","18:00:00",""
"7203900","16.0954","0.0004","33.2375","0.0009","7.8746","0.0002","90","","90","","90","","4212.68","0.19","200","2","200","2","","","","","","","","3","F d d 2","F 2 -2d","43","","(39)","","- C23 H38 N2 -","- C23 H38 N2 -","- C184 H304 N16 -","8","0.5","","von Hirschheydt, Thomas; Wolfart, Volker; Gleiter, Rolf; Irngartinger, Hermann; Oeser, Thomas; Rominger, Frank; Eisenträger, Frank","A short survey of bicyclic diamines ‒ syntheses and properties of N,N'-bridged-1,10-diazabicyclooctadeca-5,14-diynes","Journal of the Chemical Society, Perkin Transactions 2","2000","","2","175","","10.1039/a907609c","","","0.71073","MoKα","","0.0269","0.0245","","","0.0609","0.0624","","","","","","1.07","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203901","9.8034","0.0001","11.9812","0.0002","20.9007","0.0003","90","","91.531","0.001","90","","2454.05","0.06","200","2","200","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(42)","","- C26 H44 N2 -","- C26 H44 N2 -","- C104 H176 N8 -","4","1","","von Hirschheydt, Thomas; Wolfart, Volker; Gleiter, Rolf; Irngartinger, Hermann; Oeser, Thomas; Rominger, Frank; Eisenträger, Frank","A short survey of bicyclic diamines ‒ syntheses and properties of N,N'-bridged-1,10-diazabicyclooctadeca-5,14-diynes","Journal of the Chemical Society, Perkin Transactions 2","2000","","2","175","","10.1039/a907609c","","","0.71073","MoKα","","0.0544","0.0403","","","0.1002","0.1104","","","","","","1.02","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203902","8.899","0.003","12.364","0.004","20.155","0.006","104.35","0.03","94.56","0.03","99.02","0.03","2105.5","1.2","223","2","223","2","","","","","","","","4","P -1","-P 1","2","","1,10-Diaza-21-oxabicyclo[8.8.5]tricosa-5,14-diyne (43)","","- C20 H40 N2 O5 -","- C20 H36 N2 O3.625 -","- C80 H144 N8 O14.5 -","4","2","","von Hirschheydt, Thomas; Wolfart, Volker; Gleiter, Rolf; Irngartinger, Hermann; Oeser, Thomas; Rominger, Frank; Eisenträger, Frank","A short survey of bicyclic diamines ‒ syntheses and properties of N,N'-bridged-1,10-diazabicyclooctadeca-5,14-diynes","Journal of the Chemical Society, Perkin Transactions 2","2000","","2","175","","10.1039/a907609c","","","0.71073","MoKα","","0.119","0.0553","","","0.159","0.1878","","","","","","1.026","","","","has coordinates,has disorder","180370","2020-10-21","18:00:00",""
"7203903","8.9706","0.0001","20.6147","0.0003","11.4614","0.0001","90","","94.86","","90","","2111.89","0.04","200","2","200","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(44)","","- C22 H36 N2 O2 -","- C22 H36 N2 O2 -","- C88 H144 N8 O8 -","4","1","","von Hirschheydt, Thomas; Wolfart, Volker; Gleiter, Rolf; Irngartinger, Hermann; Oeser, Thomas; Rominger, Frank; Eisenträger, Frank","A short survey of bicyclic diamines ‒ syntheses and properties of N,N'-bridged-1,10-diazabicyclooctadeca-5,14-diynes","Journal of the Chemical Society, Perkin Transactions 2","2000","","2","175","","10.1039/a907609c","","","0.71073","MoKα","","0.0455","0.0352","","","0.0842","0.0904","","","","","","1.035","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203904","9.569","0.001","12.697","0.002","16.052","0.005","90","","98.82","0.02","90","","1927.2","0.7","223","2","223","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1,10-Diazabicyclo[8.8.6]tetracosa-5,14,21-triyne (46)","","- C22 H32 N2 -","- C22 H32 N2 -","- C88 H128 N8 -","4","1","","von Hirschheydt, Thomas; Wolfart, Volker; Gleiter, Rolf; Irngartinger, Hermann; Oeser, Thomas; Rominger, Frank; Eisenträger, Frank","A short survey of bicyclic diamines ‒ syntheses and properties of N,N'-bridged-1,10-diazabicyclooctadeca-5,14-diynes","Journal of the Chemical Society, Perkin Transactions 2","2000","","2","175","","10.1039/a907609c","","","0.71073","MoKα","","0.092","0.039","","","0.093","0.109","","","","","","1.009","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203905","12.177","0.002","9.875","0.002","8.532","0.001","90","","90","","90","","1026","0.3","293","2","293","2","","","","","","","","3","P 21 21 2","P 2 2ab","18","","1,10-Diazabicyclo[8.8.8]hexacosa-5,14,22-triyne (47)","","- C24 H36 N2 -","- C24 H36 N2 -","- C48 H72 N4 -","2","0.5","","von Hirschheydt, Thomas; Wolfart, Volker; Gleiter, Rolf; Irngartinger, Hermann; Oeser, Thomas; Rominger, Frank; Eisenträger, Frank","A short survey of bicyclic diamines ‒ syntheses and properties of N,N'-bridged-1,10-diazabicyclooctadeca-5,14-diynes","Journal of the Chemical Society, Perkin Transactions 2","2000","","2","175","","10.1039/a907609c","","","0.71073","MoKα","","0.0498","0.0348","","","0.0925","0.0993","","","","","","1.025","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203906","25.4676","0.0003","10.5968","0.0002","14.8576","0.0002","90","","93.62","0.001","90","","4001.7","0.1","200","2","200","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","(48)","","- C42 H68 N4 -","- C42 H68 N4 -","- C168 H272 N16 -","4","0.5","","von Hirschheydt, Thomas; Wolfart, Volker; Gleiter, Rolf; Irngartinger, Hermann; Oeser, Thomas; Rominger, Frank; Eisenträger, Frank","A short survey of bicyclic diamines ‒ syntheses and properties of N,N'-bridged-1,10-diazabicyclooctadeca-5,14-diynes","Journal of the Chemical Society, Perkin Transactions 2","2000","","2","175","","10.1039/a907609c","","","0.71073","MoKα","","0.058","0.0378","","","0.0891","0.0992","","","","","","1.023","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203907","6.9104","0.0002","15.8694","0.0005","13.2342","0.0004","90","","103.602","0.002","90","","1410.61","0.07","123","2","123","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C18 H16 O3 -","- C18 H16 O3 -","- C72 H64 O12 -","4","1","","Raston, Colin L.; Scott, Janet L.","Chemoselective, solvent-free aldol condensation reaction","Green Chemistry","2000","2","2","49","","10.1039/a907688c","","","0.71073","MoKα","","0.0844","0.0492","","","0.1063","0.1163","","","","","","1.061","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203908","7.272","0.0003","7.5704","0.0002","12.3802","0.0004","77.14","0.002","89.263","0.002","69.134","0.002","619.23","0.04","123","2","123","2","","","","","","","","3","P -1","-P 1","2","","","","- C18 H14 O -","- C18 H14 O -","- C36 H28 O2 -","2","1","","Raston, Colin L.; Scott, Janet L.","Chemoselective, solvent-free aldol condensation reaction","Green Chemistry","2000","2","2","49","","10.1039/a907688c","","","0.71073","MoKα","","0.0707","0.0466","","","0.1176","0.1345","","","","","","1.078","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203909","12.2718","0.0002","7.8706","0.0001","16.1076","0.0003","90","","102.299","0.001","90","","1520.07","0.04","123","2","123","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C21 H20 O -","- C21 H20 O -","- C84 H80 O4 -","4","1","","Raston, Colin L.; Scott, Janet L.","Chemoselective, solvent-free aldol condensation reaction","Green Chemistry","2000","2","2","49","","10.1039/a907688c","","","0.71073","MoKα","","0.0641","0.0448","","","0.1089","0.116","","","","","","1.053","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203910","10.337","0.002","15.297","0.0013","17.389","0.0006","90","","90","","90","","2749.6","0.6","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","N-[(2-Triphenylarsoniobenzylidene)]-1-amino-4-methoxybenzene iodide","","- C32 H27 As I N O -","- C32 H27 As I N O -","- C128 H108 As4 I4 N4 O4 -","4","1","","Allen, David W.; Mifflin, Joanne P.; Hursthouse, Michael B.; Coles, Simon; Hibbs, David E.; Malik, K. M. Abdul","A copper(i)-catalysed template synthesis of aryl-arsonium and -stibonium systems. Solvatochromic tetraaryl-arsonium and -stibonium iminophenolate betaines","Journal of Materials Chemistry","2000","10","2","457","","10.1039/a907699i","","","0.71069","MoKα","","0.0391","0.0326","","0.0766","0.0754","","","","0.881","0.947","0.947","","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203911","42.77","0.003","12.461","0.0017","19.025","0.001","90","","107.861","0.005","90","","9650.8","1.6","","","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C44 H76 N6 O10 -","- C44 H76 N6 O10 -","- C352 H608 N48 O80 -","8","1","","Nishimura, Kazukuni; Kondo, Tetsuo; Drozdova, Olga O.; Yamochi, Hideki; Saito, Gunzi","Preparation of metallic BEDT-TTF charge transfer complex of 3,3',5,5'-tetranitro-4,4'-biphenyldiol dianion (TNBP2−) having flexible molecular shape","Journal of Materials Chemistry","2000","10","4","911","","10.1039/a907746d","","","0.71073","MoKα","","0.0674","0.0674","","","0.1848","0.1848","","","","","","1.448","","","","has coordinates","192778","2020-10-21","18:00:00",""
"7203912","9.396","0.002","10.436","0.002","14.038","0.003","113.226","0.009","96.24","0.01","94.51","0.01","1246.3","0.5","","","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C60 H44 N4 O10 P2 -","- C60 H44 N4 O10 P2 -","- C60 H44 N4 O10 P2 -","1","0.5","","Nishimura, Kazukuni; Kondo, Tetsuo; Drozdova, Olga O.; Yamochi, Hideki; Saito, Gunzi","Preparation of metallic BEDT-TTF charge transfer complex of 3,3',5,5'-tetranitro-4,4'-biphenyldiol dianion (TNBP2−) having flexible molecular shape","Journal of Materials Chemistry","2000","10","4","911","","10.1039/a907746d","","","0.71073","MoK-alpha","","","0.068","","","0.071","","","","","1.299","1.299","","","","","has coordinates","192778","2020-10-21","18:00:00",""
"7203913","8.692","0.001","12.936","0.001","16.208","0.002","97.376","0.009","96.234","0.009","103.888","0.009","1736","0.3","","","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C52 H36 N4 O10 S32 -","- C52 H36 N4 O10 S32 -","- C52 H36 N4 O10 S32 -","1","0.5","","Nishimura, Kazukuni; Kondo, Tetsuo; Drozdova, Olga O.; Yamochi, Hideki; Saito, Gunzi","Preparation of metallic BEDT-TTF charge transfer complex of 3,3',5,5'-tetranitro-4,4'-biphenyldiol dianion (TNBP2−) having flexible molecular shape","Journal of Materials Chemistry","2000","10","4","911","","10.1039/a907746d","","","0.71073","MoK-alpha","","","0.065","","","0.063","","","","","2.308","2.308","","","","","has coordinates","192778","2020-10-21","18:00:00",""
"7203914","13.192","0.003","13.192","0.003","46.149","0.009","90","","90","","120","","6955","3","150","2","150","2","","","","","","","","7","R -3 c :H","-R 3 2""c","167","Co-DAF4","","","- C11.56 H26.43 Al7.35 Co1.65 N1.65 O37.05 P9 -","- C13.2 Al7.35 Co1.65 O37.04 P9 -","- C79.2 Al44.1 Co9.9 O222.24 P54 -","6","0.166667","","Barrett, P. A.; Jones, R. H.","Evidence for ordering of cobalt ions in the microporous solid acid catalyst CoDAF-4 by single crystal X-ray diffraction and resonant X-ray powder diffraction","Physical Chemistry Chemical Physics","2000","2","3","407","","10.1039/a907883e","","","0.71069","MoKα","","0.1128","0.0591","","0.1774","0.1453","","","","0.88","1.226","1.226","","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203915","13.314","0.0019","13.314","0.0019","6.8188","0.0014","90","","90","","90","","1208.7","0.3","293","2","293","2","","","","","","","","5","I -4 2 d","I -4 2bw","122","AlGe-NATROLITE","","","- Al1.87 Ge2.8 H2 Na2 O11.2 -","- Al1.865 Ge2.8 Na2 O12 -","- Al7.46 Ge11.2 Na8 O48 -","4","0.25","","Tripathi, Akhilesh; Johnson, Geoffrey M.; Jin Kim, Sun; Parise, John B.","Na2Al2Ge3O10·2H2O: an aluminogermanate with the tetranatrolite topology","Journal of Materials Chemistry","2000","10","2","451","","10.1039/a907933e","","","0.71073","MoKα","","0.0496","0.0463","","","0.1118","0.1132","","","","","","1.05","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203916","5.1195","0.001","9.171","0.0018","21.063","0.004","90","","92.94","0.03","90","","987.6","0.3","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C23 H20 N4 O2 -","- C23 H20 N4 O2 -","- C46 H40 N8 O4 -","2","1","","Darkins, Paul; Groarke, Michelle; McKervey, M. Anthony; Moncrieff, Hazel M.; McCarthy, Noreen; Nieuwenhuyzen, Mark","Enantiopure N-protected α-amino glyoxals 1. Synthesis from α-amino acids and some condensation reactions with amines","Journal of the Chemical Society, Perkin Transactions 1","2000","","3","381","","10.1039/a907948c","","","1.54178","CuKα","","0.0609","0.0483","","","0.1119","0.1196","","","","","","1.083","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203917","10.496","0.001","11.407","0.001","18.715","0.001","90","","91.53","0.01","90","","2239.9","0.3","228","2","228","2","","","","","","","recrystallized from hexane/ethyl acetate mixed solvents","4","P 1 21/n 1","-P 2yn","14","benzonitrile","","","- C14 H11 N O -","- C14 H11 N O -","- C112 H88 N8 O8 -","8","2","","Tandel, Sagun; Zhang, Hongming; Qadri, Nabil; Ford, George P.; Biehl, Edward R.","The synthesis of 2-arylmethyl-6-hydroxybenzenecarbonitriles from the base-mediated aryne reaction of bromophenols with arylacetonitriles","Journal of the Chemical Society, Perkin Transactions 1","2000","","4","587","","10.1039/a907980g","","","0.71073","MoKα","","0.0901","0.0468","","0.1385","0.1108","","","","1.014","1.093","1.093","","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203918","9.397","0.001","10.968","0.001","18.397","0.001","90","","91.52","0.01","90","","1895.4","0.3","100","0.1","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","triphenylphosphonium benzylide","","- C25 H21 P -","- C25 H21 P -","- C100 H84 P4 -","4","1","","Yufit, Dmitrii S.; Howard, Judith A. K.; Davidson, Matthew G.","Bonding in phosphorus ylides: topological analysis of experimental charge density distribution in triphenylphosphonium benzylide †","Journal of the Chemical Society, Perkin Transactions 2","2000","","2","249","","10.1039/a908099f","","","0.71073","MoKα","","","0.022","","","","0.017","","","","","","0.72","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203919","10.067","0.002","10.796","0.002","13.606","0.003","97.28","0.03","96.24","0.03","97.08","0.03","1444","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","N,N'-ethylenebis(1,5-diphenyl-2,4-pentanedione)","","- C36 H36 N2 O2 -","- C36 H36 N2 O2 -","- C72 H72 N4 O4 -","2","1","","Pulkkinen, Juha T.; Laatikainen, Reino; Ahlgrén, Markku J.; Peräkylä, Mikael; Vepsäläinen, Jouko J.","Conformational flexibility and role of aromatic‒aromatic interactions in the crystal packing of the coordination compounds of some novel quadridentate Schiff bases","Journal of the Chemical Society, Perkin Transactions 2","2000","","4","777","","10.1039/a908101a","","","0.71073","MoKα","","0.2157","0.074","","","0.105","0.1256","","","","","","0.975","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203920","10.035","0.003","12.473","0.003","12.724","0.004","69.94","0.03","81.79","0.03","83.42","0.03","1477","0.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","N,N'-ethylenebis(1,5-diphenyl-2,5-pentanedioneiminato)nickel(II)","","- C36 H34 N2 Ni O2 -","- C36 H34 N2 Ni O2 -","- C72 H68 N4 Ni2 O4 -","2","1","","Pulkkinen, Juha T.; Laatikainen, Reino; Ahlgrén, Markku J.; Peräkylä, Mikael; Vepsäläinen, Jouko J.","Conformational flexibility and role of aromatic‒aromatic interactions in the crystal packing of the coordination compounds of some novel quadridentate Schiff bases","Journal of the Chemical Society, Perkin Transactions 2","2000","","4","777","","10.1039/a908101a","","","0.71073","MoKα","","0.1056","0.0773","","","0.0872","0.0908","","","","","","1.683","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203921","9.811","0.001","11.872","0.004","12.858","0.002","86.73","0.02","81.97","0.01","83.69","0.02","1472.7","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","N,N'-ethylenebis(1,5-diphenyl-2,5-pentanedioneiminato)cobalt(II)","","- C36 H34 Co N2 O2 -","- C36 H34 Co N2 O2 -","- C72 H68 Co2 N4 O4 -","2","1","","Pulkkinen, Juha T.; Laatikainen, Reino; Ahlgrén, Markku J.; Peräkylä, Mikael; Vepsäläinen, Jouko J.","Conformational flexibility and role of aromatic‒aromatic interactions in the crystal packing of the coordination compounds of some novel quadridentate Schiff bases","Journal of the Chemical Society, Perkin Transactions 2","2000","","4","777","","10.1039/a908101a","","","0.71073","MoKα","","0.0543","0.0354","","","0.0847","0.0892","","","","","","1.036","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203922","25.85","0.005","13.195","0.003","8.711","0.002","90","","93.26","0.03","90","","2966.4","1.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N,N'-Ethylenebis(1,5-diphenyl-2,5-pentanedioneiminato)copper(II)","","- C36 H34 Cu N2 O2 -","- C36 H34 Cu N2 O2 -","- C144 H136 Cu4 N8 O8 -","4","1","","Pulkkinen, Juha T.; Laatikainen, Reino; Ahlgrén, Markku J.; Peräkylä, Mikael; Vepsäläinen, Jouko J.","Conformational flexibility and role of aromatic‒aromatic interactions in the crystal packing of the coordination compounds of some novel quadridentate Schiff bases","Journal of the Chemical Society, Perkin Transactions 2","2000","","4","777","","10.1039/a908101a","","","0.71073","MoKα","","0.156","0.0509","","","0.073","0.0851","","","","","","0.727","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203923","10.165","0.001","11.118","0.002","15.414","0.002","75.32","0.02","88.28","0.02","88.59","0.02","1684.1","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","N,N'-Ethylenebis(1,5-diphenyl-2,5-pentanedioneiminato)nickel(II) pyridine solvate","","- C41 H39 N3 Ni O2 -","- C41 H39 N3 Ni O2 -","- C82 H78 N6 Ni2 O4 -","2","1","","Pulkkinen, Juha T.; Laatikainen, Reino; Ahlgrén, Markku J.; Peräkylä, Mikael; Vepsäläinen, Jouko J.","Conformational flexibility and role of aromatic‒aromatic interactions in the crystal packing of the coordination compounds of some novel quadridentate Schiff bases","Journal of the Chemical Society, Perkin Transactions 2","2000","","4","777","","10.1039/a908101a","","","0.71073","MoKα","","0.079","0.0298","","","0.0592","0.063","","","","","","0.505","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203924","40.3445","0.0008","40.3445","0.0008","13.9251","0.0008","90","","90","","120","","19629","1.3","293","2","293","2","","","","","","","","5","R -3 :H","-R 3","148","","N,N'-Ethylenebis[1,5-di-(1-naphthyl)-2,5-pentanedioneiminato]-nickel(II)","","- C52 H42 N2 Ni O2 -","- C52 H42 N2 Ni O2 -","- C936 H756 N36 Ni18 O36 -","18","1","","Pulkkinen, Juha T.; Laatikainen, Reino; Ahlgrén, Markku J.; Peräkylä, Mikael; Vepsäläinen, Jouko J.","Conformational flexibility and role of aromatic‒aromatic interactions in the crystal packing of the coordination compounds of some novel quadridentate Schiff bases","Journal of the Chemical Society, Perkin Transactions 2","2000","","4","777","","10.1039/a908101a","","","0.71073","MoKα","","0.156","0.0617","","","0.1119","0.1293","","","","","","1.096","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203925","12.369","0.003","13.674","0.002","12.38","0.0016","90","","90","","90","","2093.9","0.7","293","2","293","2","","","","","","","","4","C 2 2 21","C 2c 2","20","","","","- C16 H32 Pd2 S2 -","- C16 H32 Pd2 S2 -","- C64 H128 Pd8 S8 -","4","0.5","","Singhal, A.; Jain, V. K.; Mishra, R.; Varghese, Babu","Organochalcogenido-bridged dimeric 2-methylallylpalladium complexes: synthesis, structure and their transformation into palladium chalcogenides","Journal of Materials Chemistry","2000","10","5","1121","","10.1039/a908133j","","","0.71073","MoKα","","0.0213","0.0184","","","0.0448","0.047","","","","","","1.189","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203926","8.148","0.001","15.388","0.002","22.658","0.003","96.086","0.009","96.34","0.01","95.26","0.011","2792.2","0.6","293","2","293","2","","","","","","","synthesis","4","P -1","-P 1","2","","","","- C114 H88 N40 Se6 -","- C114 H88 N40 Se6 -","- C114 H88 N40 Se6 -","1","0.5","","Devillanova, Francesco A.; Garau, Alessandra; Isaia, Francesco; Lippolis, Vito; Verani, Gaetano; Cornia, Andrea; Fabretti, Antonio C.; Girlando, Alberto","Reaction of N,N'-dimethylimidazolidine-2-selone (4) with TCNQ. Characterisation and X-ray crystal structure of the mixed-valence compound 4·(TCNQ)1.167","Journal of Materials Chemistry","2000","10","6","1281","","10.1039/a908136d","","","0.71069","MoKα","","0.0849","0.0442","","","0.1006","0.1274","","","","","","1.055","","","","has coordinates,has disorder","180370","2020-10-21","18:00:00",""
"7203927","8.924","0.001","9.155","0.001","11.963","0.002","90.53","0.02","92.119","0.015","96.561","0.015","970.2","0.2","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C26 H23 O2 -","- C26 H23 O2 -","- C52 H46 O4 -","2","1","","Edwin Weber; Thomas Hens; Thomas Brehmer; Ingeborg Csöregh","Crystalline inclusion compounds of hosts composed of anthracene, ethylene and crowded alcoholic building blocks","J. Chem. Soc., Perkin Trans. 2","2000","","2","235","241","10.1039/a908151h","","","0.71073","MoKa","","0.0583","0.0358","","0.0915","0.0823","","","","0.901","0.996","0.996","","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203928","11.5927","0.0003","12.8758","0.0005","14.0251","0.0004","90","","105.162","0.002","90","","2020.59","0.11","291","2","291","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C50 H42 O4 -","- C50 H42 O4 -","- C100 H84 O8 -","2","0.5","","Edwin Weber; Thomas Hens; Thomas Brehmer; Ingeborg Csöregh","Crystalline inclusion compounds of hosts composed of anthracene, ethylene and crowded alcoholic building blocks","J. Chem. Soc., Perkin Trans. 2","2000","","2","235","241","10.1039/a908151h","","","1.5418","CuKa","","0.0784","0.0583","","0.1919","0.159","","","","1.059","1.156","1.156","","","","","has coordinates","209504","2020-10-21","18:00:00",""
"7203929","8.4","0.001","8.88","0.001","13.45","0.002","82.33","0.02","71.63","0.02","76.64","0.02","924.4","0.2","102","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C25 H19 O2 -","- C25 H19 O2 -","- C50 H38 O4 -","2","1","","Edwin Weber; Thomas Hens; Thomas Brehmer; Ingeborg Csöregh","Crystalline inclusion compounds of hosts composed of anthracene, ethylene and crowded alcoholic building blocks","J. Chem. Soc., Perkin Trans. 2","2000","","2","235","241","10.1039/a908151h","","","0.71073","MoKa","","0.0462","0.0348","","0.1002","0.0923","","","","1.052","1.097","1.097","","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203930","8.2243","0.0005","10.4546","0.0008","14.535","0.003","80.443","0.007","84.476","0.008","70.578","0.005","1161.1","0.3","253","","253","","","","","","","","","5","P -1","-P 1","2","","(2S*,9S*)-2-Benzenesulfonyl-12-(toluene-4-sulfonyl)-12-aza- bicyclo[7.2.1]dodeca-1(11)-ene","","?","- C24 H29 N O4 S2 -","- C48 H58 N2 O8 S4 -","2","1","","Bamford, Samantha J.; Goubitz, Kees; van Lingen, Hester L.; Luker, Tim; Schenk, Henk; Hiemstra, Henk","Formation of medium-size bridged ring systems via ring-closing metathesis of 2,5-disubstituted-2,3-dihydro-1H-pyrroles","Journal of the Chemical Society, Perkin Transactions 1","2000","","3","345","","10.1039/a908272g","","","1.5418","Cu-Kα","","0.086","0.07","","0.071","0.064","","","","0.921","0.937","0.937","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7203931","6.7596","0.0007","8.7092","0.001","26.1866","0.0019","90","","90","","90","","1541.6","0.3","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C12 H18 Cl N O6 -","- C12 H18 Cl N O6 -","- C48 H72 Cl4 N4 O24 -","4","1","","Hall, Adrian; Bailey, Patrick D.; Rees, David C.; Rosair, Georgina M.; Wightman, Richard H.","α-Chloronitroso compounds derived from carbohydrate ketones: cycloadditions with cyclic dienes, a synthesis of (−)-physoperuvine and a formal synthesis of (+)-epibatidine","Journal of the Chemical Society, Perkin Transactions 1","2000","","3","329","","10.1039/a908333b","","","0.71073","MoKα","","0.1161","0.0562","","","0.1194","0.1478","","","","","","1.006","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203932","9.92","0.001","10.103","0.001","25.963","0.002","90","","90","","90","","2602.1","0.4","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C24 H30 Cl N O5 Si -","- C24 H30 Cl N O5 Si -","- C96 H120 Cl4 N4 O20 Si4 -","4","1","","Hall, Adrian; Bailey, Patrick D.; Rees, David C.; Rosair, Georgina M.; Wightman, Richard H.","α-Chloronitroso compounds derived from carbohydrate ketones: cycloadditions with cyclic dienes, a synthesis of (−)-physoperuvine and a formal synthesis of (+)-epibatidine","Journal of the Chemical Society, Perkin Transactions 1","2000","","3","329","","10.1039/a908333b","","","0.71073","MoKα","","0.1265","0.0582","","","0.0972","0.1201","","","","","","1.011","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203933","10.005","0.001","12.53","0.001","23.255","0.002","90","","90","","90","","2915.3","0.4","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C29 H36 Cl N O5 Si -","- C29 H36 Cl N O5 Si -","- C116 H144 Cl4 N4 O20 Si4 -","4","1","","Hall, Adrian; Bailey, Patrick D.; Rees, David C.; Rosair, Georgina M.; Wightman, Richard H.","α-Chloronitroso compounds derived from carbohydrate ketones: cycloadditions with cyclic dienes, a synthesis of (−)-physoperuvine and a formal synthesis of (+)-epibatidine","Journal of the Chemical Society, Perkin Transactions 1","2000","","3","329","","10.1039/a908333b","","","0.71073","MoKα","","0.2034","0.0677","","","0.1042","0.1465","","","","","","0.978","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203934","38.065","0.002","15.1021","0.0004","26.5383","0.0012","90","","100.147","0.001","90","","15017.2","1.1","123","2","123","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C90 H90 O15 -","- C90 H83 O15 -","- C720 H664 O120 -","8","1","","Arnaud-Neu, Françoise; Asfari, Zouhair; Souley, Bahari; Vicens, Jacques; Thuéry, Pierre; Nierlich, Martine","Pentaalkyl ester derivatives of p-benzylcalix[5]arene and p-tert-octylcalix[5]arene: synthesis, crystal structure and metal ion complexation","Journal of the Chemical Society, Perkin Transactions 2","2000","","3","495","","10.1039/a908336g","","","0.71073","MoKα","","0.1485","0.0876","","0.2369","0.1751","","","","1.153","1.166","1.166","","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203935","6.1029","0.0016","13.105","0.002","14.153","0.002","90","","94.418","0.015","90","","1128.6","0.4","160","2","160","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C25 H31 F O6 -","- C25 H31 F O6 -","- C50 H62 F2 O12 -","2","1","","Keith Biggadike; Sean M. Lynn; Panayiotis A. Procopiou; Rupert E. Shaw; Christopher Williamson","Novel glucocorticoid antedrugs possessing a C16,17-fused γ-lactone ring","J. Chem. Soc., Perkin Trans. 1","2000","","5","813","818","10.1039/a908358h","","","1.54184","CuKα","","0.1104","0.073","","0.1973","0.1707","","","","1.043","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203936","10.032","0.002","10.9","0.002","24.779","0.005","90","","90","","90","","2709.6","0.9","133","2","133","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Kendomycin","","","- C29 H42 O6 -","- C29 H42 O6 -","- C116 H168 O24 -","4","1","","Bode, Helge B.; Zeeck, Axel","Structure and biosynthesis of kendomycin, a carbocyclic ansa-compound from Streptomyces","Journal of the Chemical Society, Perkin Transactions 1","2000","","3","323","","10.1039/a908387a","","","0.71073","MoKα","","0.0655","0.0441","","","0.0864","0.0925","","","","","","1.03","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203937","6.2928","0.0009","19.505","0.003","10.367","0.002","90","","96.581","0.014","90","","1264.1","0.4","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H14 O3 S2 -","- C12 H14 O3 S2 -","- C48 H56 O12 S8 -","4","1","","Blake, Alexander J.; Cooke, Paul A.; Kendall, Jackie D.; Simpkins, Nigel S.; Westaway, Susan M.","Concerning the synthesis and enantioselective rearrangements of episulfoxides","Journal of the Chemical Society, Perkin Transactions 1","2000","","2","153","","10.1039/a908391j","","","0.71073","MoKα","","0.0625","0.0447","","0.1104","0.0969","","","","1.16","1.148","1.148","","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203938","9.907","0.007","5.888","0.004","12.317","0.006","90","","103.06","0.05","90","","699.9","0.8","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C13 H16 O4 S2 -","- C13 H16 O4 S2 -","- C26 H32 O8 S4 -","2","1","","Blake, Alexander J.; Cooke, Paul A.; Kendall, Jackie D.; Simpkins, Nigel S.; Westaway, Susan M.","Concerning the synthesis and enantioselective rearrangements of episulfoxides","Journal of the Chemical Society, Perkin Transactions 1","2000","","2","153","","10.1039/a908391j","","","0.71073","MoKα","","0.0298","0.0264","","0.0641","0.0611","","","","1.118","1.096","1.096","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7203939","6.101","0.002","8.826","0.004","7.894","0.003","90","","98.54","0.03","90","","420.4","0.3","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C8 H12 O2 S -","- C8 H12 O2 S -","- C16 H24 O4 S2 -","2","1","","Blake, Alexander J.; Cooke, Paul A.; Kendall, Jackie D.; Simpkins, Nigel S.; Westaway, Susan M.","Concerning the synthesis and enantioselective rearrangements of episulfoxides","Journal of the Chemical Society, Perkin Transactions 1","2000","","2","153","","10.1039/a908391j","","","0.71073","MoKα","","0.0567","0.0522","","","0.1364","0.142","","","","","","1.075","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7203940","10.8001","0.0009","11.016","0.0009","12.4143","0.0009","107.851","0.005","100.953","0.005","96.477","0.007","1356.9","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C66 H44 Cl4 O8 -","- C66 H40 Cl4 O8 -","- C66 H40 Cl4 O8 -","1","0.5","","Baxter, Ian; Colquhoun, Howard M.; Hodge, Philip; Kohnke, Franz H.; Lewis, David F.; Williams, David J.","Macrocyclic oligomers of the aromatic polyetherketone “PK99”: synthesis, fractionation, structural characterisation and ring-opening polymerisation","Journal of Materials Chemistry","2000","10","2","309","","10.1039/a908414b","","","1.54178","CuKα","","0.0832","0.0638","","0.2081","0.1754","","","","1.042","1.092","1.092","","","","","has coordinates,has disorder","180370","2020-10-21","18:00:00",""
"7203941","11.836","0.001","19.401","0.002","10.58","0.001","90","","110.81","0.01","90","","2271","0.4","288.2","","288.2","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C26 H28 N2 O2 Sn -","- C26 H28 N2 O2 Sn0.5 -","- C104 H112 N8 O8 Sn2 -","4","0.5","","Kitamura, Chitoshi; Maeda, Naoyuki; Kamada, Noboru; Ouchi, Mikio; Yoneda, Akio","Synthesis of 2-(substituted methyl)quinolin-8-ols and their complexation with Sn(II)","Journal of the Chemical Society, Perkin Transactions 1","2000","","5","781","","10.1039/a908636f","","","0.7107","MoKα","","0.0498","0.05","","0.067","","0.067","","","2.781","","","2.78","","","","has coordinates","277929","2022-09-16","21:37:38",""
"7203942","11.198","0.004","9.393","0.002","15.277","0.004","90","","90","","90","","1606.9","0.8","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C6 N6 O3 -","- C6 N6 O3 -","- C48 N48 O24 -","8","1","","Barbieux-Flammang, Monique; Vandevoorde, Séverine; Flammang, Robert; Wong, Ming Wah; Bibas, Hervé; Kennard, Colin H. L.; Wentrup, Curt","Monomer, dimers and trimers of cyanogen N-oxide, NC‒CN→O. An X-ray, FVT-MS/IR and theoretical investigation","Journal of the Chemical Society, Perkin Transactions 2","2000","","3","473","","10.1039/a908653f","","","0.71073","MoKα","","0.2762","0.0928","","","0.2057","0.3034","","","","","","0.963","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203943","6.093","0.003","7.5041","0.0008","9.297","0.004","90","","108.35","0.02","90","","403.5","0.3","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C6 N6 O3 -","- C6 N6 O3 -","- C12 N12 O6 -","2","1","","Barbieux-Flammang, Monique; Vandevoorde, Séverine; Flammang, Robert; Wong, Ming Wah; Bibas, Hervé; Kennard, Colin H. L.; Wentrup, Curt","Monomer, dimers and trimers of cyanogen N-oxide, NC‒CN→O. An X-ray, FVT-MS/IR and theoretical investigation","Journal of the Chemical Society, Perkin Transactions 2","2000","","3","473","","10.1039/a908653f","","","0.71073","MoKα","","0.0616","0.0569","","","0.1483","0.1547","","","","","","1.051","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203944","7.046","0.001","7.204","0.001","31.591","0.004","90","","90","","90","","1603.5","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Ro 67-3926","3-Hydroxy-2-hydroxymethyl-10-phenyl-2,3,9,10-tetrahydro-1- oxa-9-aza-anthrazen-4-one","","- C19 H17 N O4 -","- C19 H17 N O4 -","- C76 H68 N4 O16 -","4","1","","Scheffler, Götz; Montavon, Francois; Hennig, Michael; Wessel, Hans Peter","Carbohydrate α-oxoketene N,O-ketals in the synthesis of dihydroquinolines","Journal of the Chemical Society, Perkin Transactions 1","2000","","5","753","","10.1039/a908806g","","","1.54178","CuKα","","0.057","0.0559","","","0.1519","0.1529","","","","","","1.137","","","","has coordinates,has disorder","180370","2020-10-21","18:00:00",""
"7203945","23.144","0.002","11.273","0.002","12.357","0.001","90","","114.86","0.01","90","","2925.2","0.7","193","2","193","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C28 H27 Cl4 N O8 -","- C28 H27 Cl4 N O8 -","- C112 H108 Cl16 N4 O32 -","4","1","","Scheffler, Götz; Montavon, Francois; Hennig, Michael; Wessel, Hans Peter","Carbohydrate α-oxoketene N,O-ketals in the synthesis of dihydroquinolines","Journal of the Chemical Society, Perkin Transactions 1","2000","","5","753","","10.1039/a908806g","","","1.54178","CuKα","","0.0603","0.0586","","","0.1602","0.1627","","","","","","1.048","","","","has coordinates,has disorder","180370","2020-10-21","18:00:00",""
"7203946","11.953","0.004","14.701","0.002","13.917","0.004","90","","93.77","0.02","90","","2440.2","1.1","294","","294","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H12 Cl O4 S12 -","- C15 H8 Cl O4 S12 -","- C60 H32 Cl4 O16 S48 -","4","1","","Le Moustarder, S.; Hudhomme, P.; Durand, C.; Mercier, N.; Azcondo, M. T.; Delhaes, P.; Riou, A.; Gorgues, A.","First radical cation salts from the symmetrical outer S‐position isomer of BEDT-TTF","Journal of Materials Chemistry","2000","10","3","617","","10.1039/a908843a","","","0.71073","Mo-Kα","","0.067","0.051","","0.086","0.08","","","","2.229","2.122","2.122","","","","","has coordinates","288529","2023-12-23","19:34:17",""
"7203947","11.91","0.008","14.579","0.008","13.771","0.002","90","","94.28","0.02","90","","2384","2","294","","294","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H12 B F4 S12 -","- C15 H11.44 B F4 S12 -","- C60 H45.76 B4 F16 S48 -","4","1","","Le Moustarder, S.; Hudhomme, P.; Durand, C.; Mercier, N.; Azcondo, M. T.; Delhaes, P.; Riou, A.; Gorgues, A.","First radical cation salts from the symmetrical outer S‐position isomer of BEDT-TTF","Journal of Materials Chemistry","2000","10","3","617","","10.1039/a908843a","","","0.71073","Mo-Kα","","0.065","0.048","","0.061","0.05","","","","2.354","2.012","2.012","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203948","5.417","0.007","17.75","0.01","20.71","0.01","90","","96.94","0.02","90","","1977","3","294","","294","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H4 Cu N2 S10 -","- C12 H4 Cu N2 S10 -","- C48 H16 Cu4 N8 S40 -","4","1","","Le Moustarder, S.; Hudhomme, P.; Durand, C.; Mercier, N.; Azcondo, M. T.; Delhaes, P.; Riou, A.; Gorgues, A.","First radical cation salts from the symmetrical outer S‐position isomer of BEDT-TTF","Journal of Materials Chemistry","2000","10","3","617","","10.1039/a908843a","","","0.71073","Mo-Kα","","0.203","0.056","","0.352","0.069","","","","","1.418","1.418","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203949","45.381","0.001","5.1771","0.0007","18.266","0.001","90","","106.293","0.006","90","","4119.1","0.6","298","2","","","","","","","","","","2","C 1 2/c 1","-C 2yc","15","","Dibenzo[fg,ij]phenanthro[3,2,1,10,9-pqrst]pentaphene","","- C36 H18 -","- C36 H18 -","- C288 H144 -","8","1","","Kübel, Christian; Eckhardt, Karin; Enkelmann, Volker; Wegner, Gerhard; Müllen, Klaus","Synthesis and crystal packing of large polycyclic aromatic hydrocarbons: hexabenzo[bc,ef,hi,kl,no,qr]coronene and dibenzo[fg,ij]phenanthro[9,10,1,2,3-pqrst]pentaphene","Journal of Materials Chemistry","2000","10","4","879","","10.1039/a908941a","","","1.5418","CuKα","","","0.047","","","0.057","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203950","10.453","0.004","23.017","0.009","12.223","0.003","90","","102.83","0.03","90","","2867.4","1.8","293","","293","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C15 H26 O3 -","- C15 H26 O3 -","- C120 H208 O24 -","8","2","","Muri, Estela; Kanazawa, Alice; Barreiro, Eliezer; Greene, Andrew E.","Asymmetric synthesis of 3β-angeloyloxy-4β-hydroxyeudesman-8-one, purported sesquiterpene from Pluchea quitoc †","Journal of the Chemical Society, Perkin Transactions 1","2000","","5","731","","10.1039/a909112b","","","0.7107","MoKα","","0.0627","0.0627","","0.0595","","0.0595","","","2.663","","","2.663","","","","has coordinates","193981","2020-10-21","18:00:00",""
"7203951","21.722","0.002","21.722","0.002","7.448","0.002","90","","90","","90","","3514.3","1","291.2","","293","","","","","","","","","5","P 42/n :2","-P 4bc","86","","","","- C92 H52 Fe2 N20 P -","- C92 H52 Fe2 N20 P -","- C184 H104 Fe4 N40 P2 -","2","0.25","","Matsuda, Masaki; Naito, Toshio; Inabe, Tamotsu; Hanasaki, Noriaki; Tajima, Hiroyuki; Otsuka, Takeo; Awaga, Kunio; Narymbetov, Bakhyt; Kobayashi, Hayao","A one-dimensional macrocyclic π‐ligand conductor carrying a magnetic center. Structure and electrical, optical and magnetic properties of TPP[Fe(Pc)(CN)2]2 {TPP = tetraphenylphosphonium and [Fe(Pc)(CN)2] = dicyano(phthalocyaninato)iron(iii)}","Journal of Materials Chemistry","2000","10","3","631","","10.1039/a909159i","","","0.7107","MoKα","","0.0358","0.0358","","","0.0385","0.0385","","","","","","2.45","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203952","5.0715","0.0006","7.5286","0.0011","9.1496","0.0011","72.441","0.003","85.679","0.002","70.48","0.002","313.8","0.07","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C2 H14 F Fe N2 Nb O11 P2 -","- C2 H14 F Fe N2 Nb O11 P2 -","- C2 H14 F Fe N2 Nb O11 P2 -","1","0.5","","Wang, Xiqu; Liu, Lumei; Cheng, Heidi; Ross, Kent; Jacobson, Allan J.","Synthesis and crystal structures of [H3N(CH2)2NH3]NbMOF(PO4)2(H2O)2, M = Fe,Co and [H3N(CH2)2NH3]Ti(Fe0.9Cr0.1)(F1.3O0.7)(H0.3PO4)2(H2O)2","Journal of Materials Chemistry","2000","10","5","1203","","10.1039/a909193i","","","0.71073","MoKα","","0.049","0.0473","","0.1138","0.1131","","","","1.313","1.331","1.331","","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203953","5.0469","0.0005","7.487","0.0008","9.1217","0.001","72.486","0.002","85.679","0.002","70.8","0.002","310.31","0.06","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C2 H14 Co F N2 Nb O11 P2 -","- C2 H14 Co F N2 Nb O11 P2 -","- C2 H14 Co F N2 Nb O11 P2 -","1","0.5","","Wang, Xiqu; Liu, Lumei; Cheng, Heidi; Ross, Kent; Jacobson, Allan J.","Synthesis and crystal structures of [H3N(CH2)2NH3]NbMOF(PO4)2(H2O)2, M = Fe,Co and [H3N(CH2)2NH3]Ti(Fe0.9Cr0.1)(F1.3O0.7)(H0.3PO4)2(H2O)2","Journal of Materials Chemistry","2000","10","5","1203","","10.1039/a909193i","","","0.71073","MoKα","","0.0599","0.0569","","0.1337","0.1323","","","","1.312","1.327","1.327","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203954","5.1584","0.001","7.4556","0.0014","9.089","0.002","63.87","0.03","80.6","0.03","69.79","0.03","294.48","0.14","293","2","293","2","","","","","","","","9","P -1","-P 1","2","","","","- C2 H14.3 Cr0.1 F1.3 Fe0.9 N2 O10.7 P2 Ti -","- C H5 Cr0.07 F0.65 Fe0.43 N O5.35 P Ti0.5 -","- C2 H10 Cr0.14 F1.3 Fe0.86 N2 O10.7 P2 Ti -","2","1","","Wang, Xiqu; Liu, Lumei; Cheng, Heidi; Ross, Kent; Jacobson, Allan J.","Synthesis and crystal structures of [H3N(CH2)2NH3]NbMOF(PO4)2(H2O)2, M = Fe,Co and [H3N(CH2)2NH3]Ti(Fe0.9Cr0.1)(F1.3O0.7)(H0.3PO4)2(H2O)2","Journal of Materials Chemistry","2000","10","5","1203","","10.1039/a909193i","","","0.71073","MoKα","","0.1548","0.0976","","0.2413","0.2103","","","","1.076","1.186","1.186","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203955","17.739","","21.05","","16.878","","108.7","","103.6","","72.7","","5631.07","","293","","293","","","","","","","","","4","P -1","-P 1","2","","","","- C97 H130 Cl2 O10 -","- C97 H120 Cl2 O10 -","- C194 H240 Cl4 O20 -","2","1","","Geraci, Corrada; Bottino, Alessandra; Piattelli, Mario; Gavuzzo, Enrico; Neri, Placido","Interplay between cone and partial-cone geometry in doubly-bridged calix[8]arenes investigated by X-ray and 2D NMR","Journal of the Chemical Society, Perkin Transactions 2","2000","","2","185","","10.1039/a909410e","","","1.54178","CuKα","","0.147","0.147","","0.154","0.154","","","","1.126","1.126","1.126","","","","","has coordinates","209359","2020-10-21","18:00:00",""
"7203956","9.404","0.003","16.703","0.004","5.777","0.001","96.67","0.02","107.37","0.02","83.96","0.02","857.8","0.4","193.2","","193.2","","","","","","","","","5","P -1","-P 1","2","","","","- C20 H19 O P Se -","- C20 H19 O P Se -","- C40 H38 O2 P2 Se2 -","2","1","","Murai, Toshiaki; Izumi, Chiyoko; Itoh, Toshihide; Kato, Shinzi","Reactions of selenothioic acid S-esters with trivalent phosphorus compounds: new synthetic methods for α-phosphoryl alkyl sulfides and alkyl selenides","Journal of the Chemical Society, Perkin Transactions 1","2000","","6","917","","10.1039/a909469e","","","0.7107","MoKα","","0.0344","0.0344","","","0.0363","0.0363","","","","","","1.456","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203957","8.254","0.0016","11.229","0.0015","20.088","0.002","90","","90","","90","","1861.8","0.5","123","2","123","2","","","","","","","","3","P b n a","-P 2ac 2b","60","","","","- C9 H18 O2 -","- C9 H18 O2 -","- C72 H144 O16 -","8","1","","Johnston, Derek; McCusker, Catherine F.; Muir, Kenneth; Procter, David J.","Samarium(II)-mediated 4-exo-trig cyclisations of unsaturated aldehydes. A stereoselective approach to functionalised cyclobutanols","Journal of the Chemical Society, Perkin Transactions 1","2000","","5","681","","10.1039/a909549g","","","0.71073","MoKα","","0.0977","0.0505","","","0.1181","0.1405","","","","","","1.026","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203958","12.432","0.001","12.893","0.001","22.148","0.002","90","","90","","90","","3550.01","","160","","0","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C42 H42 N4 O2 -","- C42 H42 N4 O2 -","- C168 H168 N16 O8 -","4","1","","Averseng, Frédéric; Lacroix, Pascal G.; Malfant, Isabelle; Dahan, Françoise; Nakatani, Keitaro","Synthesis, crystal structure and solid state NLO properties of a new chiral bis(salicylaldiminato)nickel(ii) Schiff-base complex in a nearly optimized solid state environment","Journal of Materials Chemistry","2000","10","4","1013","","10.1039/a910244m","","","0.71073","MoKα","","","0.0913","","","0.08","","","","","1.1412","1.1412","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7203959","13.66","0.002","10.601","0.002","12.34","0.002","90","","112.086","0.011","90","","1655.83","","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C36 H40 N4 Ni O2 -","- C36 H40 N4 Ni O2 -","- C72 H80 N8 Ni2 O4 -","2","1","","Averseng, Frédéric; Lacroix, Pascal G.; Malfant, Isabelle; Dahan, Françoise; Nakatani, Keitaro","Synthesis, crystal structure and solid state NLO properties of a new chiral bis(salicylaldiminato)nickel(ii) Schiff-base complex in a nearly optimized solid state environment","Journal of Materials Chemistry","2000","10","4","1013","","10.1039/a910244m","","","0.71073","MoKα","","0.0509","0.0352","","0.0632","0.0568","","","","1.076","1.115","1.115","","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203960","12.9998","0.001","16.1021","0.0016","36.377","0.003","90","","90","","90","","7614.58","","180","","180","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C88 H88 N8 Ni3 O9 -","- C88 H88 N8 Ni3 O9 -","- C352 H352 N32 Ni12 O36 -","4","1","","Averseng, Frédéric; Lacroix, Pascal G.; Malfant, Isabelle; Dahan, Françoise; Nakatani, Keitaro","Synthesis, crystal structure and solid state NLO properties of a new chiral bis(salicylaldiminato)nickel(ii) Schiff-base complex in a nearly optimized solid state environment","Journal of Materials Chemistry","2000","10","4","1013","","10.1039/a910244m","","","0.71073","MoKα","","0.1035","0.0776","","","0.1862","0.208","","","","","","1.025","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203961","17.776","0.005","18.613","0.009","10.124","0.003","90","","123.51","0.03","90","","2793","2","296.2","","296.2","","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C54 H36 Cl4 N10 O12 Zn2 -","- C27 H18 Cl2 N5 O6 Zn0.5 -","- C108 H72 Cl8 N20 O24 Zn2 -","4","1","","Evans, Cara C.; Masse, René; Nicoud, Jean-François; Bagieu-Beucher, Muriel","A new octupolar material for quadratic nonlinear optics: tris(2,2'-bipyridyl)Zn(ii) tetrakis(2-chloro-4-nitrophenolate)Zn(ii)","Journal of Materials Chemistry","2000","10","6","1419","","10.1039/b000417k","","","0.7107","MoKα","","0.0356","0.036","","0.039","","0.039","","","1.436","","","1.44","","","","has coordinates","277931","2022-09-16","22:15:54",""
"7203962","11.2655","0.0006","16.7247","0.0008","9.6229","0.0004","94.18","0.003","109","1","106.026","0.003","1621","12","296.2","","296.2","","","","","","","","","6","P -1","-P 1","2","","","","- C32 H22 Cl2 N6 O6 Zn -","- C32 H22 Cl2 N6 O6 Zn -","- C64 H44 Cl4 N12 O12 Zn2 -","2","1","","Evans, Cara C.; Masse, René; Nicoud, Jean-François; Bagieu-Beucher, Muriel","A new octupolar material for quadratic nonlinear optics: tris(2,2'-bipyridyl)Zn(ii) tetrakis(2-chloro-4-nitrophenolate)Zn(ii)","Journal of Materials Chemistry","2000","10","6","1419","","10.1039/b000417k","","","0.5608","AgKα","","0.0314","0.031","","0.046","","0.046","","","2.99","","","2.99","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203963","13.1589","0.0006","13.3044","0.0009","11.9989","0.0008","94.1","1","115","1","91.107","0.003","1896","16","296.2","","296.2","","","","","","","","","6","P -1","-P 1","2","","","","- C12 H16 Cl2 N2 O11 Zn -","- C12 H15.5 Cl2 N2 O11 Zn -","- C48 H62 Cl8 N8 O44 Zn4 -","4","2","","Evans, Cara C.; Masse, René; Nicoud, Jean-François; Bagieu-Beucher, Muriel","A new octupolar material for quadratic nonlinear optics: tris(2,2'-bipyridyl)Zn(ii) tetrakis(2-chloro-4-nitrophenolate)Zn(ii)","Journal of Materials Chemistry","2000","10","6","1419","","10.1039/b000417k","","","0.5608","AgKα","","0.0431","0.043","","0.052","","0.052","","","1.983","","","1.98","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203964","7.4876","0.0008","8.2336","0.0008","12.8592","0.0013","98.723","0.002","101.258","0.002","115.785","0.002","674.51","0.12","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C3 H14 N2 O12 P3 Zn2 -","- C3 H14 N2 O12 P3 Zn2 -","- C6 H28 N4 O24 P6 Zn4 -","2","1","","Liu, Wang; Liu, Yunling; Shi, Zhan; Pang, Wenqin","Hydrothermal synthesis and characterization of a new layered zinc phosphate intercalated with fully-protonated triethylenetetramine [Zn2(HPO4)3]2−[(C6N4H22)0.5]2+","Journal of Materials Chemistry","2000","10","6","1451","","10.1039/b000658k","","","0.71073","MoKα","","0.0627","0.0596","","","0.1521","0.1548","","","","","","1.084","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203965","11.1071","0.0005","25.4188","0.0009","12.5938","0.0005","90","","96.911","0.007","90","","3529.8","0.3","183","2","183","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C42 H34 Cl2 O8 -","- C42 H34 Cl2 O8 -","- C168 H136 Cl8 O32 -","4","1","","Ben-Haida, Abderrazak; Colquhoun, Howard M.; Hodge, Philip; Williams, David J.","Cyclic oligomers of poly(ether ketone) (PEK): synthesis, extraction from polymer, fractionation, and characterisation of the cyclic trimer, tetramer and pentamer","Journal of Materials Chemistry","2000","10","9","2011","","10.1039/b000738m","","","1.54178","CuKα","","0.0647","0.0514","","0.1471","0.1338","","","","1.037","1.075","1.075","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203966","8.7603","0.0005","10.1072","0.0005","14.0404","0.0008","75.262","0.004","73.004","0.005","80.202","0.004","1143.57","0.11","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C53.5 H35 Cl3 O8 -","- C53.5 H35 Cl3 O8 -","- C53.5 H35 Cl3 O8 -","1","0.5","","Ben-Haida, Abderrazak; Colquhoun, Howard M.; Hodge, Philip; Williams, David J.","Cyclic oligomers of poly(ether ketone) (PEK): synthesis, extraction from polymer, fractionation, and characterisation of the cyclic trimer, tetramer and pentamer","Journal of Materials Chemistry","2000","10","9","2011","","10.1039/b000738m","","","1.54178","CuKα","","0.0815","0.0609","","0.2084","0.1741","","","","1.07","1.124","1.124","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7203967","8.374","0.001","12.684","0.002","26.295","0.003","90","","96.2","0.01","90","","2776.6","0.6","120","2","120","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","4-bis[4',5,5'-tris(methylsulfanyl)tetrathiafulvalenyl]","","- C18 H18 S14 -","- C18 H18 S14 -","- C72 H72 S56 -","4","1","","John, Derek E.; Moore, Adrian J.; Bryce, Martin R.; Batsanov, Andrei S.; Leech, Michael A.; Howard, Judith A. K.","New bi(tetrathiafulvalenyl) derivatives and their radical cations: synthetic and X-ray structural studies","Journal of Materials Chemistry","2000","10","6","1273","","10.1039/b000790k","","","0.71073","MoKα","","0.0465","0.042","","0.1194","0.1145","","","","1.187","1.203","1.203","","","","","has coordinates,has disorder","288193","2023-12-08","17:12:24",""
"7203968","11.074","0.003","24.139","0.007","4.876","0.002","90","","90","","90","","1303.4","0.7","150","2","150","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","4-bis(5-methyl-4',5'-ethylenedithiotetrathiafulvalenyl) perchlorate","","- C18 H14 Cl O4 S12 -","- C18 H14 Cl O4 S12 -","- C36 H28 Cl2 O8 S24 -","2","0.5","","John, Derek E.; Moore, Adrian J.; Bryce, Martin R.; Batsanov, Andrei S.; Leech, Michael A.; Howard, Judith A. K.","New bi(tetrathiafulvalenyl) derivatives and their radical cations: synthetic and X-ray structural studies","Journal of Materials Chemistry","2000","10","6","1273","","10.1039/b000790k","","","1.54184","CuKα","","0.1737","0.1276","","0.4067","0.3278","","","","1.063","1.098","1.098","","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203969","14.4429","0.0005","8.0609","0.0003","24.3908","0.0007","90","","99.51","0.002","90","","2800.62","0.16","123","2","123","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","tris-(O-allyl)CTV","2,7,12,-trimethoxy-3,8,13-tri(prop-1-enoxy)-10,15-dihydro-5H-tribenzo [a,d,g]cyclononene","","- C33 H36 O6 -","- C33 H36 O6 -","- C132 H144 O24 -","4","1","","Scott, Janet L.; MacFarlane, Douglas R.; Raston, Colin L.; Teoh, Ching Mei","Clean, efficient syntheses of cyclotriveratrylene (CTV) and tris-(O-allyl)CTV in an ionic liquid","Green Chemistry","2000","2","4","123","","10.1039/b000825g","","","0.71073","MoKα","","0.136","0.0689","","","0.1581","0.1946","","","","","","1.031","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203970","7.234","0.001","8.999","0.001","16.907","0.002","90","","92.42","0.01","90","","1099.6","0.2","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H10 N2 O3 -","- C12 H10 N2 O3 -","- C48 H40 N8 O12 -","4","1","","Zhao, Bo; Chen, Changyun; Zhou, Zhihua; Cao, Yang; Li, Ming","A comparative study on the nonlinear optical properties of diphenyl ether and diphenyl sulfide compounds","Journal of Materials Chemistry","2000","10","7","1581","","10.1039/b000957l","","","0.71073","MoKα","","0.0577","0.0322","","","0.077","0.0834","","","","","","0.905","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203971","9.929","0.002","19.549","0.004","12.1","0.002","90","","96.11","0.03","90","","2335.3","0.8","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H30 N2 O5 S -","- C24 H30 N2 O5 S -","- C96 H120 N8 O20 S4 -","4","1","","Ren, Yan; Fang, Qi; Yu, Wen-Tao; Lei, Hong; Tian, Yu-Peng; Jiang, Min-Hua; Yang, Qing-Chuan; Mak, Thomas C. W.","Synthesis, structures and two-photon pumped up-conversion lasing properties of two new organic salts","Journal of Materials Chemistry","2000","10","9","2025","","10.1039/b001058h","","","0.71073","MoKα","","0.0811","0.0776","","","0.2303","0.2347","","","","","","1.091","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7203972","9.4237","0.0008","9.6976","0.0008","13.2841","0.0009","86.655","0.006","74.064","0.005","85.891","0.007","1163.39","0.16","568","2","568","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H30 N2 O4 S -","- C25 H30 N2 O4 S -","- C50 H60 N4 O8 S2 -","2","1","","Ren, Yan; Fang, Qi; Yu, Wen-Tao; Lei, Hong; Tian, Yu-Peng; Jiang, Min-Hua; Yang, Qing-Chuan; Mak, Thomas C. W.","Synthesis, structures and two-photon pumped up-conversion lasing properties of two new organic salts","Journal of Materials Chemistry","2000","10","9","2025","","10.1039/b001058h","","","0.71073","MoKα","","0.0842","0.0573","","","0.1575","0.1832","","","","","","0.987","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203973","9.733","0.001","20.826","0.002","25.311","0.003","74.97","0.01","83.31","0.02","89.26","0.02","4920.5","1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H27 Cl3 In N3 -","- C21 H27 Cl3 In N3 -","- C168 H216 Cl24 In8 N24 -","8","4","","Green, Mark; Norager, Sebastian; Moriarty, Philip; Motevalli, Majid; O'Brien, Paul","On the synthesis and manipulation of InAs quantum dots","Journal of Materials Chemistry","2000","10","8","1939","","10.1039/b001354o","","","0.71073","MoKα","","0.2443","0.0953","","","0.2874","0.3465","","","","","","0.825","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203974","19.503","0.004","10.841","0.003","24.137","0.005","90","","97.13","0.03","90","","5064","2","293","2","293","2","","","","","","","","7","P 1 21/a 1","-P 2yab","14","TBA[Ni(fcvdt)2](COMe2)0.5","","","- C45.5 H59 Fe2 N Ni O0.5 S8 -","- C45.5 H56 Fe2 N Ni O0.5 S8 -","- C182 H224 Fe8 N4 Ni4 O2 S32 -","4","1","","Lee, Ha-Jin; Noh, Dong-Youn","Syntheses, X-ray crystal structures and properties of di- and tetra-ferrocenyl nickel-bis(1,4-dithiin-5,6-dithiolate) complexes","Journal of Materials Chemistry","2000","10","9","2167","","10.1039/b001829p","","","0.71073","MoKα","","0.0793","0.0772","","","0.1971","0.2003","","","","","","1.09","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203975","20.457","0.014","39.22","0.013","8.496","0.002","90","","90","","90","","6817","5","293","2","293","2","","","","","","","","7","P n m a","-P 2ac 2n","62","TBA[Ni(dfcvdt)2](COMe2)","","","- C67 H78 Fe4 N Ni O S8 -","- C67 H36 Fe4 N Ni O S8 -","- C268 H144 Fe16 N4 Ni4 O4 S32 -","4","0.5","","Lee, Ha-Jin; Noh, Dong-Youn","Syntheses, X-ray crystal structures and properties of di- and tetra-ferrocenyl nickel-bis(1,4-dithiin-5,6-dithiolate) complexes","Journal of Materials Chemistry","2000","10","9","2167","","10.1039/b001829p","","","0.71073","MoKα","","0.2474","0.1093","","","0.2571","0.3047","","","","","","1.037","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203976","6.438","0.001","19.151","0.002","3.93","0.001","92.69","0.02","95.76","0.02","93.7","0.01","480.4","0.15","293.2","","293.2","","","","","","","","","6","P 1","P 1","1","","","","- C12 H6 F2 S4 Se4 Ta0.33 -","- C12 H6 F1.98 S4 Se4 Ta0.33 -","- C12 H6 F1.98 S4 Se4 Ta0.33 -","1","1","","Fujiwara, Hideki; Misaki, Yohji; Yamabe, Tokio; Mori, Takehiko; Mori, Hatsumi; Tanaka, Shoji","Preparation, structures and physical properties of selenium analogues of DTEDT as promising donors for organic metals","Journal of Materials Chemistry","2000","10","7","1565","","10.1039/b002790l","","","0.7107","MoKα","","","0.0434","","","0.0474","","","","","2.364","2.364","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203977","9.41","","10.004","","18.881","","79.891","","85.382","","89.057","","1744.13","","120","","120","","","","","","","","","6","P -1","-P 1","2","","bismuthcalciumvanadate","","- C0 H0 Bi3.03 Ca8.97 O41 V11 -","- Bi3.035 Ca8.965 O41 V11 -","- Bi6.07 Ca17.93 O82 V22 -","2","1","","Radosavljevic, Ivana; Howard, Judith A. K.; Sleight, Arthur W.; Evans, John S. O.","Synthesis and structure of Bi3Ca9V11O41","Journal of Materials Chemistry","2000","10","9","2091","","10.1039/b002857f","","","0.71073","MoKα","","","0.0393","","","","0.0411","","","","","","0.6348","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203978","12.783","0.002","28.839","0.005","7.3919","0.0009","90","","90","","90","","2725","0.7","123","2","123","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C26 H34 Cu2 N2 O8 -","- C26 H34 Cu2 N2 O8 -","- C104 H136 Cu8 N8 O32 -","4","1","","Royles, Brodyck J. L.; Sherrington, David C.","Mainchain optically active vinyl copolymers via transition metal complex-templated asymmetric free radical polymerisation","Journal of Materials Chemistry","2000","10","9","2035","","10.1039/b003007o","","","0.61079","","","0.0684","0.0375","","","0.089","0.0981","","","","","","1.026","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203979","8.9908","0.0005","13.2399","0.0005","15.0602","0.001","81.003","0.004","85.747","0.003","70.911","0.003","1672.79","0.16","293","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H24 Cl O4 S16 -","- C24 H24 Cl O4 S16 -","- C48 H48 Cl2 O8 S32 -","2","1","","Li, Hongxiang; Zhang, Deqing; Zhang, Bin; Yao, Youxin; Xu, Wei; Zhu, Daoben; Wang, Zhemin","Syntheses of new electron donors with hydroxymethyl groups and studies on their cation-radical salts","Journal of Materials Chemistry","2000","10","9","2063","","10.1039/b003041o","","","0.71073","MoKα","","0.1107","0.0825","","","0.2","0.2093","","","","","","1.239","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203981","13.503","0.001","8.435","0.001","14.839","0.001","90","","112.24","0.01","90","","1564.4","0.3","250","2","250","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H25 N3 O7 S -","- C10 H25 N3 O7 S -","- C40 H100 N12 O28 S4 -","4","1","","Ilczyszyn, Maria M.; Wierzejewska, Maria; Ciunik, Zbigniew","Crystal structure and vibrational spectra of bis(betaine) sulfamate","Physical Chemistry Chemical Physics","2000","2","15","3503","","10.1039/b003284k","","","0.71073","MoKα","","0.0366","0.0327","","","0.0897","0.0954","","","","","","1.077","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203982","13.467","0.001","8.353","0.001","14.701","0.001","90","","112","0.01","90","","1533.3","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H25 N3 O7 S -","- C10 H25 N3 O7 S -","- C40 H100 N12 O28 S4 -","4","1","","Ilczyszyn, Maria M.; Wierzejewska, Maria; Ciunik, Zbigniew","Crystal structure and vibrational spectra of bis(betaine) sulfamate","Physical Chemistry Chemical Physics","2000","2","15","3503","","10.1039/b003284k","","","0.71073","MoKα","","0.0307","0.0282","","","0.0763","0.0783","","","","","","1.049","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203986","4.0251","0.0003","15.266","0.002","19.259","0.002","97.02","0.01","93.23","0.01","96.04","0.01","1165.1","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C16.875 H12 Fe0.375 N2.25 O6.375 S6 -","- C16.875 H12 Fe0.375 N2.25 O6.375 S6 -","- C33.75 H24 Fe0.75 N4.5 O12.75 S12 -","2","1","","Zorina, Leokadiya V.; Khasanov, Salavat S.; Shibaeva, Rimma P.; Gener, Marc; Rousseau, Roger; Canadell, Enric; Kushch, Lyudmila A.; Yagubskii, Eduard B.; Drozdova, Olga O.; Yakushi, Kyuya","A new stable organic metal based on the BEDO-TTF donor and the doubly charged nitroprusside anion, (BEDO-TTF)4[Fe(CN)5NO]","Journal of Materials Chemistry","2000","10","9","2017","","10.1039/b003433i","","","0.71073","MoKα","","0.0753","0.0707","","","0.2303","0.2383","","","","","","0.999","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203987","10.245","0.0016","12.6915","0.0019","13.557","0.002","80.371","0.003","87","0.003","85.967","0.003","1732.1","0.5","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C33 H29 Br6 N5 O3 -","- C33 H29 Br6 N5 O3 -","- C66 H58 Br12 N10 O6 -","2","1","","Robertson, Neil; Parsons, S.; MacLean, E. J.; Coxall, R. A.; Mount, Andrew R.","Preparation, X-ray structure and properties of a hexabrominated, symmetric indole trimer and its TCNQ adduct: a new route to functional molecular systems","Journal of Materials Chemistry","2000","10","9","2043","","10.1039/b003631p","","","0.6884","synchrotron","","0.1077","0.0654","","","0.1457","0.1581","","","","","","1.037","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203988","14.455","0.003","25.371","0.005","16.719","0.003","90","","93.24","0.03","90","","6122","2","220","2","220","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C56 H41 Br6 N11 O4 S4 -","- C54 H35 Br6 N11 O3 S3 -","- C216 H140 Br24 N44 O12 S12 -","4","1","","Robertson, Neil; Parsons, S.; MacLean, E. J.; Coxall, R. A.; Mount, Andrew R.","Preparation, X-ray structure and properties of a hexabrominated, symmetric indole trimer and its TCNQ adduct: a new route to functional molecular systems","Journal of Materials Chemistry","2000","10","9","2043","","10.1039/b003631p","","","1.54178","CuKα","","0.1807","0.0868","","","0.2021","0.2476","","","","","","0.955","","","","has coordinates,has disorder","180370","2020-10-21","18:00:00",""
"7203989","4.8898","0.0005","9.0758","0.001","9.521","0.001","88.815","0.002","78.638","0.002","78.491","0.002","405.84","0.07","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- Ba3 Nb2 O18 P4 -","- Ba3 Nb2 O18 P4 -","- Ba3 Nb2 O18 P4 -","1","0.5","","Wang, Xiqu; Liu, Lumei; Jacobson, Allan J.","Hydrothermal synthesis and structures of Ba3(NbO)2(PO4)4 and Co3(NbO)2(PO4)4(H2O)10","Journal of Materials Chemistry","2000","10","12","2774","","10.1039/b003845h","","","0.71073","MoKα","","0.0738","0.055","","0.1428","0.133","","","","0.997","1.053","1.053","","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203990","5.1259","0.0003","11.1573","0.0008","19.1666","0.0013","90","","90.171","0.001","90","","1096.16","0.13","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- Co3 F0.3 H19.7 Nb2 O27.7 P4 -","- Co3 Nb2 O28 P4 -","- Co6 Nb4 O56 P8 -","2","0.5","","Wang, Xiqu; Liu, Lumei; Jacobson, Allan J.","Hydrothermal synthesis and structures of Ba3(NbO)2(PO4)4 and Co3(NbO)2(PO4)4(H2O)10","Journal of Materials Chemistry","2000","10","12","2774","","10.1039/b003845h","","","0.71073","MoKα","","0.0687","0.0488","","0.1174","0.1096","","","","0.975","1.032","1.032","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203991","6.876","0.002","9.361","0.003","9.508","0.003","101.96","0.01","95.96","0.01","104.09","0.01","573","0.3","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","thieno[3',4'-d:5,6][1,4]dithiino[2,3-b]quinoxaline","","- C12 H6 N2 S3 -","- C12 H6 N2 S3 -","- C24 H12 N4 S6 -","2","1","","Skabara, Peter J.; Berridge, Rory; Prescott, Karen; Goldenberg, Leonid M.; Ortí, Enrique; Viruela, Rafael; Pou-Amérigo, Rosendo; Batsanov, Andrei S.; Howard, Judith A. K.; Coles, Simon J.; Hursthouse, Michael B.","Experimental and theoretical studies into the structural perturbations between neutral, oxidised and reduced forms of 1,4-dithiinoquinoxaline derivatives","Journal of Materials Chemistry","2000","10","11","2448","","10.1039/b003910l","","","0.71073","MoKα","","0.0313","0.0286","","0.0819","0.0764","","","","1.121","1.119","1.119","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203992","8.059","0.001","12.144","0.001","22.257","0.002","76.95","0.01","85.24","0.01","79.67","0.01","2085.6","0.4","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","thieno[3',4'-d:5,6][1,4]dithiino[2,3-b]quinoxaline tetracyanoquinodimethane","","- C24 H10 N6 S3 -","- C24 H10 N6 S3 -","- C96 H40 N24 S12 -","4","2","","Skabara, Peter J.; Berridge, Rory; Prescott, Karen; Goldenberg, Leonid M.; Ortí, Enrique; Viruela, Rafael; Pou-Amérigo, Rosendo; Batsanov, Andrei S.; Howard, Judith A. K.; Coles, Simon J.; Hursthouse, Michael B.","Experimental and theoretical studies into the structural perturbations between neutral, oxidised and reduced forms of 1,4-dithiinoquinoxaline derivatives","Journal of Materials Chemistry","2000","10","11","2448","","10.1039/b003910l","","","0.71073","MoKα","","0.106","0.0675","","","0.1594","0.1928","","","","","","1.09","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203993","9.5292","0.0019","13.975","0.003","10.241","0.002","90","","90","","90","","1363.8","0.5","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","5,6-bis(methylsulfanyl)[1,4]dithiino[2,3-b]quinoxaline","","- C12 H10 N2 S4 -","- C12 H10 N2 S4 -","- C48 H40 N8 S16 -","4","0.5","","Skabara, Peter J.; Berridge, Rory; Prescott, Karen; Goldenberg, Leonid M.; Ortí, Enrique; Viruela, Rafael; Pou-Amérigo, Rosendo; Batsanov, Andrei S.; Howard, Judith A. K.; Coles, Simon J.; Hursthouse, Michael B.","Experimental and theoretical studies into the structural perturbations between neutral, oxidised and reduced forms of 1,4-dithiinoquinoxaline derivatives","Journal of Materials Chemistry","2000","10","11","2448","","10.1039/b003910l","","","0.71073","MoKα","","0.0518","0.0443","","","0.1085","0.1126","","","","","","0.796","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203994","9.116","0.006","5.066","0.001","17.13","0.02","90","","93.97","0.03","90","","789.2","1.1","293","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C9 H8 N2 O2 -","- C9 H8 N2 O2 -","- C36 H32 N8 O8 -","4","1","","Plüg, Carsten; Wallfisch, Bianca; Gade Andersen, Heidi; Bernhardt, Paul V.; Baker, Lisa-Jane; Clark, George R.; Wah Wong, Ming; Wentrup, Curt","Mesoionic pyridopyrimidinylium and pyridooxazinylium olates and non-mesoionic pyridopyrimidinones. Structures in the solid state, solution, and matrices †","Journal of the Chemical Society, Perkin Transactions 2","2000","","10","2096","","10.1039/b003933k","","","0.71073","MoKα","","0.189","0.0496","","","0.1291","0.188","","","","","","0.916","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203995","6.5287","0.0001","7.3004","0.0001","12.0735","0.0001","98.26","0.001","101.086","0.001","101.871","0.001","542.483","0.013","203","2","203","2","","","","","","","","4","P -1","-P 1","2","","","","- C14 H10 N2 O2 -","- C14 H10 N2 O2 -","- C28 H20 N4 O4 -","2","1","","Plüg, Carsten; Wallfisch, Bianca; Gade Andersen, Heidi; Bernhardt, Paul V.; Baker, Lisa-Jane; Clark, George R.; Wah Wong, Ming; Wentrup, Curt","Mesoionic pyridopyrimidinylium and pyridooxazinylium olates and non-mesoionic pyridopyrimidinones. Structures in the solid state, solution, and matrices †","Journal of the Chemical Society, Perkin Transactions 2","2000","","10","2096","","10.1039/b003933k","","","0.71073","MoKα","","0.0414","0.036","","","0.1035","0.1062","","","","","","1.065","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203996","7.688","0.001","13.3074","0.0009","15.144","0.003","90","","93.243","0.009","90","","1546.9","0.4","293","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C9 H7 N O3 -","- C9 H7 N O3 -","- C72 H56 N8 O24 -","8","2","","Plüg, Carsten; Wallfisch, Bianca; Gade Andersen, Heidi; Bernhardt, Paul V.; Baker, Lisa-Jane; Clark, George R.; Wah Wong, Ming; Wentrup, Curt","Mesoionic pyridopyrimidinylium and pyridooxazinylium olates and non-mesoionic pyridopyrimidinones. Structures in the solid state, solution, and matrices †","Journal of the Chemical Society, Perkin Transactions 2","2000","","10","2096","","10.1039/b003933k","","","0.71073","MoKα","","0.2756","0.0599","","","0.1169","0.1885","","","","","","0.929","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203997","7.318","0.002","11.984","0.001","12.378","0.003","90","","90.71","0.01","90","","1085.5","0.4","293","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H9 N O3 -","- C14 H9 N O3 -","- C56 H36 N4 O12 -","4","1","","Plüg, Carsten; Wallfisch, Bianca; Gade Andersen, Heidi; Bernhardt, Paul V.; Baker, Lisa-Jane; Clark, George R.; Wah Wong, Ming; Wentrup, Curt","Mesoionic pyridopyrimidinylium and pyridooxazinylium olates and non-mesoionic pyridopyrimidinones. Structures in the solid state, solution, and matrices †","Journal of the Chemical Society, Perkin Transactions 2","2000","","10","2096","","10.1039/b003933k","","","0.71073","MoKα","","0.1165","0.0377","","","0.092","0.1184","","","","","","0.98","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203998","10.189","0.002","15.928","0.003","11.2","0.003","90","","94.683","0.008","90","","1811.6","0.7","296","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H10 N2 O2 -","- C10 H10 N2 O2 -","- C80 H80 N16 O16 -","8","2","","Plüg, Carsten; Wallfisch, Bianca; Gade Andersen, Heidi; Bernhardt, Paul V.; Baker, Lisa-Jane; Clark, George R.; Wah Wong, Ming; Wentrup, Curt","Mesoionic pyridopyrimidinylium and pyridooxazinylium olates and non-mesoionic pyridopyrimidinones. Structures in the solid state, solution, and matrices †","Journal of the Chemical Society, Perkin Transactions 2","2000","","10","2096","","10.1039/b003933k","","","0.71073","MoKα","","0.2868","0.0514","","","0.1025","0.168","","","","","","0.934","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203999","10.868","0.003","8.703","0.001","11.834","0.004","90","","100.67","0.01","90","","1100","0.5","293","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H10 N4 O -","- C13 H10 N4 O -","- C52 H40 N16 O4 -","4","1","","Plüg, Carsten; Wallfisch, Bianca; Gade Andersen, Heidi; Bernhardt, Paul V.; Baker, Lisa-Jane; Clark, George R.; Wah Wong, Ming; Wentrup, Curt","Mesoionic pyridopyrimidinylium and pyridooxazinylium olates and non-mesoionic pyridopyrimidinones. Structures in the solid state, solution, and matrices †","Journal of the Chemical Society, Perkin Transactions 2","2000","","10","2096","","10.1039/b003933k","","","0.71073","MoKα","","0.059","0.0374","","","0.0957","0.1083","","","","","","1.041","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204000","9.864","0.002","12.475","0.004","8.827","0.002","107.83","0.02","93.02","0.02","102.3","0.02","1002.1","0.5","296.2","","","","","","","","","","","4","P -1","-P 1","2","","","","- C52 H27 Co N11 -","- C52 H24 Co N11 -","- C52 H24 Co N11 -","1","0.5","","Matsumura, Naoko; Fujita, Akiko; Naito, Toshio; Inabe, Tamotsu","Multi-dimensional π‒π stacking interaction in neutral radical crystals obtained by electrochemical oxidation of [CoIII(2,3-Nc)(CN)2]− (2,3-Nc = 2,3-naphthalocyanine)","Journal of Materials Chemistry","2000","10","10","2266","","10.1039/b004025h","","","0.7107","MoKα","","","0.0724","","","","0.08","","","","","","3.44","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204001","10.684","0.001","15.005","0.002","8.068","0.001","92.371","0.007","95.72","0.006","70.079","0.004","1209.9","0.2","123","","","","","","","","","","","5","P -1","-P 1","2","","","","- C62 H32 Cl4 Co N10 -","- C62 H32 Cl4 Co N10 -","- C62 H32 Cl4 Co N10 -","1","0.5","","Matsumura, Naoko; Fujita, Akiko; Naito, Toshio; Inabe, Tamotsu","Multi-dimensional π‒π stacking interaction in neutral radical crystals obtained by electrochemical oxidation of [CoIII(2,3-Nc)(CN)2]− (2,3-Nc = 2,3-naphthalocyanine)","Journal of Materials Chemistry","2000","10","10","2266","","10.1039/b004025h","","","0.7107","MoKα","","","0.0645","","","","0.045","","","","","","2.36","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204002","17.2497","0.0013","25.7851","0.0018","9.4339","0.0007","90","","103.567","","90","","4079","0.5","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C140 H141 Al12 O64 P20 -","- C142.08 H134 Al12 O64 P20 -","- C142.08 H134 Al12 O64 P20 -","1","0.25","","Zakowsky, Nadja; Hix, Gary B.; Morris, Russell E.","Synthesis of a family of aluminium benzylphosphonates","Journal of Materials Chemistry","2000","10","10","2375","","10.1039/b004177g","","","0.6944","Synchrotron","","0.1349","0.0835","","","0.1819","0.202","","","","","","1.197","","","","has coordinates,has disorder","180371","2020-10-21","18:00:00",""
"7204003","15.043","0.004","15.37","0.003","21.872","0.005","90","","90","","90","","5057","2","298","","298","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C20 H28 Cl2 N6 Ni O9 -","- C20 H28 Cl2 N6 Ni O9 -","- C160 H224 Cl16 N48 Ni8 O72 -","8","1","","Bazzicalupi, Carla; Bencini, Andrea; Bianchi, Antonio; Ciattini, Samuele; Giorgi, Claudia; Paoletti, Piero; Valtancoli, Barbara; Secco, Fernando; Rosaria Tinè, Maria; Venturini, Marcella","Ni(II) and Co(II) complexes with a phenanthroline-containing macrocycle. Thermodynamic, structural and kinetic considerations","Physical Chemistry Chemical Physics","2000","2","21","4864","","10.1039/b004442n","","","1.54178","CuKα","","0.0705","0.0677","","","0.1902","0.1936","","","","","","1.053","","","","has coordinates","180371","2020-10-21","18:00:00",""
"7204004","20.944","0.005","9.861","0.002","9.404","0.002","90","","95.61","0.02","90","","1932.9","0.7","296.2","","296.2","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C11 H11 B F4 N O S8 -","- C11 H7 B F4 N O S8 -","- C44 H28 B4 F16 N4 O4 S32 -","4","1","","Ono, Go; Terao, Hiroshi; Higuchi, Saburo; Sugawara, Tadashi; Izuoka, Akira; Mochida, Tomoyuki","One-dimensional double chain composed of carbamoylmethylthio-substituted TTF-based donor in ion radical salt","Journal of Materials Chemistry","2000","10","10","2277","","10.1039/b004557h","","","0.7107","MoKα","","","0.0557","","","0.0884","","","","","1.695","1.695","","","","","has coordinates","180371","2020-10-21","18:00:00",""
"7204005","7.5773","0.0008","13.5538","0.0014","14.2164","0.0013","76.894","0.008","85.153","0.008","74.656","0.009","1370.9","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C23 H11 F4 N5 O S8 -","- C23 F4 N5 O S8 -","- C46 F8 N10 O2 S16 -","2","1","","Ono, Go; Terao, Hiroshi; Higuchi, Saburo; Sugawara, Tadashi; Izuoka, Akira; Mochida, Tomoyuki","One-dimensional double chain composed of carbamoylmethylthio-substituted TTF-based donor in ion radical salt","Journal of Materials Chemistry","2000","10","10","2277","","10.1039/b004557h","","","1.54178","CuKα","","","0.0725","","","0.0765","","","","","1.797","1.797","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204006","5.1393","0.0006","6.363","0.001","11.293","0.001","95.65","0.01","96.874","0.009","92.786","0.01","364.18","0.08","293","2","293","2","","","","","","","","5","P -1","-P 1","2","N2H5CoPO","hydrazinium cobalt phosphate","","- Co2 H6 N2 O8 P2 -","- Co2 H6 N2 O8 P2 -","- Co4 H12 N4 O16 P4 -","2","1","","Ekambaram, Sambandan; Sevov, Slavi C.","Layered cobalt phosphate grafted with hydrazinium ligands: Co2(PO4)(H2PO4)N2H5","Journal of Materials Chemistry","2000","10","11","2522","","10.1039/b004753h","","","0.71073","MoKα","","0.0487","0.0457","","","0.1385","0.1429","","","","","","1.112","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204007","17.3514","0.0006","9.5075","0.0003","9.8065","0.0003","90","","102.682","0.002","90","","1578.3","0.09","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C2 H10 N O6 P1.5 Zn -","- C2 H10 N O6 P1.5 Zn -","- C16 H80 N8 O48 P12 Zn8 -","8","1","","Ayi, Ayi A.; Choudhury, Amitava; Natarajan, Srinivasan; Rao, C. N. R.","Solution-mediated synthesis of a three-dimensional zinc phosphate in the presence of a monoamine","Journal of Materials Chemistry","2000","10","11","2606","","10.1039/b004972g","","","0.71073","MoKα","","0.0345","0.0266","","0.0737","0.0706","","","","1.051","1.087","1.087","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204008","16.778","0.006","14.757","0.004","5.851","0.003","90","","90","","90","","1448.7","1","293","2","180","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C7 H6 N S2 -","- C7 H6 N S2 -","- C56 H48 N8 S16 -","8","1","","McManus, Gordon D.; Rawson, Jeremy M.; Feeder, Neil; Palacio, Fernando; Oliete, Patricia","Structure and magnetic properties of a sulfur‒nitrogen radical, methylbenzodithiazolyl","Journal of Materials Chemistry","2000","10","9","2001","","10.1039/b004992l","","","0.71069","MoKα","","0.0823","0.0523","","0.1315","0.1153","","","","1.029","1.108","1.108","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204009","5.2016","0.0004","13.6024","0.0011","17.2394","0.0013","97.869","0.002","93.302","0.002","91.828","0.002","1205.29","0.16","298","","298","","","","","","","","hydrothermal reaction","6","P -1","-P 1","2","","","","- C6 H26 N2 O18.94 P4 Zn4 -","- C6 H18 N2 O18.93 P4 Zn4 -","- C12 H36 N4 O37.86 P8 Zn8 -","2","1","","Rodgers, Jennifer A.; Harrison, William T. A.","H3N(CH2)6NH3·Zn4(PO4)2(HPO4)2·3H2O: a novel three-dimensional zinc phosphate framework containing 5- and 20-rings","Journal of Materials Chemistry","2000","10","12","2853","","10.1039/b004994h","","","0.71073","MoKα","","","0.0436","","","0.0535","","","","","1.0589","1.0589","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204010","10.437","0.002","12.707","0.003","12.841","0.003","91.22","0.03","108.34","0.03","111.03","0.03","1491.4","0.8","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H12 N2 S -","- C19 H12 N2 S -","- C76 H48 N8 S4 -","4","2","","Borowicz, Paweł; Herbich, Jerzy; Kapturkiewicz, Andrzej; Anulewicz-Ostrowska, Romana; Nowacki, Jacek; Grampp, Günter","Nature of the lowest triplet states of 4'-substituted N-phenylphenothiazine derivatives","Physical Chemistry Chemical Physics","2000","2","19","4275","","10.1039/b005058j","","","0.71073","MoKα","","0.1759","0.0471","","0.1828","0.1225","","","","1.046","1.204","1.204","","","","","has coordinates","180371","2020-10-21","18:00:00",""
"7204023","25.495","0.002","9.3495","0.0007","15.859","0.001","89","","89","","90","","3779.1","0.5","198.2","","","","","","","","","","","5","C m c a","-C 2ac 2","64","","","","- C34 H28 Mn N8 S8 -","- C34 H28 Mn N8 S8 -","- C136 H112 Mn4 N32 S32 -","4","","","Ken-ichi Sugiura; Kantaro Ushiroda; Mitchell T. Johnson; Joel S. Miller; Yoshiteru Sakata","Ferrimagnetic ordering of a methylthio-substitutedplanar porphyrin based electron transfer salt, octakis(2,3,7,8,12,13,17,18-methylthio)porphyrinatomanganese(III)tetracyanoethanide","J. Mater. Chem.","2000","10","11","2507","2514","10.1039/b006261h","","","0.7107","MoKα","","","0.0561","","","","0.0634","","","","","","1.856","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204028","5.9637","0.0002","9.123","0.0006","12.0646","0.0007","99.666","0.003","96.329","0.003","95.837","0.003","638.28","0.06","123","2","123","2","","","","","","","","3","P -1","-P 1","2","","","","- C14 H14 O6 -","- C14 H14 O6 -","- C28 H28 O12 -","2","1","","Scott, Janet L.; Raston, Colin L.","Solvent-free synthesis of 3-carboxycoumarins","Green Chemistry","2000","2","5","245","","10.1039/b006704k","","","0.71073","MoKα","","0.0673","0.0437","","","0.0947","0.1038","","","","","","1.037","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204029","5.11","0.0002","19.5292","0.0004","9.4299","0.0003","90","","99.909","0.002","90","","927.01","0.05","123","2","123","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","8-methoxy,3-carboxy-coumarin","","- C11 H8 O5 -","- C11 H7 O5 -","- C44 H28 O20 -","4","1","","Scott, Janet L.; Raston, Colin L.","Solvent-free synthesis of 3-carboxycoumarins","Green Chemistry","2000","2","5","245","","10.1039/b006704k","","","0.71073","MoKα","","0.069","0.0437","","","0.104","0.1157","","","","","","1.037","","","","has coordinates","180371","2020-10-21","18:00:00",""
"7204031","14.49","0.002","8.2086","0.0008","21.994","0.003","90","","96.05","0.012","90","","2601.5","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H27 I N2 O3 -","- C26 H21 I N2 O3 -","- C104 H84 I4 N8 O12 -","4","1","","Wang, Xiao-Mei; Zhou, Yu-Fang; Yu, Wen-Tao; Wang, Chun; Fang, Qi; Jiang, Min-Hua; Lei, Hong; Wang, He-Zhou","Two-photon pumped lasing stilbene-type chromophores containing various terminal donor groups: relationship between lasing efficiency and intramolecular charge transfer","Journal of Materials Chemistry","2000","10","12","2698","","10.1039/b006764o","","","0.71073","MoKα","","0.1151","0.0629","","","0.1652","0.1991","","","","","","1.027","","","","has coordinates,has disorder","180371","2020-10-21","18:00:00",""
"7204032","21.438","0.0012","14.9682","0.0011","14.0446","0.001","90","","119.257","0.004","90","","3931.9","0.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H27 I N2 O2 -","- C18 H27 I N2 O1.5 -","- C144 H216 I8 N16 O12 -","8","1","","Wang, Xiao-Mei; Zhou, Yu-Fang; Yu, Wen-Tao; Wang, Chun; Fang, Qi; Jiang, Min-Hua; Lei, Hong; Wang, He-Zhou","Two-photon pumped lasing stilbene-type chromophores containing various terminal donor groups: relationship between lasing efficiency and intramolecular charge transfer","Journal of Materials Chemistry","2000","10","12","2698","","10.1039/b006764o","","","0.71073","MoKα","","0.0709","0.0451","","","0.1077","0.124","","","","","","1.028","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204033","4.978","0.003","12","0.01","8.189","0.006","90","","91.97","0.03","90","","488.9","0.6","160","","293","","","","","","","","Aldrich, Lancaster","6","P 1 21/m 1","-P 2yb","11","","Aluminium fluoro ethylenediphosphonate hydrate","","- C2 H4 Al2 F2 O9 P2 -","- C2 H4 Al2 F2 O9 P2 -","- C4 H8 Al4 F4 O18 P4 -","2","0.5","","Harvey, Howard G.; Teat, Simon J.; Attfield, Martin P.","Al2[O3PC2H4PO3](H2O)2F2·H2O: a novel aluminium diphosphonate","Journal of Materials Chemistry","2000","10","12","2632","","10.1039/b006851i","","","0.6942","DaresburySynchrotronradiationsource","","","0.1043","","","","0.107","","","","","","1.0801","","","","has coordinates","288252","2023-12-12","14:26:25",""
"7204908","5.767","0.001","7.971","0.001","13.462","0.001","90","","91.47","0.01","90","","618.63","0.14","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","methyl 6-O-propanoyl-alpha-D-galactopyranoside","","- C10 H18 O7 -","- C10 H18 O7 -","- C20 H36 O14 -","2","1","","Abe, Yutaka; Fujiwara, Masami; Ohbu, Kazuo; Harata, Kazuaki","Crystal structures of glycolipids with odd and even numbered alkyl chains","Journal of the Chemical Society, Perkin Transactions 2","2000","","2","341","","10.1039/a905624f","","","0.71073","MoKα","","0.0481","0.0432","","0.115","0.1122","","","","1.037","1.068","1.068","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204909","5.77","0.001","7.973","0.001","15.451","0.001","90","","93.69","0.01","90","","709.34","0.16","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","methyl 6-O-pentanoyl-alpha-D-galactopyranoside","","- C12 H22 O7 -","- C12 H22 O7 -","- C24 H44 O14 -","2","1","","Abe, Yutaka; Fujiwara, Masami; Ohbu, Kazuo; Harata, Kazuaki","Crystal structures of glycolipids with odd and even numbered alkyl chains","Journal of the Chemical Society, Perkin Transactions 2","2000","","2","341","","10.1039/a905624f","","","0.71073","MoKα","","0.0618","0.0533","","0.1503","0.1438","","","","1.01","1.063","1.063","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204910","5.775","0.001","7.946","0.001","17.883","0.001","90","","97.15","0.01","90","","814.24","0.18","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","methyl 6-O-heptanoyl-alpha-D-galactopyranoside","","- C14 H26 O7 -","- C14 H26 O7 -","- C28 H52 O14 -","2","1","","Abe, Yutaka; Fujiwara, Masami; Ohbu, Kazuo; Harata, Kazuaki","Crystal structures of glycolipids with odd and even numbered alkyl chains","Journal of the Chemical Society, Perkin Transactions 2","2000","","2","341","","10.1039/a905624f","","","0.71073","MoKα","","0.0583","0.0436","","0.1247","0.1025","","","","1.033","1.036","1.036","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204911","5.768","0.001","7.903","0.001","20.114","0.001","90","","96.63","0.01","90","","910.8","0.2","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","methyl 6-O-nonanoyl-alpha-D-galactopyranoside","","- C16 H30 O7 -","- C16 H30 O7 -","- C32 H60 O14 -","2","1","","Abe, Yutaka; Fujiwara, Masami; Ohbu, Kazuo; Harata, Kazuaki","Crystal structures of glycolipids with odd and even numbered alkyl chains","Journal of the Chemical Society, Perkin Transactions 2","2000","","2","341","","10.1039/a905624f","","","0.71073","MoKα","","0.0701","0.0515","","0.1337","0.1078","","","","1.06","1.085","1.085","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204912","5.778","0.001","7.903","0.001","22.326","0.001","90","","92.83","0.01","90","","1018.2","0.2","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","methyl 6-O-undecanoyl-alpha-D-galactopyranoside","","- C18 H34 O7 -","- C18 H34 O7 -","- C36 H68 O14 -","2","1","","Abe, Yutaka; Fujiwara, Masami; Ohbu, Kazuo; Harata, Kazuaki","Crystal structures of glycolipids with odd and even numbered alkyl chains","Journal of the Chemical Society, Perkin Transactions 2","2000","","2","341","","10.1039/a905624f","","","0.71073","MoKα","","0.0783","0.053","","0.1398","0.1092","","","","1.017","1.062","1.062","","","","","has coordinates","205752","2020-10-21","18:00:00",""
"7204913","7.932","0.001","7.101","0.001","10.984","0.001","90","","101.11","0.01","90","","607.08","0.13","293","2","293","2","","","","","","","114.85","3","P 1 21 1","P 2yb","4","","methyl 6-O-propanoyl-beta-D-glucopyranoside","","- C10 H18 O7 -","- C10 H18 O7 -","- C20 H36 O14 -","2","1","","Abe, Yutaka; Fujiwara, Masami; Ohbu, Kazuo; Harata, Kazuaki","Crystal structures of glycolipids with odd and even numbered alkyl chains","Journal of the Chemical Society, Perkin Transactions 2","2000","","2","341","","10.1039/a905624f","","","0.71073","MoKα","","0.0445","0.0375","","0.0977","0.0932","","","","1.068","1.08","1.08","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204914","7.906","0.001","7.459","0.001","14.218","0.001","90","","102.63","0.01","90","","818.16","0.16","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","methyl 6-O-heptanoyl-beta-D-glucopyranoside","","- C14 H26 O7 -","- C14 H26 O7 -","- C28 H52 O14 -","2","1","","Abe, Yutaka; Fujiwara, Masami; Ohbu, Kazuo; Harata, Kazuaki","Crystal structures of glycolipids with odd and even numbered alkyl chains","Journal of the Chemical Society, Perkin Transactions 2","2000","","2","341","","10.1039/a905624f","","","0.71073","MoKα","","0.0615","0.045","","0.1226","0.1112","","","","1.026","1.071","1.071","","","","","has coordinates,has disorder","180380","2020-10-21","18:00:00",""
"7204915","7.922","0.001","7.45","0.001","15.815","0.001","90","","100.01","0.01","90","","919.18","0.18","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","methyl 6-O-nonanoyl-beta-D-glucopyranoside","","- C16 H30 O7 -","- C15.99 H29.981 O6.998 -","- C31.98 H59.962 O13.996 -","2","1","","Abe, Yutaka; Fujiwara, Masami; Ohbu, Kazuo; Harata, Kazuaki","Crystal structures of glycolipids with odd and even numbered alkyl chains","Journal of the Chemical Society, Perkin Transactions 2","2000","","2","341","","10.1039/a905624f","","","0.71073","MoKα","","0.0776","0.05","","0.1322","0.1054","","","","1.064","1.111","1.111","","","","","has coordinates,has disorder","180380","2020-10-21","18:00:00",""
"7204916","7.923","0.001","7.437","0.001","17.217","0.001","90","","92.626","0.001","90","","1013.4","0.2","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","methyl 6-O-undecanoyl-beta-D-glucopyranoside","","- C18 H34 O7 -","- C17.988 H33.977 O6.998 -","- C35.976 H67.954 O13.996 -","2","1","","Abe, Yutaka; Fujiwara, Masami; Ohbu, Kazuo; Harata, Kazuaki","Crystal structures of glycolipids with odd and even numbered alkyl chains","Journal of the Chemical Society, Perkin Transactions 2","2000","","2","341","","10.1039/a905624f","","","0.71073","MoKα","","0.06","0.0508","","0.1319","0.1259","","","","0.992","1.068","1.068","","","","","has coordinates,has disorder","180380","2020-10-21","18:00:00",""
"7204917","5.3361","0.0006","8.765","0.0008","14.952","0.001","90","","98.871","0.008","90","","690.95","0.11","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Phenazine fumaric acid","dibenzopyrazine trans-2-butenedioc acid","","- C16 H12 N2 O4 -","- C16 H12 N2 O4 -","- C32 H24 N4 O8 -","2","0.5","","Batchelor, Elaine; Klinowski, Jacek; Jones, William","Crystal engineering using co‐crystallisation of phenazine with dicarboxylic acids","Journal of Materials Chemistry","2000","10","4","839","","10.1039/a908214j","","","0.71069","MoKα","","0.0468","0.034","","","0.0918","0.1011","","","","","","1.043","","","","has coordinates","180380","2020-10-21","18:00:00",""
"7204918","26.833","0.026","7.095","0.004","19.613","0.027","90","","127.46","0.07","90","","2964","6","295","2","295","2","","","","","","","Aldrich","4","C 1 2/c 1","-C 2yc","15","Phenazine mesaconic acid","dibenzopyrazine trans-2-methyl-2-butenedioic acid","","- C17 H14 N2 O4 -","- C17 H14 N2 O4 -","- C136 H112 N16 O32 -","8","1","","Batchelor, Elaine; Klinowski, Jacek; Jones, William","Crystal engineering using co‐crystallisation of phenazine with dicarboxylic acids","Journal of Materials Chemistry","2000","10","4","839","","10.1039/a908214j","","","0.71069","MoKα","","0.0799","0.0407","","0.1183","0.101","","","","1.014","1.085","1.085","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204919","5.513","0.002","6.733","0.002","13.026","0.007","95.32","0.03","99.39","0.04","100.24","0.03","465.7","0.3","295","2","295","2","","","","","","","Sigma-Aldrich Company Ltd.","4","P -1","-P 1","2","Phenazine bis(maleic acid)","dibenzopyrazine bis(cis-2-butenedioic acid)","","- C20 H16 N2 O8 -","- C20 H16 N2 O8 -","- C20 H16 N2 O8 -","1","0.5","","Batchelor, Elaine; Klinowski, Jacek; Jones, William","Crystal engineering using co‐crystallisation of phenazine with dicarboxylic acids","Journal of Materials Chemistry","2000","10","4","839","","10.1039/a908214j","","","0.71069","MoKα","","0.046","0.0339","","0.0986","0.0887","","","","1.005","1.002","1.002","","","","","has coordinates","180380","2020-10-21","18:00:00",""
"7204920","6.679","0.0009","18.66","0.002","8.933","0.001","90","","105.13","0.02","90","","1074.7","0.2","295","2","295","2","","","","","","","Sigma-Aldrich Company Ltd.","4","P 1 21/n 1","-P 2yn","14","Phenazine bis (citraconic acid)","dibenzopyrazine bis(cis-2-methyl-2-butenedioic acid)","","- C11 H10 N O4 -","- C11 H10 N O4 -","- C44 H40 N4 O16 -","4","1","","Batchelor, Elaine; Klinowski, Jacek; Jones, William","Crystal engineering using co‐crystallisation of phenazine with dicarboxylic acids","Journal of Materials Chemistry","2000","10","4","839","","10.1039/a908214j","","","0.71069","MoKα","","0.1091","0.0393","","0.1262","0.0867","","","","0.926","0.963","0.963","","","","","has coordinates","180380","2020-10-21","18:00:00",""
"7204921","5.2792","0.0004","9.057","0.001","15.054","0.001","90","","99.141","0.007","90","","710.65","0.11","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Phenazine succinic acid","dibenzopyrazine butanedioic acid","","- C8 H7 N O2 -","- C8 H7 N O2 -","- C32 H28 N4 O8 -","4","1","","Batchelor, Elaine; Klinowski, Jacek; Jones, William","Crystal engineering using co‐crystallisation of phenazine with dicarboxylic acids","Journal of Materials Chemistry","2000","10","4","839","","10.1039/a908214j","","","0.71069","MoKα","","0.0456","0.0347","","","0.1011","0.1366","","","","","","1.211","","","","has coordinates","180380","2020-10-21","18:00:00",""
"7204922","5.6755","0.0005","9.997","0.002","10.866","0.001","116.611","0.01","95.117","0.011","90.044","0.01","548.44","0.14","295","2","295","2","","","","","","","","4","P -1","-P 1","2","Phenazine bis(glutaric acid)","dibenzopyrazine bis(pentanedioic acid)","","- C11 H12 N O4 -","- C11 H12 N O4 -","- C22 H24 N2 O8 -","2","1","","Batchelor, Elaine; Klinowski, Jacek; Jones, William","Crystal engineering using co‐crystallisation of phenazine with dicarboxylic acids","Journal of Materials Chemistry","2000","10","4","839","","10.1039/a908214j","","","0.71069","MoKα","","0.1099","0.0463","","","0.1078","0.1319","","","","","","0.984","","","","has coordinates","180380","2020-10-21","18:00:00",""
"7204923","27.99","0.003","7.946","0.002","13.357","0.001","90","","103.415","0.009","90","","2889.7","0.8","297","","297","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C52 H36 As F6 N4 O S18 -","- C52 H36 As0.5 F6 N4 O S18 -","- C104 H72 As F12 N8 O2 S36 -","2","0.5","","Uruichi, Mikio; Yakushi, Kyuya; Yamashita, Yoshiro","Optical properties and metal‒insulator transitions in organic metals (BEDT-ATD)2X(solvent) (X = PF6, AsF6, BF4; solvent = THF, DHF, DO) [BEDT-ATD = 4,11-bis(4',5'-ethylenedithio-1',3'-dithiol-2'-ylidene)-4,11-dihydroanthra[2,3-c][1,2,5]thiadiazole]","Journal of Materials Chemistry","2000","10","12","2716","","10.1039/b002904l","","","0.7107","MoKα","","","0.062","","","0.073","","","","","1.728","1.728","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204924","27.67","0.01","7.601","0.001","13.342","0.003","90","","102.05","0.03","90","","2744.3","1.3","90","","90","","","","","","","","","7","P 1 a 1","P -2ya","7","","","","- C52 H36 B F4 N4 O S18 -","- C52 H36 B F4 N4 O S18 -","- C104 H72 B2 F8 N8 O2 S36 -","2","1","","Uruichi, Mikio; Yakushi, Kyuya; Yamashita, Yoshiro","Optical properties and metal‒insulator transitions in organic metals (BEDT-ATD)2X(solvent) (X = PF6, AsF6, BF4; solvent = THF, DHF, DO) [BEDT-ATD = 4,11-bis(4',5'-ethylenedithio-1',3'-dithiol-2'-ylidene)-4,11-dihydroanthra[2,3-c][1,2,5]thiadiazole]","Journal of Materials Chemistry","2000","10","12","2716","","10.1039/b002904l","","","0.7107","MoKα","","","0.0805","","","0.0847","","","","","2.249","2.249","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204925","27.78","0.01","7.826","0.001","13.346","0.003","90","","101.99","0.02","90","","2838.2","1.3","300","","300","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C52 H36 B F4 N4 O S18 -","- C52 H36 B0.5 F4 N4 O S18 -","- C104 H72 B F8 N8 O2 S36 -","2","0.5","","Uruichi, Mikio; Yakushi, Kyuya; Yamashita, Yoshiro","Optical properties and metal‒insulator transitions in organic metals (BEDT-ATD)2X(solvent) (X = PF6, AsF6, BF4; solvent = THF, DHF, DO) [BEDT-ATD = 4,11-bis(4',5'-ethylenedithio-1',3'-dithiol-2'-ylidene)-4,11-dihydroanthra[2,3-c][1,2,5]thiadiazole]","Journal of Materials Chemistry","2000","10","12","2716","","10.1039/b002904l","","","0.7107","MoKα","","","0.105","","","7654360","","","","","194189","194189","","","","","has coordinates","195719","2020-10-21","18:00:00",""
"7204926","27.866","0.001","7.926","0.001","13.3035","0.0006","90","","103.59","0.004","90","","2856","0.4","297","","297","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C52 H34 F6 N4 O P S18 -","- C52 H36 F6 N4 O P0.5 S18 -","- C104 H72 F12 N8 O2 P S36 -","2","0.5","","Uruichi, Mikio; Yakushi, Kyuya; Yamashita, Yoshiro","Optical properties and metal‒insulator transitions in organic metals (BEDT-ATD)2X(solvent) (X = PF6, AsF6, BF4; solvent = THF, DHF, DO) [BEDT-ATD = 4,11-bis(4',5'-ethylenedithio-1',3'-dithiol-2'-ylidene)-4,11-dihydroanthra[2,3-c][1,2,5]thiadiazole]","Journal of Materials Chemistry","2000","10","12","2716","","10.1039/b002904l","","","0.7107","MoKα","","","0.0773","","","0.1034","","","","","2.455","2.455","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204927","27.879","0.005","7.954","0.006","13.337","0.002","90","","103.61","0.01","90","","2874","2","296","","296","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C51 H34 F6 N4 O2 P S18 -","- C50 H36 F6 N4 O P0.5 S18 -","- C100 H72 F12 N8 O2 P S36 -","2","0.5","","Uruichi, Mikio; Yakushi, Kyuya; Yamashita, Yoshiro","Optical properties and metal‒insulator transitions in organic metals (BEDT-ATD)2X(solvent) (X = PF6, AsF6, BF4; solvent = THF, DHF, DO) [BEDT-ATD = 4,11-bis(4',5'-ethylenedithio-1',3'-dithiol-2'-ylidene)-4,11-dihydroanthra[2,3-c][1,2,5]thiadiazole]","Journal of Materials Chemistry","2000","10","12","2716","","10.1039/b002904l","","","0.7107","MoKα","","","0.0952","","","0.1175","","","","","2.344","2.344","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204928","27.665","0.002","7.781","0.002","13.3065","0.0007","90","","103.709","0.005","90","","2782.8","0.8","100","","100","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C52 H36 F6 N4 O P S18 -","- C52 H36 F6 N4 O2 P0.5 S18 -","- C104 H72 F12 N8 O4 P S36 -","2","0.5","","Uruichi, Mikio; Yakushi, Kyuya; Yamashita, Yoshiro","Optical properties and metal‒insulator transitions in organic metals (BEDT-ATD)2X(solvent) (X = PF6, AsF6, BF4; solvent = THF, DHF, DO) [BEDT-ATD = 4,11-bis(4',5'-ethylenedithio-1',3'-dithiol-2'-ylidene)-4,11-dihydroanthra[2,3-c][1,2,5]thiadiazole]","Journal of Materials Chemistry","2000","10","12","2716","","10.1039/b002904l","","","0.7107","MoKα","","","0.0752","","","0.0929","","","","","2.812","2.812","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204929","27.972","0.003","7.934","0.002","13.366","0.001","90","","102.931","0.008","90","","2891.1","0.8","297","","297","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C52 H34 F6 N4 O P S18 -","- C52 H36 F6 N4 O P0.5 S18 -","- C104 H72 F12 N8 O2 P S36 -","2","0.5","","Uruichi, Mikio; Yakushi, Kyuya; Yamashita, Yoshiro","Optical properties and metal‒insulator transitions in organic metals (BEDT-ATD)2X(solvent) (X = PF6, AsF6, BF4; solvent = THF, DHF, DO) [BEDT-ATD = 4,11-bis(4',5'-ethylenedithio-1',3'-dithiol-2'-ylidene)-4,11-dihydroanthra[2,3-c][1,2,5]thiadiazole]","Journal of Materials Chemistry","2000","10","12","2716","","10.1039/b002904l","","","0.7107","MoKα","","","0.0783","","","0.1031","","","","","2.132","2.132","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204930","27.712","0.002","7.787","0.002","13.3297","0.0009","90","","103.888","0.006","90","","2792.4","0.8","75","","75","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C52 H36 As F6 N4 O S18 -","- C52 H36 As0.5 F6 N4 O S18 -","- C104 H72 As F12 N8 O2 S36 -","2","0.5","","Uruichi, Mikio; Yakushi, Kyuya; Yamashita, Yoshiro","Optical properties and metal‒insulator transitions in organic metals (BEDT-ATD)2X(solvent) (X = PF6, AsF6, BF4; solvent = THF, DHF, DO) [BEDT-ATD = 4,11-bis(4',5'-ethylenedithio-1',3'-dithiol-2'-ylidene)-4,11-dihydroanthra[2,3-c][1,2,5]thiadiazole]","Journal of Materials Chemistry","2000","10","12","2716","","10.1039/b002904l","","","0.7107","MoKα","","","0.0702","","","0.0925","","","","","2.283","2.283","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7209385","4.681","","11.055","","7.535","","90","","90","","90","","389.925","","","","","","","","","","","","","3","C m c m","-C 2c 2","63","","Eu Au In2","","- Au Eu In2 -","- Au Eu In2 -","- Au4 Eu4 In8 -","4","0.25","","Kal'ichak, Ya.M.; Hoffmann, R.D.; Poettgen, R.; Zaremba, V.I.","New indides Eu Au In2, Eu Pd In4, Gd Rh In2, Yb Rh In4, and Yb Pd In4","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2000","55","","834","840","","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213176","7.99","0.01","15.168","0.002","9.7127","0.0013","90","","106.69","0.06","90","","1127.5","1.5","293","2","293","2","","","","","","","synthesis","5","P 1 21 1","P 2yb","4","","2,6,9,13-tetraazabicyclo[12.4.0]octadecane-2,6,9,13-tetraium tetrabromide","","- C14 H36 Br4 N4 O -","- C14 H36 Br4 N4 O -","- C28 H72 Br8 N8 O2 -","2","1","","Alfonso, Ignacio; Astorga, Covadonga; Rebolledo, Francisca; Gotor, Vicente; García-Granda, Santiago; Tesouro, Ana","Structural studies of two protonated forms of a C2 symmetrical optically active cyclam derivative","Journal of the Chemical Society, Perkin Transactions 2","2000","","4","899","","10.1039/a904998c","","","0.71073","MoKα","","0.145","0.0467","","0.132","0.0971","","","","1.037","1.065","1.065","","","","","has coordinates","193981","2020-10-21","18:00:00",""
"7213177","8.033","0.006","8.268","0.007","18.029","0.017","100.01","0.06","94.67","0.05","116.89","0.07","1034.1","1.7","293","2","293","2","","","","","","","","5","P 1","P 1","1","","2,6,9,13-tetraazabicyclo[12.4.0]octadecane-2,9-diium diperchlorate","","- C14 H32 Cl2 N4 O8 -","- C14 H32 Cl2 N4 O8 -","- C28 H64 Cl4 N8 O16 -","2","2","","Alfonso, Ignacio; Astorga, Covadonga; Rebolledo, Francisca; Gotor, Vicente; García-Granda, Santiago; Tesouro, Ana","Structural studies of two protonated forms of a C2 symmetrical optically active cyclam derivative","Journal of the Chemical Society, Perkin Transactions 2","2000","","4","899","","10.1039/a904998c","","","0.71073","MoKα","","0.2101","0.058","","","0.1207","0.1653","","","","","","0.986","","","","has coordinates","180462","2020-10-21","18:00:00",""
"7213183","3.78","0.001","7.621","0.001","10.581","0.002","90","0.01","90.2","0.01","90","0.01","304.81","0.11","273.2","","273.2","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C7 H6 O3 -","- C7 H6 O3 -","- C14 H12 O6 -","2","1","","Sarma, Jagarlapudi A. R. P.; Nagaraju, Akula; Majumdar, Kanak K.; Samuel, Purnima M.; Das, Indira; Roy, Sujit; McGhie, Alistair J.","Solid state nuclear bromination with N-bromosuccinimide. Part 2. Experimental and theoretical studies of reactions with some substituted benzaldehydes †","Journal of the Chemical Society, Perkin Transactions 2","2000","","6","1119","","10.1039/a905468e","","","0.7107","MoKα","","0.0399","0.0399","","0.0307","","0.0307","","","2.777","","","2.777","","","","has coordinates","193981","2020-10-21","18:00:00",""
"7213184","19.513","0.004","24.024","0.005","16.414","0.003","90","","104.49","0.03","90","","7450","3","13","2","13","2","","","","","","","","3","C 1 2 1","C 2y","5","beta-CD/4,7-dimethylcoumarin heptadecahydrate","","","- C53 H114 O54 -","- C53 H59 O54 -","- C212 H236 O216 -","4","1","","Brett, Tom J.; Alexander, Jennifer M.; Stezowski, John J.","Chemical insight from crystallographic disorder-structural studies of supramolecular photochemical systems. Part 2. The β-cyclodextrin‒4,7-dimethylcoumarin inclusion complex: a new β-cyclodextrin dimer packing type, unanticipated photoproduct formation, and an examination of guest influence on β-CD dimer packing","Journal of the Chemical Society, Perkin Transactions 2","2000","","6","1095","","10.1039/a906041c","","","0.71073","MoKα","","0.085","0.0805","","","0.2027","0.2063","","","","","","1.109","","","","has coordinates,has disorder","180462","2020-10-21","18:00:00",""
"7213185","9.733","","15.587","","5.722","","90","","99.184","0.002","90","","856.947","0.005","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","4,7-dimethylcoumarin anti-HT photodimer","","","- C22 H20 O4 -","- C22 H20 O4 -","- C44 H40 O8 -","2","1","","Brett, Tom J.; Alexander, Jennifer M.; Stezowski, John J.","Chemical insight from crystallographic disorder-structural studies of supramolecular photochemical systems. Part 2. The β-cyclodextrin‒4,7-dimethylcoumarin inclusion complex: a new β-cyclodextrin dimer packing type, unanticipated photoproduct formation, and an examination of guest influence on β-CD dimer packing","Journal of the Chemical Society, Perkin Transactions 2","2000","","6","1095","","10.1039/a906041c","","","0.71073","MoKα","","0.1746","0.119","","","0.2829","0.3015","","","","","","2.218","","","","has coordinates","180462","2020-10-21","18:00:00",""
"7213186","18.01","0.06","15.53","0.06","15.37","0.06","103.35","0.06","113.22","0.06","99.46","0.06","3684","2","298","2","298","2","","","","","","","","3","P 1","P 1","1","beta-CD/7OH-4ME-coumarin","","","- C104 H200 O98 -","- C104 H112 O98 -","- C104 H112 O98 -","1","1","","Brett, Tom J.; Alexander, Jennifer M.; Stezowski, John J.","Chemical insight from crystallographic disorder-structural studies of supramolecular photochemical systems. Part 3. The β-cyclodextrin‒7-hydroxy-4-methylcoumarin inclusion complex: direct observation of photodimerization by X-ray crystallography","Journal of the Chemical Society, Perkin Transactions 2","2000","","6","1105","","10.1039/a906042a","","","0.71073","MoKα","","0.078","0.0741","","","0.1954","0.2003","","","","","","1.09","","","","has coordinates,has disorder","180462","2020-10-21","18:00:00",""
"7213187","18.133","0.004","15.479","0.003","15.401","0.003","102.9","0.03","113.35","0.03","99.53","0.03","3709.4","1.9","298","2","298","2","","","","","","","","3","P 1","P 1","1","beta-CD/7OH-4ME-coumarin photolyzed","","","- C104 H200 O98 -","- C104 H112 O98.5 -","- C104 H112 O98.5 -","1","1","","Brett, Tom J.; Alexander, Jennifer M.; Stezowski, John J.","Chemical insight from crystallographic disorder-structural studies of supramolecular photochemical systems. Part 3. The β-cyclodextrin‒7-hydroxy-4-methylcoumarin inclusion complex: direct observation of photodimerization by X-ray crystallography","Journal of the Chemical Society, Perkin Transactions 2","2000","","6","1105","","10.1039/a906042a","","","0.71073","MoKα","","0.0785","0.0718","","","0.1901","0.1985","","","","","","1.078","","","","has coordinates,has disorder","180462","2020-10-21","18:00:00",""
"7213188","9.525","0.002","14.705","0.003","24.448","0.005","90","","90","","90","","3424.3","1.2","243","1","243","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","none","N,N'-bis(9-phenyl-9-xanthenyl)-ethylenediamine.tetrahydrofuran inclusion complex","","- C44 H40 N2 O3 -","- C44 H40 N2 O3 -","- C176 H160 N8 O12 -","4","1","","Barton, Benita; Caira, Mino R.; McCleland, Cedric W.; Taljaard, Benjamin","Synthesis of N,N′-bis(9-phenylxanthen-9-yl)ethylenediamine and an investigation of its host‒guest inclusion potential","Journal of the Chemical Society, Perkin Transactions 2","2000","","4","865","","10.1039/a907232b","","","0.71069","MoKα","","0.1599","0.0512","","","0.1309","0.1465","","","","","","0.945","","","","has coordinates","180462","2020-10-21","18:00:00",""
"7213189","10.703","0.002","12.29","0.002","21.49","0.004","90","","90","","90","","2826.8","0.9","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C32 H34 O5 -","- C32 H34 O5 -","- C128 H136 O20 -","4","1","","ysek, Robert; Krajewski, Piotr; Urbańczyk-Lipkowska, Zofia; Furman, Bartłomiej; Kałuża, Zbigniew; Kozerski, Lech; Chmielewski, Marek","Conformation of chiral alkoxyallenes by proton NMR spectroscopy","Journal of the Chemical Society, Perkin Transactions 2","2000","","1","61","","10.1039/a907289f","","","1.54178","CuKα","","0.0419","0.0391","","","0.0996","0.102","","","","","","1.032","","","","has coordinates","180462","2020-10-21","18:00:00",""
"7213190","14.427","0.006","15.199","0.006","7.498","0.003","98.72","0.03","99.51","0.03","106.61","0.03","1519.1","1.1","296","","296","","","","","","","","","4","P -1","-P 1","2","4-(N-Hexylbenz[c,d]indolinylidenemethyl)-2- (4-julolidinyl)-3-cyclobutene-1,3-dione","","","- C37 H39 N2 O3 -","- C37 H39 N2 O3 -","- C74 H78 N4 O6 -","2","1","","Yagi, Shigeyuki; Hyodo, Yutaka; Matsumoto, Shinya; Takahashi, Naoki; Kono, Hiroshi; Nakazumi, Hiroyuki","Synthesis of novel unsymmetrical squarylium dyes absorbing in the near-infrared region †","Journal of the Chemical Society, Perkin Transactions 1","2000","","4","599","","10.1039/a907335c","","","0.7107","MoKalpha","","0.127","0.127","","0.095","0.095","","","","2.67","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213191","9.0585","0.0014","8.2339","0.0014","14.66","0.003","90","","99.398","0.014","90","","1078.8","0.3","200","2","200","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","10,12-dichlorobicyclo[6.3.1]dodeca-1(12),8,10-triene","","- C12 H14 Cl2 -","- C12 H14 Cl2 -","- C48 H56 Cl8 -","4","1","","van Eis, Maurice J.; de Wolf, Willem H.; Bickelhaupt, Friedrich; Boese, Roland","Structures and strain energies of small [n]metacyclophanes","Journal of the Chemical Society, Perkin Transactions 2","2000","","4","793","","10.1039/a907863k","","","0.71073","MoKα","","0.0375","0.0314","","","0.0869","0.0911","","","","","","1.068","","","","has coordinates","180462","2020-10-21","18:00:00",""
"7213192","8.9226","0.0014","11.207","0.002","12.067","0.002","111.422","0.014","92.306","0.014","95.988","0.014","1113.2","0.3","233","2","233","2","","","","","","","","3","P -1","-P 1","2","","10,12-dichlorobicyclo[6.3.1]dodeca-1(12),8,10-triene","","- C12 H14 Cl2 -","- C12 H14 Cl2 -","- C48 H56 Cl8 -","4","2","","van Eis, Maurice J.; de Wolf, Willem H.; Bickelhaupt, Friedrich; Boese, Roland","Structures and strain energies of small [n]metacyclophanes","Journal of the Chemical Society, Perkin Transactions 2","2000","","4","793","","10.1039/a907863k","","","0.71073","MoKα","","0.0404","0.0349","","","0.0855","0.0898","","","","","","1.039","","","","has coordinates","180462","2020-10-21","18:00:00",""
"7213193","21.094","0.002","5.6478","0.0006","21.496","0.002","90","","90","","90","","2560.9","0.4","120","2","120","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","2,3,5,6-tetrakis(benzoyl)thiopyran-4-thione","","- C33 H20 O4 S2 -","- C33 H20 O4 S2 -","- C132 H80 O16 S8 -","4","1","","Jeppesen, Jan Oskar; Thorup, Niels; Becher, Jan","A novel thiopyran-4-thione synthesis and crystal structure of a thiopyran-4-thione","Journal of the Chemical Society, Perkin Transactions 1","2000","","9","1467","","10.1039/a908068f","","","0.71073","MoKα","","0.0394","0.0362","","","0.0865","0.0878","","","","","","1.089","","","","has coordinates,has disorder","180462","2020-10-21","18:00:00",""
"7213194","5.7212","0.0004","11.5757","0.0016","28.177","0.004","90","","90","","90","","1866.1","0.4","100","1","100","1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C21 H21 F N O2 P -","- C21 H21 F N O2 P -","- C84 H84 F4 N4 O8 P4 -","4","1","","Kotoris, Christopher C.; Wen, Wendy; Lough, Alan; Taylor, Scott D.","Preparation of chiral α-monofluoroalkylphosphonic acids and their evaluation as inhibitors of protein tyrosine phosphatase 1B","Journal of the Chemical Society, Perkin Transactions 1","2000","","8","1271","","10.1039/a908086d","","","0.71073","MoKα","","0.0887","0.0521","","","0.1049","0.1171","","","","","","1.004","","","","has coordinates","180462","2020-10-21","18:00:00",""
"7213195","11.8451","0.0005","27.3815","0.0019","6.0985","0.0008","90","","90","","90","","1978","0.3","100","2","100","2","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C23 H23 F N O2 P -","- C23 H23 F N O2 P -","- C92 H92 F4 N4 O8 P4 -","4","1","","Kotoris, Christopher C.; Wen, Wendy; Lough, Alan; Taylor, Scott D.","Preparation of chiral α-monofluoroalkylphosphonic acids and their evaluation as inhibitors of protein tyrosine phosphatase 1B","Journal of the Chemical Society, Perkin Transactions 1","2000","","8","1271","","10.1039/a908086d","","","0.71073","MoKα","","0.1102","0.0552","","","0.0949","0.108","","","","","","0.952","","","","has coordinates","180462","2020-10-21","18:00:00",""
"7213196","5.7208","0.0002","11.2412","0.0008","24.5839","0.0015","90","","90","","90","","1580.96","0.16","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C17 H19 F N O2 P -","- C17 H19 F N O2 P -","- C68 H76 F4 N4 O8 P4 -","4","1","","Kotoris, Christopher C.; Wen, Wendy; Lough, Alan; Taylor, Scott D.","Preparation of chiral α-monofluoroalkylphosphonic acids and their evaluation as inhibitors of protein tyrosine phosphatase 1B","Journal of the Chemical Society, Perkin Transactions 1","2000","","8","1271","","10.1039/a908086d","","","0.71073","MoKα","","0.0717","0.0452","","","0.0924","0.1","","","","","","0.949","","","","has coordinates","180462","2020-10-21","18:00:00",""
"7213197","6.6666","0.0004","12.1266","0.0005","11.6697","0.0006","90","","96.744","0.003","90","","936.89","0.08","200","2","200","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C21 H21 F N O2 P -","- C21 H21 F N O2 P -","- C42 H42 F2 N2 O4 P2 -","2","1","","Kotoris, Christopher C.; Wen, Wendy; Lough, Alan; Taylor, Scott D.","Preparation of chiral α-monofluoroalkylphosphonic acids and their evaluation as inhibitors of protein tyrosine phosphatase 1B","Journal of the Chemical Society, Perkin Transactions 1","2000","","8","1271","","10.1039/a908086d","","","0.71073","MoKα","","0.0393","0.0328","","","0.0771","0.08","","","","","","1.05","","","","has coordinates","180462","2020-10-21","18:00:00",""
"7213198","12.2726","0.0002","24.9928","0.0003","6.6447","0.0007","90","","90","","90","","2038.1","0.2","100","2","100","2","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C23 H23 F N O2 P -","- C23 H23 F N O2 P -","- C92 H92 F4 N4 O8 P4 -","4","1","","Kotoris, Christopher C.; Wen, Wendy; Lough, Alan; Taylor, Scott D.","Preparation of chiral α-monofluoroalkylphosphonic acids and their evaluation as inhibitors of protein tyrosine phosphatase 1B","Journal of the Chemical Society, Perkin Transactions 1","2000","","8","1271","","10.1039/a908086d","","","0.71073","MoKα","","0.0473","0.0354","","","0.0766","0.0796","","","","","","1.052","","","","has coordinates","180462","2020-10-21","18:00:00",""
"7213199","9.9593","0.0007","6.5312","0.0003","12.2863","0.0009","90","","92.346","0.003","90","","798.51","0.09","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C17 H19 F N O2 P -","- C17 H19 F N O2 P -","- C34 H38 F2 N2 O4 P2 -","2","1","","Kotoris, Christopher C.; Wen, Wendy; Lough, Alan; Taylor, Scott D.","Preparation of chiral α-monofluoroalkylphosphonic acids and their evaluation as inhibitors of protein tyrosine phosphatase 1B","Journal of the Chemical Society, Perkin Transactions 1","2000","","8","1271","","10.1039/a908086d","","","0.71073","MoKα","","0.0416","0.0366","","","0.0915","0.0937","","","","","","1.034","","","","has coordinates","180462","2020-10-21","18:00:00",""
"7213200","22.32","0.02","21.09","0.02","22.89","0.02","90","","94.583","0.01","90","","10741","17","293","2","293","2","","","","","","","","4","I 1 2/c 1","-I 2yc","15","","","","- C60 H80 N4 O6 -","- C60 H72 N4 O6 -","- C480 H576 N32 O48 -","8","1","","Beer, Paul D.; Drew, Michael G. B.; Gradwell, Kate","Synthesis and anion coordination chemistry of new calix[4]arene pyridinium receptors","Journal of the Chemical Society, Perkin Transactions 2","2000","","3","511","","10.1039/a908106b","","","0.71073","MoKα","","0.1851","0.0973","","","0.1999","0.2382","","","","","","1.152","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213201","10.442","0.007","13.208","0.009","23.11","0.02","72.321","0.01","85.089","0.01","73.503","0.01","2912","4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C61 H72 N4 O5 -","- C61 H72 N4 O5 -","- C122 H144 N8 O10 -","2","1","","Beer, Paul D.; Drew, Michael G. B.; Gradwell, Kate","Synthesis and anion coordination chemistry of new calix[4]arene pyridinium receptors","Journal of the Chemical Society, Perkin Transactions 2","2000","","3","511","","10.1039/a908106b","","","0.71073","MoKα","","0.1096","0.0793","","","0.2218","0.2453","","","","","","0.981","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213202","11.197","0.014","14.68","0.02","17.61","0.02","90.17","0.01","97.249","0.01","92.823","0.01","2868","6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C56 H74 Cl4 N3 O10 -","- C56 H71 Cl4 N3 O10 -","- C112 H142 Cl8 N6 O20 -","2","1","","Beer, Paul D.; Drew, Michael G. B.; Gradwell, Kate","Synthesis and anion coordination chemistry of new calix[4]arene pyridinium receptors","Journal of the Chemical Society, Perkin Transactions 2","2000","","3","511","","10.1039/a908106b","","","0.71073","MoKα","","0.0761","0.0561","","","0.1676","0.1745","","","","","","1.175","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7213203","28","0.02","15.619","0.014","13.818","0.014","90","","90","","90","","6043","9","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C76 H40 N6 O6 -","- C61 H76 N6 O6 -","- C244 H304 N24 O24 -","4","0.5","","Beer, Paul D.; Drew, Michael G. B.; Gradwell, Kate","Synthesis and anion coordination chemistry of new calix[4]arene pyridinium receptors","Journal of the Chemical Society, Perkin Transactions 2","2000","","3","511","","10.1039/a908106b","","","0.71073","MoKα","","0.0885","0.0557","","","0.1509","0.1621","","","","","","1.06","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213204","10.0872","0.0002","11.797","0.0002","7.7925","0.0002","90","","90","","90","","927.3","0.03","150","2","150","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C8 H14 N2 O2 -","- C8 H14 N2 O2 -","- C32 H56 N8 O8 -","4","0.5","","Marsman, Albert W.; van Walree, Cornelis A.; Havenith, Remco W. A.; Jenneskens, Leonardus W.; Lutz, Martin; Spek, Anthony L.; Lutz, Egbertus T. G.; van der Maas, Joop H.","Infinite, undulating chains of intermolecularly hydrogen bonded (E,E)-2,2-dimethylcyclohexane-1,3-dione dioximes in the solid state. A single crystal X-ray, charge density distribution and spectroscopic study","Journal of the Chemical Society, Perkin Transactions 2","2000","","3","501","","10.1039/a908335i","","","0.71073","MoKα","","0.0428","0.036","","","0.0963","0.1018","","","","","","1.062","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213205","7.1363","0.0002","7.2813","0.0002","11.6544","0.0003","87.8805","0.0018","72.1948","0.0013","82.7986","0.0016","572.03","0.03","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C10 H18 N2 O2 -","- C10 H18 N2 O2 -","- C20 H36 N4 O4 -","2","1","","Marsman, Albert W.; van Walree, Cornelis A.; Havenith, Remco W. A.; Jenneskens, Leonardus W.; Lutz, Martin; Spek, Anthony L.; Lutz, Egbertus T. G.; van der Maas, Joop H.","Infinite, undulating chains of intermolecularly hydrogen bonded (E,E)-2,2-dimethylcyclohexane-1,3-dione dioximes in the solid state. A single crystal X-ray, charge density distribution and spectroscopic study","Journal of the Chemical Society, Perkin Transactions 2","2000","","3","501","","10.1039/a908335i","","","0.71073","MoKα","","0.0442","0.0221","","","0.0281","0.0323","","","","","","0.7211","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213206","14.904","0.006","10.051","0.001","17.289","0.009","90","","98.12","0.02","90","","2563.9","1.7","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2(ax)-benzoyloxy-3(ax)-(1,1,3,3-tetramethyl-2,3-dihydro-isoindol-2-ylo xy)-trans- decalin","","- C29 H37 N O3 -","- C29 H36 N O3 -","- C116 H144 N4 O12 -","4","1","","Busfield, W. Ken; Byriel, Karl A.; Grice, I. Darren; Jenkins, Ian D.; Lynch, Daniel E.","The stereoselectivity of addition of benzoyloxyl radicals to trans-Δ2-octalin","Journal of the Chemical Society, Perkin Transactions 2","2000","","4","757","","10.1039/a908455j","","","0.71073","MoKα","","","0.04","","","0.044","","","","","","","","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213207","9.5471","0.0007","14.619","0.001","11.4954","0.0008","90","","97.993","0.005","90","","1588.82","0.19","296.2","","296.2","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C14.5 H14 Cl N3 O4 -","- C14.5 H15 Cl N3 O4 -","- C58 H60 Cl4 N12 O16 -","4","1","","Murashima, Takashi; Tamai, Ryuji; Nishi, Keiji; Nomura, Kentaroh; Fujita, Ken-ichi; Uno, Hidemitsu; Ono, Noboru","Synthesis and X-ray structure of stable 2H-isoindoles","Journal of the Chemical Society, Perkin Transactions 1","2000","","6","995","","10.1039/a908641b","","","1.5418","CuKα","","0.0804","0.08","","0.075","","0.075","","","2.896","","","2.9","","","","has coordinates","193981","2020-10-21","18:00:00",""
"7213208","21.396","0.008","5.699","0.004","24.09","0.009","90","","94.45","0.05","90","","2929","3","120","2","293","2","","","","","","","synthesis as described","4","P 1 21/n 1","-P 2yn","14","","","","- C33 H31 Cl3 O4 -","- C33 H30 Cl3 O4 -","- C132 H120 Cl12 O16 -","4","1","","Utley, James H. P.; Smith, Carmen Z.; Motevalli, Majid","Electro-organic reactions. Part 51.† Reactivity and stereochemical pathways for cathodically generated radical-anions of α,β-unsaturated ketones in aqueous media","Journal of the Chemical Society, Perkin Transactions 2","2000","","5","1053","","10.1039/a908657i","","","0.71073","MoKα","","0.4081","0.1627","","","0.4387","0.5726","","","","","","0.915","","","","has coordinates,has disorder","180463","2020-10-21","18:00:00",""
"7213209","11.431","0.005","6.047","0.001","18.286","0.006","90","","96.69","0.07","90","","1255.4","0.7","120","2","293","2","","","","","","","synthesis as described","3","P 1 21 1","P 2yb","4","","","","- C32 H30 O4 -","- C32 H30 O4 -","- C64 H60 O8 -","2","1","","Utley, James H. P.; Smith, Carmen Z.; Motevalli, Majid","Electro-organic reactions. Part 51.† Reactivity and stereochemical pathways for cathodically generated radical-anions of α,β-unsaturated ketones in aqueous media","Journal of the Chemical Society, Perkin Transactions 2","2000","","5","1053","","10.1039/a908657i","","","0.71073","MoKα","","0.1431","0.0478","","","0.1083","0.1443","","","","","","0.876","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213210","5.73","0.001","12.176","0.001","20.499","0.001","90","","90","","90","","1430.2","0.3","223","2","223","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H22 O S -","- C16 H22 O S -","- C64 H88 O4 S4 -","4","1","","Hoffmann, Reinhard W.; Koberstein, Ralf","Chiral organometallic reagents. Part XXV.1 The stereochemistry of the ring opening of cyclopropylallyllithium compounds","Journal of the Chemical Society, Perkin Transactions 2","2000","","3","595","","10.1039/a908668d","","","1.54178","CuKα","","0.0448","0.0428","","","0.1305","0.1317","","","","","","1.213","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213211","7.354","0.001","12.314","0.001","29.346","0.001","90","","90.488","0.001","90","","2657.4","0.4","173","2","173","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H15 N O -","- C18 H15 N O -","- C144 H120 N8 O8 -","8","2","","Kolehmainen, Erkki; Ośmiałowski, Borys; Krygowski, Tadeusz M.; Kauppinen, Reijo; Nissinen, Maija; Gawinecki, Ryszard","Substituent and temperature controlled tautomerism: multinuclear magnetic resonance, X-ray, and theoretical studies on 2-phenacylquinolines","Journal of the Chemical Society, Perkin Transactions 2","2000","","6","1259","","10.1039/a908874a","","","0.71073","MoKα","","0.1093","0.0614","","","0.1347","0.1522","","","","","","1.11","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213212","7.2831","0.0001","14.4511","0.0005","12.5032","0.0004","90","","90.693","0.002","90","","1315.85","0.06","173","2","173","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H15 N O -","- C18 H15 N O -","- C72 H60 N4 O4 -","4","1","","Kolehmainen, Erkki; Ośmiałowski, Borys; Krygowski, Tadeusz M.; Kauppinen, Reijo; Nissinen, Maija; Gawinecki, Ryszard","Substituent and temperature controlled tautomerism: multinuclear magnetic resonance, X-ray, and theoretical studies on 2-phenacylquinolines","Journal of the Chemical Society, Perkin Transactions 2","2000","","6","1259","","10.1039/a908874a","","","0.71073","MoKα","","0.0585","0.046","","","0.1102","0.1178","","","","","","1.042","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213213","7.3719","0.0002","14.455","0.0004","12.5837","0.0003","90","","90.736","0.002","90","","1340.82","0.06","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H15 N O -","- C18 H15 N O -","- C72 H60 N4 O4 -","4","1","","Kolehmainen, Erkki; Ośmiałowski, Borys; Krygowski, Tadeusz M.; Kauppinen, Reijo; Nissinen, Maija; Gawinecki, Ryszard","Substituent and temperature controlled tautomerism: multinuclear magnetic resonance, X-ray, and theoretical studies on 2-phenacylquinolines","Journal of the Chemical Society, Perkin Transactions 2","2000","","6","1259","","10.1039/a908874a","","","0.71073","MoKα","","0.0719","0.0508","","","0.1196","0.1336","","","","","","1.041","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213214","5.903","0.001","7.652","0.001","28.437","0.001","90","","90","","90","","1284.5","0.3","173","0.1","173","0.1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C17 H12 F N O -","- C17 H12 F N O -","- C68 H48 F4 N4 O4 -","4","1","","Kolehmainen, Erkki; Ośmiałowski, Borys; Krygowski, Tadeusz M.; Kauppinen, Reijo; Nissinen, Maija; Gawinecki, Ryszard","Substituent and temperature controlled tautomerism: multinuclear magnetic resonance, X-ray, and theoretical studies on 2-phenacylquinolines","Journal of the Chemical Society, Perkin Transactions 2","2000","","6","1259","","10.1039/a908874a","","","0.71073","MoKα","","0.0975","0.052","","","0.098","0.1157","","","","","","1.025","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213215","4.47","0.001","12.388","0.001","24.375","0.001","90","","90","","90","","1349.8","0.3","173","0.1","173","2","","","","","","","","5","P c 21 b","P -2bc -2c","29","","","","- C17 H12 Br N O -","- C17 H12 Br N O -","- C68 H48 Br4 N4 O4 -","4","1","","Kolehmainen, Erkki; Ośmiałowski, Borys; Krygowski, Tadeusz M.; Kauppinen, Reijo; Nissinen, Maija; Gawinecki, Ryszard","Substituent and temperature controlled tautomerism: multinuclear magnetic resonance, X-ray, and theoretical studies on 2-phenacylquinolines","Journal of the Chemical Society, Perkin Transactions 2","2000","","6","1259","","10.1039/a908874a","","","0.71073","MoKα","","0.0769","0.0453","","","0.0934","0.1095","","","","","","1.051","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213216","14.056","0.003","13.921","0.003","18.25","0.004","90","","90","","90","","3571","1.3","173","2","173","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","[1-(2'-Difluoroboryloxy-4'-methoxyphenyl)-2-(4""-methoxyphenyl)-3- (N,N'-dimethyl)]-2-propen-1-dione","","- C19 H20 B F2 N O4 -","- C19 H20 B F2 N O4 -","- C152 H160 B8 F16 N8 O32 -","8","1","","Balasubramanian, Sreenivasan; Ward, Donald L.; Nair, Muraleedharan G.","The first isolation and crystal structure of a boron difluoro complex (isoflavone yellow). Biologically active intermediates produced during isoflavone synthesis","Journal of the Chemical Society, Perkin Transactions 1","2000","","4","567","","10.1039/a908915b","","","0.71073","MoKα","","0.0704","0.0494","","","0.0877","0.0947","","","","","","1.152","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213217","9.68","0.003","7.87","0.003","18.254","0.006","90","","95.27","","90","","1384.7","0.8","293","2","293","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C8 H20 N6 S2 -","- C8 H20 N6 S2 -","- C32 H80 N24 S8 -","4","1","","Yutronic, Nicolás; Manriquez, Victor; Jara, Paul; Witke, Oscar; Merchán, Juan; González, Guillermo","Bis(thiourea)-1,2-diazabicyclo[2.2.2]octane. A new layered thiourea inclusion compound","Journal of the Chemical Society, Perkin Transactions 2","2000","","8","1757","","10.1039/a908919e","","","0.71073","MoKα","","0.0939","0.0727","","","0.201","0.229","","","","","","1.077","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213218","9.093","0.002","14.257","0.003","8.389","0.002","93.42","0.05","107.21","0.05","84.84","0.05","1034","0.5","295","","295","","","","","","","","......","4","P -1","-P 1","2","","2-Phenyl-3-(2-benzil)imino-3H-indole","","- C28 H18 N2 O2 -","- C28 H18 N2 O2 -","- C56 H36 N4 O4 -","2","1","","Greci, Lucedio; Tommasi, Giampaolo; Astolfi, Paola; Petrucci, Rita; Marrosu, Giancarlo; Trazza, Antonio; Sgarabotto, Paolo; Righi, Lara","Radical cations: reactions of 2-phenylindole with aromatic amines under anodic oxidation. β-Scission of an amino alkoxy radical","Journal of the Chemical Society, Perkin Transactions 2","2000","","8","1749","","10.1039/a909035e","","","1.54178","X","","","","","","","0.059","","","","","","0.749","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213219","9.392","0.002","10.962","0.002","17.823","0.004","90","","94.29","0.03","90","","1829.8","0.7","293","2","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C18 H27 N O2 S -","- C18 H27 N O2 S -","- C72 H108 N4 O8 S4 -","4","2","","Reutzel-Edens, Susan M.; Russell, Victoria A.; Yu, Lian","Molecular basis for the stability relationships between homochiral and racemic crystals of tazofelone: a spectroscopic, crystallographic, and thermodynamic investigation","Journal of the Chemical Society, Perkin Transactions 2","2000","","5","913","","10.1039/a909259e","","","1.54178","CuKα","","0.0642","0.0554","","0.1571","0.1413","","","","0.942","0.941","0.941","","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213220","11.313","0.003","17.082","0.004","19.324","0.007","90","","101.11","0.02","90","","3664.4","1.9","293","2","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H27 N O2 S -","- C18 H27 N O2 S -","- C144 H216 N8 O16 S8 -","8","2","","Reutzel-Edens, Susan M.; Russell, Victoria A.; Yu, Lian","Molecular basis for the stability relationships between homochiral and racemic crystals of tazofelone: a spectroscopic, crystallographic, and thermodynamic investigation","Journal of the Chemical Society, Perkin Transactions 2","2000","","5","913","","10.1039/a909259e","","","1.54178","MoKα","","0.0764","0.0636","","0.2203","0.1911","","","","1.144","1.174","1.174","","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213221","11.8635","0.0008","13.2643","0.0009","18.9431","0.0014","90","","90","","90","","2980.9","0.4","220","2","220","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C20 H18 N2 -","- C20 H18 N2 -","- C160 H144 N16 -","8","1","","Sharp, John T.; Wilson, Paul; Parsons, Simon; Gould, Robert O.","Reactions of triene-conjugated diazo-compounds: reaction paths from o-(1,3-dienyl)aryldiazomethanes to 3,8-methano-1,2-diazocines and to pyrrolo[2,1-a]phthalazines via intramolecular (3 + 2) and 1,1-cycloaddition reactions","Journal of the Chemical Society, Perkin Transactions 1","2000","","7","1139","","10.1039/a909516k","","","1.5418","CuKα","","0.05","0.046","","","0.1161","0.1189","","","","","","1.113","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213222","18.699","0.002","22.045","0.002","6.898","0.002","90","","90","","90","","2843.5","0.9","220","2","220","2","","","","","","","","2","P c c n","-P 2ab 2ac","56","","","","- C20 H18 -","- C20 H18 -","- C160 H144 -","8","1","","Sharp, John T.; Wilson, Paul; Parsons, Simon; Gould, Robert O.","Reactions of triene-conjugated diazo-compounds: reaction paths from o-(1,3-dienyl)aryldiazomethanes to 3,8-methano-1,2-diazocines and to pyrrolo[2,1-a]phthalazines via intramolecular (3 + 2) and 1,1-cycloaddition reactions","Journal of the Chemical Society, Perkin Transactions 1","2000","","7","1139","","10.1039/a909516k","","","1.54184","CuKα","","0.1163","0.0563","","0.1468","0.1182","","","","1.006","1.111","1.111","","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213223","17.081","0.002","7.0507","0.0008","16.116","0.002","90","","112.113","0.006","90","","1798.1","0.4","220","","220","","","","","","","","?","3","P 1 21/c 1","-P 2ybc","14","","","","- C24 H20 N2 -","- C24 H20 N2 -","- C96 H80 N8 -","4","1","","Sharp, John T.; Wilson, Paul; Parsons, Simon; Gould, Robert O.","Reactions of triene-conjugated diazo-compounds: reaction paths from o-(1,3-dienyl)aryldiazomethanes to 3,8-methano-1,2-diazocines and to pyrrolo[2,1-a]phthalazines via intramolecular (3 + 2) and 1,1-cycloaddition reactions","Journal of the Chemical Society, Perkin Transactions 1","2000","","7","1139","","10.1039/a909516k","","","1.5418","CuKα","","","0.0451","","","0.0475","","","","","1.1246","1.1246","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7213224","9.479","0.002","10.342","0.001","15.374","0.002","94.17","0.01","99.43","0.02","91.32","0.02","1481.9","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Dimethyl N-(phenylmethyl)-N-[2'-phenyl-2'-(p-nitrobenzoyloxy)ethyl] (amino)(phenyl)methylphosphonate","","- C31 H31 N2 O7 P -","- C31 H31 N2 O7 P -","- C62 H62 N4 O14 P2 -","2","1","","Wróblewski, Andrzej E.; Maniukiewicz, Waldemar; Karolczak, Wiesława","Unusual reactivity of cis-2-benzoyl-1-benzyl-3-phenylaziridine with P-nucleophiles—ring opening vs. the Abramov reaction","Journal of the Chemical Society, Perkin Transactions 1","2000","","9","1433","","10.1039/a909521g","","","1.54178","CuKα","","0.0763","0.0546","","","0.1528","0.1736","","","","","","1.006","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213225","6.116","0.001","16.34","0.002","22.124","0.004","90","","90","","90","","2211","0.6","294","2","294","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(1R^*^2'R^*^3'S^*^)-(hydroxy)(phenyl)[3'-phenyl-1'-(phenylmethyl)- -2'-aziridinyl]methylphosphonate","","- C24 H26 N O4 P -","- C24 H26 N O4 P -","- C96 H104 N4 O16 P4 -","4","1","","Wróblewski, Andrzej E.; Maniukiewicz, Waldemar; Karolczak, Wiesława","Unusual reactivity of cis-2-benzoyl-1-benzyl-3-phenylaziridine with P-nucleophiles—ring opening vs. the Abramov reaction","Journal of the Chemical Society, Perkin Transactions 1","2000","","9","1433","","10.1039/a909521g","","","1.54178","CuKα","","0.0581","0.035","","","0.0996","0.1127","","","","","","1.042","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213226","9.637","0.002","15.251","0.003","9.109","0.002","90","","96.86","0.03","90","","1329.2","0.5","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H10 N2 O4 -","- C14 H10 N2 O4 -","- C56 H40 N8 O16 -","4","1","","Liu, You-Cheng; Wang, Hong-Yi; Yang, Qing-Chuan; Mak, Thomas C. W.","Mechanism of reduction of 1,1-diphenyl-2,2-dinitroethylene by 1-benzyl-1,4-dihydronicotinamide: transition state with partial diradical and partial covalent bonding character","Journal of the Chemical Society, Perkin Transactions 2","2000","","4","649","","10.1039/a909716c","","","0.71073","MoKα","","0.0784","0.0587","","","0.144","0.1571","","","","","","1.109","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213227","6.365","0.004","6.829","0.003","8.949","0.005","71.54","0.04","82.58","0.06","89.22","0.05","365.7","0.4","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","2R,2'S-trans-1,4-bis(2H-hexafluoropropyl)cyclohexane","","- C12 H12 F12 -","- C12 H12 F12 -","- C12 H12 F12 -","1","0.5","","Chambers, Richard D.; Fuss, Robert W.; Spink, Robert C. H.; Greenhall, Martin P.; Kenwright, Alan M.; Batsanov, Andrei S.; Howard, Judith A. K.","Free radical chemistry. Part 10. Addition of acyclic and cyclic alkanes to hexafluoropropene","Journal of the Chemical Society, Perkin Transactions 1","2000","","10","1623","","10.1039/a909777e","","","0.71073","MoKα","","0.0945","0.0373","","0.1181","0.0938","","","","1.071","1.184","1.184","","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213228","11.442","0.008","14.992","0.014","15.011","0.01","90","","90","","90","","2575","3","150","2","150","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","1,3,5,7-tetrakis(2H-hexafluoropropyl)adamantane","","- C22 H16 F24 -","- C22 H14 F24 -","- C88 H56 F96 -","4","0.5","","Chambers, Richard D.; Fuss, Robert W.; Spink, Robert C. H.; Greenhall, Martin P.; Kenwright, Alan M.; Batsanov, Andrei S.; Howard, Judith A. K.","Free radical chemistry. Part 10. Addition of acyclic and cyclic alkanes to hexafluoropropene","Journal of the Chemical Society, Perkin Transactions 1","2000","","10","1623","","10.1039/a909777e","","","0.71073","MoKα","","0.1636","0.119","","","0.3075","0.357","","","","","","1.026","","","","has coordinates,has disorder","180463","2020-10-21","18:00:00",""
"7213229","15.006","0.013","7.217","0.004","6.223","0.005","90","","102.74","0.07","90","","657.3","0.9","150","2","150","2","","","","","","","","3","C 1 2/m 1","-C 2y","12","","trans-1,4-bis(Z-pentafluoroprop-2-enyl)cyclohexane","","- C12 H10 F10 -","- C12 H10 F10 -","- C24 H20 F20 -","2","0.25","","Chambers, Richard D.; Fuss, Robert W.; Spink, Robert C. H.; Greenhall, Martin P.; Kenwright, Alan M.; Batsanov, Andrei S.; Howard, Judith A. K.","Free radical chemistry. Part 10. Addition of acyclic and cyclic alkanes to hexafluoropropene","Journal of the Chemical Society, Perkin Transactions 1","2000","","10","1623","","10.1039/a909777e","","","0.71073","MoKα","","0.0575","0.0441","","0.1142","0.1084","","","","1.069","1.132","1.132","","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213230","6.374","0.001","21.313","0.005","7.328","0.002","90","","95.864","0.01","90","","990.3","0.4","295","2","295","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","trans-cyclohexane-1,4-diol","","- C6 H12 O2 -","- C6 H12 O2 -","- C36 H72 O12 -","6","1.5","","Chambers, Richard D.; Diter, Patrick; Dunn, Stephen N.; Farren, Christopher; Sandford, Graham; Batsanov, Andrei S.; Howard, Judith A. K.","Free radical chemistry. Part 11. Additions of cyclic and acyclic alcohols and diols to hexafluoropropene","Journal of the Chemical Society, Perkin Transactions 1","2000","","10","1639","","10.1039/a909778c","","","0.71073","MoKα","","0.0847","0.0478","","0.1127","0.0876","","","","1.119","1.179","1.179","","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213231","12.651","0.001","10.436","0.001","22.301","0.002","90","","103.69","0.01","90","","2860.7","0.5","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","trans-1,3-di-(2H-hexafluoropropyl)-cyclopentane-1,3-diol","trans-1,3-di(1,1,2,3,3,3-hexafluoropropyl)-cyclopentane-1,3-diol","","- C11 H10 F12 O2 -","- C11 H9.9615 F12 O2 -","- C88 H79.692 F96 O16 -","8","2","","Chambers, Richard D.; Diter, Patrick; Dunn, Stephen N.; Farren, Christopher; Sandford, Graham; Batsanov, Andrei S.; Howard, Judith A. K.","Free radical chemistry. Part 11. Additions of cyclic and acyclic alcohols and diols to hexafluoropropene","Journal of the Chemical Society, Perkin Transactions 1","2000","","10","1639","","10.1039/a909778c","","","0.71073","MoKα","","0.1832","0.0944","","0.2028","0.15","","","","1.123","1.293","1.293","","","","","has coordinates,has disorder","180463","2020-10-21","18:00:00",""
"7213232","10.59","0.002","39.347","0.003","15.135","0.005","90","","94.6","0.01","90","","6286","2","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","cis-1,3-di(2H-hexafluoropropyl)-cyclohexane-1,3-diol","cis-1,3-di(1,1,2,3,3,3-hexafluoropropyl)-cyclohexane-1,3-diol","","- C12 H12 F12 O2 -","- C12 H10.5 F12 O2 -","- C192 H168 F192 O32 -","16","4","","Chambers, Richard D.; Diter, Patrick; Dunn, Stephen N.; Farren, Christopher; Sandford, Graham; Batsanov, Andrei S.; Howard, Judith A. K.","Free radical chemistry. Part 11. Additions of cyclic and acyclic alcohols and diols to hexafluoropropene","Journal of the Chemical Society, Perkin Transactions 1","2000","","10","1639","","10.1039/a909778c","","","0.71073","MoKα","","0.214","0.1416","","0.378","0.3052","","","","1.17","1.346","1.346","","","","","has coordinates,has disorder","180463","2020-10-21","18:00:00",""
"7213233","14.6732","0.0016","10.8011","0.0019","18.8818","0.0017","90","","90.904","0.008","90","","2992.1","0.7","150","2","150","2","","","","","","","","4","P 1 n 1","P -2yac","7","","trans-1,4-di(1,1,2,3,3,3-hexafluoropropyl)-cyclohexane-1,4-diol","","- C12 H12 F12 O2 -","- C12 H11.75 F12 O2 -","- C96 H94 F96 O16 -","8","4","","Chambers, Richard D.; Diter, Patrick; Dunn, Stephen N.; Farren, Christopher; Sandford, Graham; Batsanov, Andrei S.; Howard, Judith A. K.","Free radical chemistry. Part 11. Additions of cyclic and acyclic alcohols and diols to hexafluoropropene","Journal of the Chemical Society, Perkin Transactions 1","2000","","10","1639","","10.1039/a909778c","","","1.54184","CuKα","","0.1844","0.137","","","0.3101","0.341","","","","","","2.121","","","","has coordinates,has disorder","180463","2020-10-21","18:00:00",""
"7213234","10.709","0.004","10.853","0.003","13.926","0.004","106.98","0.01","99.83","0.02","91.33","0.01","1520.7","0.8","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","trans-1,4-di-(1,1,2,3,3,3-hexafluoropropyl)-cyclohexane-1,4-diol aldol (3:2)","","- C48 H60 F36 O10 -","- C48 H59.242 F36 O10 -","- C48 H59.242 F36 O10 -","1","0.5","","Chambers, Richard D.; Diter, Patrick; Dunn, Stephen N.; Farren, Christopher; Sandford, Graham; Batsanov, Andrei S.; Howard, Judith A. K.","Free radical chemistry. Part 11. Additions of cyclic and acyclic alcohols and diols to hexafluoropropene","Journal of the Chemical Society, Perkin Transactions 1","2000","","10","1639","","10.1039/a909778c","","","0.71073","MoKα","","0.1363","0.0939","","","0.1996","0.2403","","","","","","1.183","","","","has coordinates,has disorder","180463","2020-10-21","18:00:00",""
"7213235","11.094","0.002","28.75","0.002","5.363","0.003","90","","90","","90","","1710.5","1","294","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H17 Br O5 -","- C18 H17 Br O5 -","- C72 H68 Br4 O20 -","4","1","","Russell, Michael G. N.; Baker, Raymond; Ball, Richard G.; Thomas, Steven R.; Tsou, Nancy N.; Castro, José L.","Asymmetric synthesis of the northern segment of ephedradine C","Journal of the Chemical Society, Perkin Transactions 1","2000","","6","893","","10.1039/a909816j","","","1.54184","CuKα","","","0.0446","","","0.156","","","","","1.168","1.168","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213236","11.799","0.004","25.651","0.006","7.991","0.006","90","","90","","90","","2419","2","294","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C24 H29 N O7 -","- C24 H29 N O7 -","- C96 H116 N4 O28 -","4","1","","Russell, Michael G. N.; Baker, Raymond; Ball, Richard G.; Thomas, Steven R.; Tsou, Nancy N.; Castro, José L.","Asymmetric synthesis of the northern segment of ephedradine C","Journal of the Chemical Society, Perkin Transactions 1","2000","","6","893","","10.1039/a909816j","","","1.54184","CuKα","","","0.069","","","0.166","","","","","1.272","1.272","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213237","7.327","0.001","9.042","0.002","18.534","0.004","88.09","0.03","85.07","0.03","68.07","0.03","1134.8","0.5","293","2","293","2","","","","","","","","3","P -1","-P 1","2","4-(triphenylmethyl)benzoic acid xylene clathrate","","","- C30 H25 O2 -","- C30 H20 O2 -","- C60 H40 O4 -","2","1","","Jetti, Ram K. R.; Xue, Feng; Mak, Thomas C. W.; Nangia, Ashwini","4-Tritylbenzoic acid. A molecular scaffold for wheel-and-axle host‒guest inclusion compounds with a supramolecular axis","Journal of the Chemical Society, Perkin Transactions 2","2000","","6","1223","","10.1039/a909827e","","","0.71073","MoKα","","0.1282","0.066","","0.2253","0.1878","","","","1.038","1.153","1.153","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213238","7.31","0.001","8.994","0.001","18.454","0.002","89.19","0.01","85.75","0.01","68.23","0.01","1123.5","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","4-(triphenylmethyl)benzoic acid chlorobenzene clathrate","","","- C29 H22.5 Cl0.5 O2 -","- C58 H40 Cl0.5 O4 -","- C58 H40 Cl0.5 O4 -","1","0.5","","Jetti, Ram K. R.; Xue, Feng; Mak, Thomas C. W.; Nangia, Ashwini","4-Tritylbenzoic acid. A molecular scaffold for wheel-and-axle host‒guest inclusion compounds with a supramolecular axis","Journal of the Chemical Society, Perkin Transactions 2","2000","","6","1223","","10.1039/a909827e","","","0.71073","MoKα","","0.1694","0.0755","","0.2716","0.2204","","","","1.039","1.224","1.224","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213239","7.329","0.001","9.044","0.001","18.547","0.001","88.54","0.01","85.33","0.01","67.63","0.01","1133.1","0.2","293","2","293","2","","","","","","","","3","P -1","-P 1","2","4-(triphenylmethyl)benzoic acid m-xylene clathrate","","","- C30 H25 O2 -","- C30 H20 O2 -","- C60 H40 O4 -","2","1","","Jetti, Ram K. R.; Xue, Feng; Mak, Thomas C. W.; Nangia, Ashwini","4-Tritylbenzoic acid. A molecular scaffold for wheel-and-axle host‒guest inclusion compounds with a supramolecular axis","Journal of the Chemical Society, Perkin Transactions 2","2000","","6","1223","","10.1039/a909827e","","","0.71073","MoKα","","0.1199","0.0519","","0.1925","0.1473","","","","1.023","1.133","1.133","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213240","7.368","0.001","9.01","0.001","18.522","0.001","88","0.01","84.97","0.01","67.94","0.01","1135.2","0.2","293","2","293","2","","","","","","","","3","P -1","-P 1","2","4-(triphenylmethyl)benzoic acid o-xylene clathrate","","","- C30 H25 O2 -","- C30 H23 O2 -","- C60 H46 O4 -","2","1","","Jetti, Ram K. R.; Xue, Feng; Mak, Thomas C. W.; Nangia, Ashwini","4-Tritylbenzoic acid. A molecular scaffold for wheel-and-axle host‒guest inclusion compounds with a supramolecular axis","Journal of the Chemical Society, Perkin Transactions 2","2000","","6","1223","","10.1039/a909827e","","","0.71073","MoKα","","0.2179","0.0576","","0.1733","0.133","","","","0.938","1.232","1.232","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213241","7.241","0.002","9.011","0.002","18.916","0.003","84.25","0.02","87.25","0.02","66.66","0.02","1127.5","0.5","293","2","293","2","","","","","","","","3","P -1","-P 1","2","4-(triphenylmethyl)benzoic acid p-xylene clathrate","","","- C30 H25 O2 -","- C30 H25 O2 -","- C60 H50 O4 -","2","1","","Jetti, Ram K. R.; Xue, Feng; Mak, Thomas C. W.; Nangia, Ashwini","4-Tritylbenzoic acid. A molecular scaffold for wheel-and-axle host‒guest inclusion compounds with a supramolecular axis","Journal of the Chemical Society, Perkin Transactions 2","2000","","6","1223","","10.1039/a909827e","","","0.71073","MoKα","","0.1269","0.0532","","","0.148","0.1716","","","","","","1.051","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213242","7.31","0.001","8.998","0.001","18.464","0.001","89.98","0.01","86.26","0.01","67.5","0.01","1119.2","0.2","293","2","293","2","","","","","","","","3","P -1","-P 1","2","4-(triphenylmethyl)benzoic acid anisole clathrate","","","- C29.5 H24 O2.5 -","- C30.388 H23.388 O2 -","- C60.776 H46.776 O4 -","2","1","","Jetti, Ram K. R.; Xue, Feng; Mak, Thomas C. W.; Nangia, Ashwini","4-Tritylbenzoic acid. A molecular scaffold for wheel-and-axle host‒guest inclusion compounds with a supramolecular axis","Journal of the Chemical Society, Perkin Transactions 2","2000","","6","1223","","10.1039/a909827e","","","0.71073","MoKα","","0.1485","0.0525","","0.1664","0.1311","","","","0.972","1.199","1.199","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213243","7.39","0.001","13.637","0.001","14.349","0.001","75.92","0.01","81.64","0.01","85.16","0.01","1385.9","0.2","293","2","293","2","","","","","","","","3","P -1","-P 1","2","4-(triphenylmethyl)benzoic acid mesitylene clathrate","","","- C35 H32 O2 -","- C35 H32 O2 -","- C70 H64 O4 -","2","1","","Jetti, Ram K. R.; Xue, Feng; Mak, Thomas C. W.; Nangia, Ashwini","4-Tritylbenzoic acid. A molecular scaffold for wheel-and-axle host‒guest inclusion compounds with a supramolecular axis","Journal of the Chemical Society, Perkin Transactions 2","2000","","6","1223","","10.1039/a909827e","","","0.71073","MoKα","","0.1321","0.0493","","0.1585","0.1309","","","","1.013","1.215","1.215","","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213244","7.3066","0.0002","8.9943","0.0002","18.4963","0.0005","89.764","0.001","85.946","0.001","67.868","0.001","1122.82","0.05","294","2","294","2","","","","","","","","4","P -1","-P 1","2","4-(triphenylmethyl)benzoic acid bromobenzene clathrate","","","- C29 H22.5 Br0.5 O2 -","- C28.5 H19 Br0.5 O2 -","- C57 H38 Br O4 -","2","1","","Jetti, Ram K. R.; Xue, Feng; Mak, Thomas C. W.; Nangia, Ashwini","4-Tritylbenzoic acid. A molecular scaffold for wheel-and-axle host‒guest inclusion compounds with a supramolecular axis","Journal of the Chemical Society, Perkin Transactions 2","2000","","6","1223","","10.1039/a909827e","","","0.71073","MoKα","","0.1185","0.0886","","","0.2516","0.2802","","","","","","1.052","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213245","7.34","0.002","8.982","0.002","18.366","0.004","89.33","0.03","86.14","0.03","67.55","0.03","1116.4","0.5","294","2","294","2","","","","","","","","4","P -1","-P 1","2","4-(triphenylmethyl)benzoic acid nitrobenzene clathrate","","","- C29 H22.5 N0.5 O3 -","- C28.5 H20 O2.5 -","- C57 H40 O5 -","2","1","","Jetti, Ram K. R.; Xue, Feng; Mak, Thomas C. W.; Nangia, Ashwini","4-Tritylbenzoic acid. A molecular scaffold for wheel-and-axle host‒guest inclusion compounds with a supramolecular axis","Journal of the Chemical Society, Perkin Transactions 2","2000","","6","1223","","10.1039/a909827e","","","0.71073","MoKα","","0.1446","0.0905","","","0.2718","0.2924","","","","","","1.078","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213246","7.39","0.002","15.477","0.002","33.858","0.002","90","","90","","90","","3872.5","1.2","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","4-(triphenylmethyl)benzoic acid, unsolvated form","","","- C26 H20 O2 -","- C26 H20 O2 -","- C208 H160 O16 -","8","1","","Jetti, Ram K. R.; Xue, Feng; Mak, Thomas C. W.; Nangia, Ashwini","4-Tritylbenzoic acid. A molecular scaffold for wheel-and-axle host‒guest inclusion compounds with a supramolecular axis","Journal of the Chemical Society, Perkin Transactions 2","2000","","6","1223","","10.1039/a909827e","","","0.71073","MoKα","","0.16","0.0494","","0.089","0.0529","","","","","1.37","1.37","","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213247","12.2879","0.0019","13.883","0.003","11.625","0.002","111.965","0.014","106.941","0.015","90.328","0.017","1744.6","0.6","170.2","","170.2","","","","","","","","","4","P -1","-P 1","2","","","","- C19 H26 O2 S -","- C19 H26 O2 S -","- C76 H104 O8 S4 -","4","2","","Yadav, Veejendra K.; Jeyaraj, Duraiswamy A.; Parvez, Masood","The suitability of anion-accelerated oxy-Cope rearrangement as a probe to study π-facial selectivity. An experimental study with (6-methyl-1-oxa-4-thiaspiro[4.5]dec-6-en-7-yl)(allyl)methanols †","Journal of the Chemical Society, Perkin Transactions 1","2000","","9","1423","","10.1039/a909839i","","","0.7107","MoKα","","0.0499","0.0499","","0.0489","0.0489","","","","1.896","1.896","1.896","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213248","10.08","0.002","17.853","0.003","10.185","0.002","90","","107.8","0.1","90","","1745.1","1.1","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","Z-L-(alphaMe)Val-(L-Ala)2-L-(alphaMe)Val-L-Ala-OMe methanol solvate","","- C31 H51 N5 O9 -","- C31 H51 N5 O9 -","- C62 H102 N10 O18 -","2","1","","Lapeña, Yolanda; Lopez, Pilar; Cativiela, Carlos; Kaptein, Bernard; Broxterman, Quirinus B.; Kamphuis, Johan; Mossel, Eric; Peggion, Cristina; Formaggio, Fernando; Crisma, Marco; Toniolo, Claudio","Comparative conformational analysis of peptides based on the two Cα-tetrasubstituted, Cβ-branched, chiral α-amino acids (αMe)Dip and (αMe)Val †","Journal of the Chemical Society, Perkin Transactions 2","2000","","4","631","","10.1039/a909856i","","","1.5418","CuKα","","0.0396","0.0349","","0.1079","0.1057","","","","1.074","1.098","1.098","","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213249","5.4023","0.0001","11.5582","0.0003","12.6662","0.0003","66.521","0.001","79.97","0.001","88.055","0.001","713.77","0.03","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","Disodium salt of5-N-sulfinohydroxylamino-2-pyridinesulfonic acid ?","","- C5 H11.5 N2 Na2 O11 S2 -","- C5 H11 N2 Na2 O11 S2 -","- C10 H22 N4 Na4 O22 S4 -","2","1","","Bakke, Jan M.; Ranes, Eli; Rømming, Christian; Sletvold, Ingrid","The reaction of 3-nitropyridine with sulfite ions; a pathway to 2,5-disubstituted pyridines","Journal of the Chemical Society, Perkin Transactions 1","2000","","8","1241","","10.1039/a909875e","","","0.71073","MoKα","","0.0465","0.0328","","","0.0796","0.0846","","","","","","1.037","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213250","9.824","0.002","13.368","0.002","22.34","0.006","90","","90","","90","","2933.9","1.1","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C23 H43 N O9 Si -","- C23 H43 N O9 Si -","- C92 H172 N4 O36 Si4 -","4","1","","Kocienski, Philip; Narquizian, Robert; Raubo, Piotr; Smith, Christopher; Farrugia, Louis J.; Muir, Kenneth; Boyle, F. Thomas","Synthetic studies on the pederin family of antitumour agents. Syntheses of mycalamide B, theopederin D and pederin","Journal of the Chemical Society, Perkin Transactions 1","2000","","15","2357","","10.1039/a909898d","","","0.71073","MoKα","","0.1277","0.0825","","","0.228","0.2709","","","","","","1.044","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213251","8.5035","0.0005","10.0704","0.0009","17.6777","0.0006","90","","103.768","0.003","90","","1470.31","0.17","291","2","291","2","","","","","","","synthesis as described","5","P 1 21 1","P 2yb","4","","","","- C29 H39 N O7 Se -","- C29 H39 N O7 Se -","- C58 H78 N2 O14 Se2 -","2","1","","Kocienski, Philip; Narquizian, Robert; Raubo, Piotr; Smith, Christopher; Farrugia, Louis J.; Muir, Kenneth; Boyle, F. Thomas","Synthetic studies on the pederin family of antitumour agents. Syntheses of mycalamide B, theopederin D and pederin","Journal of the Chemical Society, Perkin Transactions 1","2000","","15","2357","","10.1039/a909898d","","","0.71073","MoKα","","0.1014","0.0361","","","0.0626","0.0774","","","","","","1.001","","","","has coordinates,has disorder","180463","2020-10-21","18:00:00",""
"7213252","27.739","0.001","24.1268","0.0005","12.294","0.0005","90","","92.051","0.006","90","","8222.5","0.5","173","","173","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C85.5 H108 B F4 N2 Na O8 P2 -","- C85.5 H100 B F4 N2 Na O8 P2 -","- C342 H400 B4 F16 N8 Na4 O32 P8 -","4","1","","Baaden, Marc; Wipff, Georges; Yaftian, Mohamed Reza; Burgard, Michel; Matt, Dominique","Cation coordination by calix[4]arenes bearing amide and/or phosphine oxide pendant groups: how many arms are needed to bind Li+ vs. Na+? A combined NMR and molecular dynamics study","Journal of the Chemical Society, Perkin Transactions 2","2000","","7","1315","","10.1039/b000019l","","","0.71073","Mo-Kα","","0.153","0.058","","1.068","","0.081","","","","","","1.485","","","","has coordinates","287753","2023-11-23","09:34:45",""
"7213253","8.932","0.002","9.67","0.003","10.105","0.002","100.95","0.02","105.61","0.02","106.37","0.02","772.4","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","3,11-dibenzoyl-6,13dimethyl-7,14-dioxo-2,10-diphenyl-1,9-dioxa- 2,6,10,13-tetraazaspiro[4.2.2.4]tetradecane","","- C36 H32 N4 O6 -","- C36 H32 N4 O6 -","- C36 H32 N4 O6 -","1","0.5","","Rigolet, Séverinne; Mélot, Jean Marie; Vébrel, Joel; Chiaroni, Angèle; Riche, Claude","The reaction of α- and ω-methylenelactams with nitrones. Influence of electronic and geometric factors on the stereoselectivity of their 1,3-dipolar cycloaddition","Journal of the Chemical Society, Perkin Transactions 1","2000","","7","1095","","10.1039/b000129p","","","1.5418","CuKα","","0.0722","0.0505","","0.1454","","0.1276","","","1.046","","","1.078","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213254","12.4467","0.0014","11.4978","0.0007","19.0943","0.0018","90","","125.34","0.007","90","","2229.1","0.4","150","","150","","","","","","","","see text","6","P 1 21/c 1","-P 2ybc","14","Bridged (beta-alkoxyalkyl)Co(III)salen","","","- C23 H27 Cl2 Co N2 O4 -","- C23 H27 Cl2 Co N2 O4 -","- C92 H108 Cl8 Co4 N8 O16 -","4","1","","Blaauw, Rolf; Kingma, Irene E.; Laan, Jan H.; van der Baan, Juul L.; Balt, Sijbe; de Bolster, Martinus W. G.; Klumpp, Gerhard W.; Smeets, Wilberth J. J.; Spek, Anthony L.","Bridged (β-alkoxyalkyl)CoIII(salen) complexes by intramolecular alkoxycobaltation of unactivated alkenes: new models for coenzyme B12","Journal of the Chemical Society, Perkin Transactions 1","2000","","8","1199","","10.1039/b000196l","","","0.71073","MoKα","","0.1424","0.0655","","","0.1062","0.1327","","","","","","1.017","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213255","10.114","0.002","4.824","0.001","20.996","0.004","90","","93.6","0.03","90","","1022.4","0.4","150","","150","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H8 F N3 O5 -","- C9 H8 F N3 O5 -","- C36 H32 F4 N12 O20 -","4","1","","O’Hagan, David; Bilton, Clair; Howard, Judith A. K.; Knight, Lee; Tozer, David J.","The preferred conformation of N-β-fluoroethylamides. Observation of the fluorine amide gauche effect","Journal of the Chemical Society, Perkin Transactions 2","2000","","4","605","","10.1039/b000205o","","","0.71073","MoKα","","0.0541","0.0387","","","0.0883","0.0969","","","","","","1.062","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213256","9.9569","0.0003","20.4211","0.0008","4.6421","0.0002","90","","90","","90","","943.88","0.06","150","","150","","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C9 H9 F N2 O3 -","- C9 H9 F N2 O3 -","- C36 H36 F4 N8 O12 -","4","1","","O’Hagan, David; Bilton, Clair; Howard, Judith A. K.; Knight, Lee; Tozer, David J.","The preferred conformation of N-β-fluoroethylamides. Observation of the fluorine amide gauche effect","Journal of the Chemical Society, Perkin Transactions 2","2000","","4","605","","10.1039/b000205o","","","0.71073","MoKα","","0.0799","0.048","","","0.1197","0.1374","","","","","","0.909","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213257","15.857","0.003","17.205","0.002","13.287","0.002","90","","90","","90","","3625","1","296.2","","296.2","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C14 H18 Cl4 O4 -","- C14 H18 Cl4 O4 -","- C112 H144 Cl32 O32 -","8","1","","Ohkita, Masakazu; Sano, Kieko; Dohba, Sotoyuki; Fujita, Yuko; Suzuki, Takanori; Tsuji, Takashi","A 2,3,5,6-tetramethylenebicyclo[2.2.0]hexane derivative: a novel bisdiene molecule that produces a Dewar benzene skeleton upon two successive Diels‒Alder reactions with dienophiles","Journal of the Chemical Society, Perkin Transactions 1","2000","","12","1971","","10.1039/b000569j","","","0.7107","MoKα","","0.043","0.043","","","0.0547","0.0547","","","","","","1.073","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213258","11.419","0.0008","11.0908","0.0005","17.519","0.002","90","","90.025","0.003","90","","2218.7","0.3","203","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C30 H26 O2 -","- C30 H26 O2 -","- C120 H104 O8 -","4","1","","Ohkita, Masakazu; Sano, Kieko; Dohba, Sotoyuki; Fujita, Yuko; Suzuki, Takanori; Tsuji, Takashi","A 2,3,5,6-tetramethylenebicyclo[2.2.0]hexane derivative: a novel bisdiene molecule that produces a Dewar benzene skeleton upon two successive Diels‒Alder reactions with dienophiles","Journal of the Chemical Society, Perkin Transactions 1","2000","","12","1971","","10.1039/b000569j","","","0.7107","MoKα","","","0.0619","","","","0.0769","","","","","","1.925","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213259","20.672","0.002","10.8482","0.0009","8.7192","0.0009","90","","104.683","0.007","90","","1891.5","0.3","293","2","293","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C19 H18 O4 S3 -","- C19 H18 O4 S3 -","- C76 H72 O16 S12 -","4","1","","Di Vitta, Claudio; de Arruda Campos, Ivan P.; Farah, João P. S.; Zukerman-Schpector, Júlio","New reductive addition of hard nucleophiles to 6,7-bis(methylsulfanyl)-1,4-dihydro-1,4-methanonaphthalene-5,8-dione","Journal of the Chemical Society, Perkin Transactions 1","2000","","21","3692","","10.1039/b000575o","","","0.71073","MoKα","","0.1001","0.055","","","0.1261","0.1563","","","","","","1.148","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213260","7.6743","0.0009","24.817","0.004","10.629","0.001","90","","101.216","0.009","90","","1985.7","0.4","293.2","","293.2","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H25 N O2 -","- C24 H25 N O2 -","- C96 H100 N4 O8 -","4","1","","Clayden, Jonathan; Westlund, Neil; Beddoes, Roy L.; Helliwell, Madeleine","Atroposelective attack of nucleophiles and electrophiles on 2-acyl-1-naphthamides and their enolates","Journal of the Chemical Society, Perkin Transactions 1","2000","","9","1351","","10.1039/b000668h","","","0.7107","MoKα","","","0.0508","","","0.0502","","","","","2.574","2.574","","","","","has coordinates","209480","2020-10-21","18:00:00",""
"7213261","12.404","0.001","19.6149","0.0008","16.222","0.002","90","","90","","90","","3946.9","0.6","293.2","","293.2","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C21 H29 N O2 -","- C21 H29 N O2 -","- C168 H232 N8 O16 -","8","1","","Clayden, Jonathan; Westlund, Neil; Beddoes, Roy L.; Helliwell, Madeleine","Atroposelective attack of nucleophiles and electrophiles on 2-acyl-1-naphthamides and their enolates","Journal of the Chemical Society, Perkin Transactions 1","2000","","9","1351","","10.1039/b000668h","","","1.5418","CuKα","","0.0844","0.0569","","0.0468","0.0454","","","","2.669","3.098","3.098","","","","","has coordinates","209478","2020-10-21","18:00:00",""
"7213262","10.1424","0.0014","16.7857","0.0013","10.7011","0.0015","90","","114.446","0.009","90","","1658.5","0.4","123","1","123","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","RWX0225/Wilson/Ref. NW-AO45-1/29-7-96.","","","- C19 H23 N O2 -","- C19 H23 N O2 -","- C76 H92 N4 O8 -","4","1","","Clayden, Jonathan; McCarthy, Catherine; Westlund, Neil; Frampton, Christopher S.","Atroposelective attack of nucleophiles on 2-formyl-1-naphthamides and their derivatives: chelation and non-chelation control","Journal of the Chemical Society, Perkin Transactions 1","2000","","9","1363","","10.1039/b000669f","","","0.71069","MoKα","","0.0562","0.0372","","","0.095","0.1036","","","","","","1.01","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213263","11.4254","0.0004","20.1558","0.0006","16.4936","0.0005","90","","99.506","0.001","90","","3746.1","0.2","123","1","123","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","RWX0441/Wilson/NW-G058/5107/24-4-97.","","","- C21 H27 N O2 -","- C21 H27 N O2 -","- C168 H216 N8 O16 -","8","2","","Clayden, Jonathan; McCarthy, Catherine; Westlund, Neil; Frampton, Christopher S.","Atroposelective attack of nucleophiles on 2-formyl-1-naphthamides and their derivatives: chelation and non-chelation control","Journal of the Chemical Society, Perkin Transactions 1","2000","","9","1363","","10.1039/b000669f","","","0.71073","MoKα","","0.049","0.0383","","","0.1016","0.1078","","","","","","1.007","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213264","16.219","0.003","11.966","0.003","18.823","0.003","90","","90","","90","","3653.1","1.3","123","1","123","1","","","","","","","","4","P b c a","-P 2ac 2ab","61","RWX0315/Wilson/NW-G012/5107/16-7-98.","","","- C20 H28 N2 O -","- C20 H28 N2 O -","- C160 H224 N16 O8 -","8","1","","Clayden, Jonathan; McCarthy, Catherine; Westlund, Neil; Frampton, Christopher S.","Atroposelective attack of nucleophiles on 2-formyl-1-naphthamides and their derivatives: chelation and non-chelation control","Journal of the Chemical Society, Perkin Transactions 1","2000","","9","1363","","10.1039/b000669f","","","0.71073","MoKα","","0.0473","0.0394","","","0.0965","0.1014","","","","","","1","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213265","9.358","0.002","11.813","0.003","9.917","0.003","90","","114.44","0.02","90","","998.1","0.5","123","1","123","1","","","","","","","","4","P 1 21 1","P 2yb","4","RWX0255/Wilson/NW-C083/5107/24-4-97.","","","- C24 H27 N O2 -","- C24 H27 N O2 -","- C48 H54 N2 O4 -","2","1","","Clayden, Jonathan; Westlund, Neil; Frampton, Christopher S.","Atropisomeric diastereoisomers from nucleophilic attack on 8-acyl-1-naphthamides","Journal of the Chemical Society, Perkin Transactions 1","2000","","9","1379","","10.1039/b000670j","","","0.71073","MoKα","","0.0279","0.0274","","","0.0726","0.0734","","","","","","1.004","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213266","6.855","0.001","7.551","0.001","14.622","0.001","80.66","0.01","88.46","0.01","87.17","0.01","745.78","0.16","298","","","","","","","","","","Local laboratory","4","P -1","-P 1","2","","","","- C8 H9 N O2 -","- C8 H9 N O2 -","- C32 H36 N4 O8 -","4","2","","Pizzala, Helene; Carles, Micheline; Stone, William E. E.; Thevand, Andre","Tautomerism in Schiff bases derived from 3-hydroxysalicylaldehyde. Combined X-ray diffraction, solution and solid state NMR study","Journal of the Chemical Society, Perkin Transactions 2","2000","","5","935","","10.1039/b000756k","","","0.71073","MoKα","","0.056","0.042","","0.063","0.063","0.063","","","0.976","1.023","1.023","1.023","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213267","7.005","0.001","7.18","0.001","12.018","0.001","83.21","0.01","79.16","0.01","72.66","0.01","565.44","0.13","298","","","","","","","","","","Local laboratory","4","P -1","-P 1","2","","","","- C13 H10 N2 O4 -","- C13 H10 N2 O4 -","- C26 H20 N4 O8 -","2","1","","Pizzala, Helene; Carles, Micheline; Stone, William E. E.; Thevand, Andre","Tautomerism in Schiff bases derived from 3-hydroxysalicylaldehyde. Combined X-ray diffraction, solution and solid state NMR study","Journal of the Chemical Society, Perkin Transactions 2","2000","","5","935","","10.1039/b000756k","","","0.71073","MoKα","","0.136","0.074","","0.15","0.15","0.15","","","1.266","1.445","1.445","1.445","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213268","10.246","0.001","6.106","0.001","20.863","0.001","90","0.01","90.42","0.01","90","0.01","1305.2","0.3","298","","","","","","","","","","Local laboratory","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H16 N2 O2 -","- C15 H16 N2 O2 -","- C60 H64 N8 O8 -","4","1","","Pizzala, Helene; Carles, Micheline; Stone, William E. E.; Thevand, Andre","Tautomerism in Schiff bases derived from 3-hydroxysalicylaldehyde. Combined X-ray diffraction, solution and solid state NMR study","Journal of the Chemical Society, Perkin Transactions 2","2000","","5","935","","10.1039/b000756k","","","0.71073","MoKα","","0.099","0.048","","0.068","0.068","0.068","","","1.072","1.163","1.163","1.163","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7213269","25.868","0.002","7.826","0.001","18.105","0.002","90","","90","","90","","3665.2","0.7","293","2","293","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C23 H19 N2 O3.5 -","- C23 H19 N2 O3.5 -","- C184 H152 N16 O28 -","8","1","","Kumar, Subodh; Hundal, Geeta; Paul, Dharam; Hundal, Maninder Singh; Singh, Harjit","Heterocalixarenes. Part 4. Synthesis of oxocalix[1]heterocycle[2]arenes: a unique H-bonding network in calix[1]benzimidazol-2-one[2]arene· 1/2 H2O †","Journal of the Chemical Society, Perkin Transactions 1","2000","","14","2295","","10.1039/b000832j","","","0.71073","MoKα","","0.0833","0.0473","","0.2025","0.1327","","","","1.023","1.082","1.082","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213270","12.259","0.002","8.865","0.001","15.943","0.002","90","","110.46","0.01","90","","1623.3","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H16 N2 O4 -","- C20 H16 N2 O4 -","- C80 H64 N8 O16 -","4","1","","Kumar, Subodh; Hundal, Geeta; Paul, Dharam; Hundal, Maninder Singh; Singh, Harjit","Heterocalixarenes. Part 4. Synthesis of oxocalix[1]heterocycle[2]arenes: a unique H-bonding network in calix[1]benzimidazol-2-one[2]arene· 1/2 H2O †","Journal of the Chemical Society, Perkin Transactions 1","2000","","14","2295","","10.1039/b000832j","","","0.71073","MoKα","","0.0639","0.0423","","0.1308","0.1137","","","","1.026","1.084","1.084","","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213271","6.0101","0.0011","11.636","0.002","14.551","0.003","80.22","0.02","81.78","0.02","88.121","0.015","992.5","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C24 H32 Fe O -","- C24 H32 Fe O -","- C48 H64 Fe2 O2 -","2","1","","Carroll, Michael A.; White, Andrew J. P.; Widdowson, David A.; Williams, David J.","Efficient regio- and diastereo-controlled synthesis of 1,1′- and 1,1′,2,2′-functionalised ferrocenes and the formation of 2-oxa[3]ferrocenophanes","Journal of the Chemical Society, Perkin Transactions 1","2000","","10","1551","","10.1039/b000833h","","","1.54178","CuKα","","0.0511","0.038","","0.0905","0.0848","","","","1.018","1.054","1.054","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213272","5.864","0.002","28.331","0.011","12.241","0.003","90","","98.36","0.03","90","","2012","1.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H32 Fe O -","- C24 H32 Fe O -","- C96 H128 Fe4 O4 -","4","1","","Carroll, Michael A.; White, Andrew J. P.; Widdowson, David A.; Williams, David J.","Efficient regio- and diastereo-controlled synthesis of 1,1′- and 1,1′,2,2′-functionalised ferrocenes and the formation of 2-oxa[3]ferrocenophanes","Journal of the Chemical Society, Perkin Transactions 1","2000","","10","1551","","10.1039/b000833h","","","1.54178","CuKα","","0.1332","0.0737","","0.1832","0.1434","","","","1.086","1.195","1.195","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213273","23.1803","0.0015","10.1436","0.0003","14.6585","0.0007","90","","90","","90","","3446.7","0.3","293","2","293","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C26 H34 Ca Cl2 N6 O16 -","- C26 H34 Ca Cl2 N6 O16 -","- C104 H136 Ca4 Cl8 N24 O64 -","4","1","","Szumna, Agnieszka; Gryko, Daniel T.; Jurczak, Janusz","Calcium complexes of macrocyclic lactams: their structure and calcium induced conformational changes","Journal of the Chemical Society, Perkin Transactions 2","2000","","7","1553","","10.1039/b000966k","","","1.54178","CuKα","","0.0859","0.0743","","","0.173","0.1971","","","","","","1.17","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213274","22.3915","0.0007","22.3915","0.0007","10.4686","0.0005","90","","90","","120","","4545.5","0.3","173","2","173","2","","","","","","","","3","P -3","-P 3","147","","","","- C34 H46 O3 -","- C34 H46 O3 -","- C204 H276 O18 -","6","1","","Dinger, Maarten B.; Scott, Michael J.","Hydroxy-substituted triarylcarbenium bromides. Synthesis, structure, derivatization and facile conversion to highly substituted xanthenes †","Journal of the Chemical Society, Perkin Transactions 1","2000","","11","1741","","10.1039/b001032o","","","0.71073","MoKα","","0.0853","0.048","","","0.1111","0.1325","","","","","","1.019","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213275","19.0851","0.0011","19.4641","0.0011","9.5618","0.0005","90","","90","","90","","3552","0.3","173","2","173","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C35 H46 Br Cl3 O3 -","- C34 H45 Br O3 -","- C136 H180 Br4 O12 -","4","1","","Dinger, Maarten B.; Scott, Michael J.","Hydroxy-substituted triarylcarbenium bromides. Synthesis, structure, derivatization and facile conversion to highly substituted xanthenes †","Journal of the Chemical Society, Perkin Transactions 1","2000","","11","1741","","10.1039/b001032o","","","0.71073","MoKα","","0.0877","0.0778","","","0.1973","0.2042","","","","","","1.114","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213276","9.3103","0.0005","12.5249","0.0007","28.9201","0.0018","90","","90","","90","","3372.4","0.3","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C35 H45 Br Cl2 O2 -","- C34 H43 Br O2 -","- C136 H172 Br4 O8 -","4","1","","Dinger, Maarten B.; Scott, Michael J.","Hydroxy-substituted triarylcarbenium bromides. Synthesis, structure, derivatization and facile conversion to highly substituted xanthenes †","Journal of the Chemical Society, Perkin Transactions 1","2000","","11","1741","","10.1039/b001032o","","","0.71073","MoKα","","0.0577","0.0471","","","0.1054","0.1109","","","","","","1.059","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213277","10.2038","0.0006","13.5294","0.0008","14.9405","0.0009","96.034","0.001","94.077","0.001","110.752","0.001","1905","0.2","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C40 H58 O6 -","- C40 H58 O6 -","- C80 H116 O12 -","2","1","","Dinger, Maarten B.; Scott, Michael J.","Hydroxy-substituted triarylcarbenium bromides. Synthesis, structure, derivatization and facile conversion to highly substituted xanthenes †","Journal of the Chemical Society, Perkin Transactions 1","2000","","11","1741","","10.1039/b001032o","","","0.71073","MoKα","","0.0939","0.0676","","","0.1667","0.1911","","","","","","1.054","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213278","11.1823","0.0006","12.6574","0.0007","12.8089","0.0007","103.779","0.001","108.435","0.001","111.672","0.001","1463.07","0.14","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C34 H44 O3 -","- C34 H44 O3 -","- C68 H88 O6 -","2","1","","Dinger, Maarten B.; Scott, Michael J.","Hydroxy-substituted triarylcarbenium bromides. Synthesis, structure, derivatization and facile conversion to highly substituted xanthenes †","Journal of the Chemical Society, Perkin Transactions 1","2000","","11","1741","","10.1039/b001032o","","","0.71073","MoKα","","0.0556","0.0487","","","0.1296","0.1378","","","","","","1.034","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213279","20.9835","0.0014","10.8817","0.0007","27.2374","0.0017","90","","98.486","0.002","90","","6151.2","0.7","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C62.67 H100.33 Li3 O7.67 -","- C62.68 H100.36 Li3 O7.67 -","- C250.72 H401.44 Li12 O30.68 -","4","1","","Dinger, Maarten B.; Scott, Michael J.","Hydroxy-substituted triarylcarbenium bromides. Synthesis, structure, derivatization and facile conversion to highly substituted xanthenes †","Journal of the Chemical Society, Perkin Transactions 1","2000","","11","1741","","10.1039/b001032o","","","0.71073","MoKα","","0.2321","0.0882","","","0.1949","0.2676","","","","","","0.973","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213280","11.9562","0.0018","12.7398","0.0017","13.4304","0.0018","97.043","0.005","90.828","0.004","105.813","0.003","1951","0.5","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C42.4 H54.8 O3.8 -","- C40 H50 O3 -","- C80 H100 O6 -","2","1","","Dinger, Maarten B.; Scott, Michael J.","Hydroxy-substituted triarylcarbenium bromides. Synthesis, structure, derivatization and facile conversion to highly substituted xanthenes †","Journal of the Chemical Society, Perkin Transactions 1","2000","","11","1741","","10.1039/b001032o","","","0.71073","MoKα","","0.1241","0.0738","","","0.1752","0.2028","","","","","","0.998","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213281","7.8726","0.0005","5.358","0.0004","18.8596","0.0006","90","","93.633","0.004","90","","793.93","0.08","100","3","100","3","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","exo-exo-1,4:5,8-diepoxy-1,23,4a,5,8,8a-octahydronaphthalene","","- C10 H12 O2 -","- C10 H12 O2 -","- C40 H48 O8 -","4","1","","Eckert-Maksić, Mirjana; Novak-Doumbouya, Nana; Kiralj, Rudolf; Kojić-Prodić, Biserka","7-Oxanorbornene cycloadducts. X-Ray, molecular orbital and photoelectron spectroscopic study †","Journal of the Chemical Society, Perkin Transactions 2","2000","","7","1483","","10.1039/b001267j","","","1.54184","CuKα","","0.0785","0.0486","","","0.1215","0.1297","","","","","","0.948","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213282","6.517","0.007","18.98","0.01","6.754","0.008","90","","107.16","0.06","90","","798.2","1.4","100","3","100","3","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","endo-exo-1,4:5,8-diepoxy-1,23,4a,5,8,8a-octahydronaphthalene","","- C10 H12 O2 -","- C10 H12 O2 -","- C40 H48 O8 -","4","1","","Eckert-Maksić, Mirjana; Novak-Doumbouya, Nana; Kiralj, Rudolf; Kojić-Prodić, Biserka","7-Oxanorbornene cycloadducts. X-Ray, molecular orbital and photoelectron spectroscopic study †","Journal of the Chemical Society, Perkin Transactions 2","2000","","7","1483","","10.1039/b001267j","","","0.71073","MoKα","","0.1324","0.0611","","","0.148","0.1884","","","","","","1.129","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213283","25.133","0.007","6.757","0.002","11.032","0.004","90","","105.44","0.02","90","","1805.9","1","120","2","120","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1,2,3,4,7-pentafluorotricyclo[3.3.1.0^2,7^]non-3-eno-8,8-diol hemihydrate","","- C9 H8 F5 O2.5 -","- C9 H8 F5 O2.5 -","- C72 H64 F40 O20 -","8","1","","Batsanov, Andrei S.; Brooke, Gerald M.; Holling, Darren; Kenwright, Alan M.","Pyrolysis reactions of nonafluorobiphenyl-4-yl prop-2-enyl ether: a remarkable rearrangement reaction of an intramolecular Diels‒Alder product","Journal of the Chemical Society, Perkin Transactions 1","2000","","11","1731","","10.1039/b001356k","","","0.71073","MoKα","","0.045","0.0338","","","0.083","0.0883","","","","","","1.029","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213284","10.047","0.0011","13.6137","0.0012","18.555","0.002","97.04","0.008","104.117","0.009","106.888","0.008","2303.4","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H25 O4 P -","- C26 H25 O4 P -","- C104 H100 O16 P4 -","4","2","","Schobert, Rainer; Siegfried, Sven; Nieuwenhuyzen, Mark; Milius, Wolfgang; Hampel, Frank","Selective C-acylation of CH-active dicarbonyl compounds with ketenylidenetriphenylphosphorane: syntheses and structures of 3-phosphoranylideneacyltetronic acids, 3-phosphoranylideneacyl-4-oxocoumarins, and 4-phosphoranylideneacylpyrazol-5-ones","Journal of the Chemical Society, Perkin Transactions 1","2000","","11","1723","","10.1039/b001541p","","","0.71073","MoKα","","0.083","0.0576","","","0.1504","0.1719","","","","","","0.954","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213285","25.351","0.003","12.9583","0.0012","16.409","0.002","90","","103.679","0.008","90","","5237.6","1","153","2","153","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C31 H30 O4 P -","- C31 H30 O4 P -","- C248 H240 O32 P8 -","8","1","","Schobert, Rainer; Siegfried, Sven; Nieuwenhuyzen, Mark; Milius, Wolfgang; Hampel, Frank","Selective C-acylation of CH-active dicarbonyl compounds with ketenylidenetriphenylphosphorane: syntheses and structures of 3-phosphoranylideneacyltetronic acids, 3-phosphoranylideneacyl-4-oxocoumarins, and 4-phosphoranylideneacylpyrazol-5-ones","Journal of the Chemical Society, Perkin Transactions 1","2000","","11","1723","","10.1039/b001541p","","","0.71073","MoKα","","0.1227","0.0611","","0.131","0.1073","","","","1.029","1.105","1.105","","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213286","8.938","0.002","22.265","0.005","11.629","0.002","90","","95.56","0.03","90","","2303.3","0.8","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C29 H21 O4 P -","- C29 H21 O4 P -","- C116 H84 O16 P4 -","4","1","","Schobert, Rainer; Siegfried, Sven; Nieuwenhuyzen, Mark; Milius, Wolfgang; Hampel, Frank","Selective C-acylation of CH-active dicarbonyl compounds with ketenylidenetriphenylphosphorane: syntheses and structures of 3-phosphoranylideneacyltetronic acids, 3-phosphoranylideneacyl-4-oxocoumarins, and 4-phosphoranylideneacylpyrazol-5-ones","Journal of the Chemical Society, Perkin Transactions 1","2000","","11","1723","","10.1039/b001541p","","","0.71073","MoKα","","0.0857","0.0469","","0.1303","0.1086","","","","1.053","1.084","1.084","","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213287","9.263","0.001","11.217","0.001","11.839","0.001","77.81","0.01","89.5","0.01","82.39","0.01","1191.5","0.2","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H25 N2 O4 P -","- C27 H25 N2 O4 P -","- C54 H50 N4 O8 P2 -","2","1","","Schobert, Rainer; Siegfried, Sven; Nieuwenhuyzen, Mark; Milius, Wolfgang; Hampel, Frank","Selective C-acylation of CH-active dicarbonyl compounds with ketenylidenetriphenylphosphorane: syntheses and structures of 3-phosphoranylideneacyltetronic acids, 3-phosphoranylideneacyl-4-oxocoumarins, and 4-phosphoranylideneacylpyrazol-5-ones","Journal of the Chemical Society, Perkin Transactions 1","2000","","11","1723","","10.1039/b001541p","","","0.71073","MoKα","","0.0605","0.0393","","0.0932","0.0835","","","","1.036","1.078","1.078","","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213288","7.341","0.004","13.56","0.007","7.471","0.004","90","","118.44","0.01","90","","653.9","0.6","119","1","119","1","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C8 Cl6 O2 S2 -","- C8 Cl6 O2 S2 -","- C16 Cl12 O4 S4 -","2","0.5","","Skramstad, Jan; Lunde, Andreas; Hope, Håkon; Bjørnstad, Vidar; Frøyen, Paul","Chlorinated thiophenes. Part 2. Trihalogenated hydroxythiophenes; preparation, reactions and tautomeric properties","Journal of the Chemical Society, Perkin Transactions 2","2000","","7","1453","","10.1039/b001570i","","","1.54178","CuKα","","0.0612","0.0551","","0.1743","0.1653","","","","1.061","1.075","1.075","","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213289","22.465","0.004","8.017","0.002","21.376","0.004","90","","100.1","0.1","90","","3790.2","1.8","298","","298","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","N,N-Dimethyl-diindole[3,2-a;2,3-c]N-methylcarbazole","","- C27 H21 N3 -","- C27 H21 N3 -","- C216 H168 N24 -","8","1","","Greci, Lucedio; Tommasi, Giampaolo; Petrucci, Rita; Marrosu, Giancarlo; Trazza, Antonio; Sgarabotto, Paolo; Righi, Lara; Alberti, Angelo","Oxidative trimerization of indole: on the formation of dications and radical cations by reaction of indole and nitrosobenzene in the presence of acids","Journal of the Chemical Society, Perkin Transactions 2","2000","","11","2337","","10.1039/b001609h","","","1.54178","X","","","0.049","","","","0.054","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213290","8.914","0.006","10.407","0.007","13.607","0.009","90","","95.68","0.05","90","","1256.1","1.5","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","7-endo-phenyl-1,2,3,4,6-pentafluoro-4-chloro- -bicyclo[4.1.0]hept-2-ene-5-one","","- C13 H6 Cl F5 O -","- C13 H6 Cl F5 O -","- C52 H24 Cl4 F20 O4 -","4","1","","Kovtonyuk, Vladimir N.; Kobrina, Ljubov S.; Gatilov, Yurij V.; Bagryanskaya, Irina Yu.; Fröhlich, Roland; Haufe, Günter","Reactions of polyfluorinated cyclohexadienones with diazoalkanes. Part 1. Formation of cyclopropanes from polyfluorinated cyclohexa-2,4-dienones with diazomethane and phenyldiazomethane","Journal of the Chemical Society, Perkin Transactions 1","2000","","12","1929","","10.1039/b001618g","","","1.54178","CuKα","","0.1177","0.0608","","","0.1399","0.1733","","","","","","1.018","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213291","11.205","0.001","13.755","0.001","7.725","0.001","90","","91.28","0.01","90","","1190.3","0.2","198","2","198","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H6 Cl F5 O -","- C13 H6 Cl F5 O -","- C52 H24 Cl4 F20 O4 -","4","1","","Kovtonyuk, Vladimir N.; Kobrina, Ljubov S.; Gatilov, Yurij V.; Bagryanskaya, Irina Yu.; Fröhlich, Roland; Haufe, Günter","Reactions of polyfluorinated cyclohexadienones with diazoalkanes. Part 1. Formation of cyclopropanes from polyfluorinated cyclohexa-2,4-dienones with diazomethane and phenyldiazomethane","Journal of the Chemical Society, Perkin Transactions 1","2000","","12","1929","","10.1039/b001618g","","","0.71073","MoKα","","0.0603","0.0411","","","0.0939","0.1047","","","","","","1.037","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213292","9.6167","0.0004","14.6927","0.0006","16.5683","0.0007","90","","94.11","0.001","90","","2335","0.17","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","00023","","","- C9 H15 N6 O2 -","- C9 H15 N6 O2 -","- C72 H120 N48 O16 -","8","2","","Daro, Nathalie; Sutter, Jean-Pascal; Pink, Maren; Kahn, (the late) Olivier","Concomitant ferro- and antiferromagnetic interactions in an H-bonded molecular ribbon duplex","Journal of the Chemical Society, Perkin Transactions 2","2000","","6","1087","","10.1039/b001684p","","","0.71073","MoKα","","0.093","0.0625","","","0.1225","0.1327","","","","","","1.065","","","","has coordinates","198632","2020-10-21","18:00:00",""
"7213293","7.776","0.004","5.832","0.003","14.092","0.008","90","","97.65","0.05","90","","633.4","0.6","160","2","160","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C14 H14 N2 O2 -","- C14 H14 N2 O2 -","- C28 H28 N4 O4 -","2","1","","Bhat, J. Ishwara; Clegg, William; Maskill, Howard; Elsegood, Mark R. J.; Menneer, Iain D.; Miatt, Peter C.","N-Nitroso-N,O-dialkylhydroxylamines: preparation, structure, and mechanism of the hydronium ion catalysed solvolytic nitrous oxide extrusion reaction","Journal of the Chemical Society, Perkin Transactions 2","2000","","7","1435","","10.1039/b001688h","","","0.71073","MoKα","","0.0588","0.0523","","","0.1111","0.1158","","","","","","1.298","","","","has coordinates,has disorder","180463","2020-10-21","18:00:00",""
"7213294","23.4127","0.0009","7.1091","0.0002","14.806","0.0006","90","","108.146","0.003","90","","2341.8","0.15","293","2","293","2","","","","","","","","5","C 1 2 1","C 2y","5","","Cephradine/quinoline complex","","- C41 H59 N7 O15 S2 -","- C41 H57 N7 O15 S2 -","- C82 H114 N14 O30 S4 -","2","0.5","","Kemperman, Gerardus J.; de Gelder, Rene; Dommerholt, Frederik J.; Raemakers-Franken, Petronella C.; Klunder, Antonius J. H.; Zwanenburg, Binne","Induced fit phenomena in clathrate structures of cephalosporins","Journal of the Chemical Society, Perkin Transactions 2","2000","","7","1425","","10.1039/b001692f","","","1.54184","CuKα","","0.0332","0.0329","","0.092","0.0915","0.092","","","1.061","","","1.061","","","","has coordinates,has disorder","180463","2020-10-21","18:00:00",""
"7213295","23.471","0.002","7.1215","0.001","14.9304","0.0019","90","","108.268","0.014","90","","2369.8","0.5","293","2","293","2","","","","","","","","5","C 1 2 1","C 2y","5","","Cephradine/alpha-naphthol complex","","- C42 H58 N6 O15 S2 -","- C42 H46 N6 O15 S2 -","- C84 H92 N12 O30 S4 -","2","0.5","","Kemperman, Gerardus J.; de Gelder, Rene; Dommerholt, Frederik J.; Raemakers-Franken, Petronella C.; Klunder, Antonius J. H.; Zwanenburg, Binne","Induced fit phenomena in clathrate structures of cephalosporins","Journal of the Chemical Society, Perkin Transactions 2","2000","","7","1425","","10.1039/b001692f","","","1.54184","CuKα","","0.1431","0.0756","","0.2188","0.1792","0.2188","","","1.034","","","1.034","","","","has coordinates,has disorder","180463","2020-10-21","18:00:00",""
"7213296","23.0227","0.0008","7.1467","0.0004","14.5544","0.0004","90","","104.644","0.003","90","","2316.94","0.17","173","2","173","2","","","","","","","","5","C 1 2 1","C 2y","5","","Cephradine/2,2'-bipyridyl complex","","- C42 H60 N8 O15 S2 -","- C42 H46 N8 O15 S2 -","- C84 H92 N16 O30 S4 -","2","0.5","","Kemperman, Gerardus J.; de Gelder, Rene; Dommerholt, Frederik J.; Raemakers-Franken, Petronella C.; Klunder, Antonius J. H.; Zwanenburg, Binne","Induced fit phenomena in clathrate structures of cephalosporins","Journal of the Chemical Society, Perkin Transactions 2","2000","","7","1425","","10.1039/b001692f","","","1.54184","CuKα","","0.0398","0.037","","0.1036","0.1005","0.1036","","","1.095","","","1.095","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213297","23.4584","0.0006","7.1179","0.0002","14.8922","0.0005","90","","108.571","0.002","90","","2357.14","0.12","293","2","293","2","","","","","","","","5","C 1 2 1","C 2y","5","","Cephradine/naphthalene complex","","- C42 H58 N6 O14.5 S2 -","- C42 H46 N6 O14.5 S2 -","- C84 H92 N12 O29 S4 -","2","0.5","","Kemperman, Gerardus J.; de Gelder, Rene; Dommerholt, Frederik J.; Raemakers-Franken, Petronella C.; Klunder, Antonius J. H.; Zwanenburg, Binne","Induced fit phenomena in clathrate structures of cephalosporins","Journal of the Chemical Society, Perkin Transactions 2","2000","","7","1425","","10.1039/b001692f","","","1.54184","CuKα","","0.0493","0.0435","","0.1389","0.1229","0.1389","","","1.149","","","1.149","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213298","23.3855","0.0005","7.1965","0.0003","14.7588","0.0004","90","","108.58","0.003","90","","2354.36","0.13","293","2","293","2","","","","","","","","5","C 1 2 1","C 2y","5","","Cephradine/2-acetonaphthone complex","","- C44 H57 N6 O13.5 S2 -","- C44 H48 N6 O13.5 S2 -","- C88 H96 N12 O27 S4 -","2","0.5","","Kemperman, Gerardus J.; de Gelder, Rene; Dommerholt, Frederik J.; Raemakers-Franken, Petronella C.; Klunder, Antonius J. H.; Zwanenburg, Binne","Induced fit phenomena in clathrate structures of cephalosporins","Journal of the Chemical Society, Perkin Transactions 2","2000","","7","1425","","10.1039/b001692f","","","1.54184","CuKα","","0.0339","0.0329","","0.0914","0.0899","0.0914","","","1.029","","","1.029","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7213299","7.0902","0.0007","21.273","0.003","31.004","0.004","90","","90","","90","","4676.3","1","208","2","208","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Cefadroxil/2,7-dihydroxynaphthalene","","- C42 H56 N6 O19 S2 -","- C42 H42 N6 O19 S2 -","- C168 H168 N24 O76 S8 -","4","1","","Kemperman, Gerardus J.; de Gelder, Rene; Dommerholt, Frederik J.; Raemakers-Franken, Petronella C.; Klunder, Antonius J. H.; Zwanenburg, Binne","Induced fit phenomena in clathrate structures of cephalosporins","Journal of the Chemical Society, Perkin Transactions 2","2000","","7","1425","","10.1039/b001692f","","","1.54184","CuKα","","0.1394","0.1085","","0.3064","0.2737","0.3064","","","1.092","","","1.092","","","","has coordinates","180463","2020-10-21","18:00:00",""
"7213300","7.1079","0.0018","21.863","0.005","32.306","0.004","90","","90","","90","","5020.4","1.8","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Cefadroxil/2,6-dihydroxynaphthalene","","- C42 H60 N6 O21 S2 -","- C42 H42 N6 O21 S2 -","- C168 H168 N24 O84 S8 -","4","1","","Kemperman, Gerardus J.; de Gelder, Rene; Dommerholt, Frederik J.; Raemakers-Franken, Petronella C.; Klunder, Antonius J. H.; Zwanenburg, Binne","Induced fit phenomena in clathrate structures of cephalosporins","Journal of the Chemical Society, Perkin Transactions 2","2000","","7","1425","","10.1039/b001692f","","","1.54184","CuKα","","0.1557","0.0771","","0.2369","0.1898","0.2369","","","1.046","","","1.046","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213301","10.04","0.001","12.331","0.001","12.675","0.001","90","","99.651","0.007","90","","1547","0.2","200","","","","","","","","","","Local laboratory","4","P 1 21/n 1","-P 2yn","14","","","","- C19 H20 N2 O2 -","- C19 H20 N2 O2 -","- C76 H80 N8 O8 -","4","1","","Banwell, Martin; Edwards, Alison; Smith, Jason; Hamel, Ernest; Verdier-Pinard, Pascal","Convergent synthesis and preliminary biological evaluation of (±)-B-norrhazinal †","Journal of the Chemical Society, Perkin Transactions 1","2000","","10","1497","","10.1039/b001731k","","","0.71073","MoKα","","0.117","0.048","","0.064","0.05","0.051","","","1.393","1.15","1.15","1.15","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213302","12.6541","0.0002","12.6541","0.0002","9.2145","0.0002","90","","90","","90","","1475.48","0.05","150","2","150","2","","","","","","","","4","P 42","P 4c","77","","","","- C13 H22 N2 O4 -","- C13 H22 N2 O4 -","- C52 H88 N8 O16 -","4","1","","Hammer, Kristin; Wang, Jing; Falck-Pedersen, Mette Lene; Rømming, Christian; Undheim, Kjell","Stereoselectivity in the synthesis of conformationally constrained vicinally dihydroxylated cyclic α-amino acids","Journal of the Chemical Society, Perkin Transactions 1","2000","","11","1691","","10.1039/b001779p","","","0.71073","MoKα","","0.0581","0.0494","","","0.1155","0.1212","","","","","","1.071","","","","has coordinates,has disorder","180464","2020-10-21","18:00:00",""
"7213303","9.7253","0.0002","8.7384","0.0002","10.9031","0.0002","90","","109.013","0.001","90","","876.03","0.03","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C16 H28 N2 O4 -","- C16 H28 N2 O4 -","- C32 H56 N4 O8 -","2","1","","Hammer, Kristin; Wang, Jing; Falck-Pedersen, Mette Lene; Rømming, Christian; Undheim, Kjell","Stereoselectivity in the synthesis of conformationally constrained vicinally dihydroxylated cyclic α-amino acids","Journal of the Chemical Society, Perkin Transactions 1","2000","","11","1691","","10.1039/b001779p","","","0.71073","MoKα","","0.0659","0.06","","","0.1684","0.1777","","","","","","1.084","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213304","7.176","0.001","17.805","0.004","20.947","0.004","90","","90","","90","","2676.4","0.9","150","2","150","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C16 H16 N2 O3 -","- C16 H16 N2 O3 -","- C128 H128 N16 O24 -","8","1","","Jones, Raymond C. F.; Dimopoulos, Paschalis; Coles, Simon C.; Light, Mark E.; Hursthouse, Michael B.","Synthesis of imidazo[1,2-a]pyridines from unactivated 2-alkyl-4,5-dihydroimidazoles through conjugate N-addition","Journal of the Chemical Society, Perkin Transactions 1","2000","","15","2331","","10.1039/b001830i","","","0.71073","MoKα","","0.1387","0.0576","","","0.1218","0.1595","","","","","","0.815","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213305","8.831","0.002","11.534","0.002","13.182","0.003","90.34","0.03","92.49","0.03","90.79","0.03","1341.3","0.5","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C17 H18 N2 O -","- C17 H18 N2 O -","- C68 H72 N8 O4 -","4","2","","Jones, Raymond C. F.; Dimopoulos, Paschalis; Coles, Simon C.; Light, Mark E.; Hursthouse, Michael B.","Synthesis of imidazo[1,2-a]pyridines from unactivated 2-alkyl-4,5-dihydroimidazoles through conjugate N-addition","Journal of the Chemical Society, Perkin Transactions 1","2000","","15","2331","","10.1039/b001830i","","","0.71073","MoKα","","0.0906","0.0661","","","0.1715","0.1873","","","","","","1.213","","","","has coordinates,has disorder","198632","2020-10-21","18:00:00",""
"7213306","11.0117","0.0005","10.6661","0.0008","12.2753","0.0009","65.331","0.003","65.329","0.004","62.908","0.003","1119.42","0.13","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C25 H28 N2 O4 -","- C25 H28 N2 O4 -","- C50 H56 N4 O8 -","2","1","","Jones, Raymond C. F.; Dimopoulos, Paschalis; Coles, Simon C.; Light, Mark E.; Hursthouse, Michael B.","Synthesis of imidazo[1,2-a]pyridines from unactivated 2-alkyl-4,5-dihydroimidazoles through conjugate N-addition","Journal of the Chemical Society, Perkin Transactions 1","2000","","15","2331","","10.1039/b001830i","","","0.71073","MoKα","","0.1396","0.0558","","","0.1103","0.1373","","","","","","0.931","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213307","13.724","0.003","14.03","0.004","17.657","0.005","90","","110.19","0.02","90","","3190.9","1.5","293","2","173","2","","","","","","","commercial (Fluka Chemical)","5","P 1 21 1","P 2yb","4","vinblastine sulfate","","","- C46 H58 N4 O32 S -","- C46 H58 N4 O32 S -","- C92 H116 N8 O64 S2 -","2","1","","Bau, Robert; Jin, Kevin Kai","Crystal structure of vinblastine","Journal of the Chemical Society, Perkin Transactions 1","2000","","13","2079","","10.1039/b001855o","","","0.70926","MoKα","","0.0615","0.0534","","0.1515","0.1425","","","","0.584","0.606","0.606","","","","","has coordinates,has disorder","180464","2020-10-21","18:00:00",""
"7213308","8.781","0.004","8.807","0.004","21.478","0.014","79.22","0.04","79.78","0.04","73.48","0.03","1550.6","1.5","193","2","193","2","","","","","","","","3","P -1","-P 1","2","","Bis (benzo-15-crown-5) 1,3,5,7 octatetrayne","","- C36 H38 O10 -","- C36 H38 O10 -","- C72 H76 O20 -","2","1","","Lee, Liang-Hui; Lynch, Vincent; Lagow, Richard J.","The synthesis and structural characterization of the first bis(benzocrown ethers) with polyyne linkages †","Journal of the Chemical Society, Perkin Transactions 1","2000","","16","2805","","10.1039/b001856m","","","0.71073","MoKα","","0.2412","0.0933","","0.2061","0.1473","","","","1.025","1.282","1.282","","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213309","13.344","0.001","5.1406","0.0005","21.862","0.003","90","","100.95","0.01","90","","1472.3","0.3","198","2","198","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Bis (benzo-15-crown-5) 1,3 butadiyne","","- C32 H38 O10 -","- C32 H38 O10 -","- C64 H76 O20 -","2","0.5","","Lee, Liang-Hui; Lynch, Vincent; Lagow, Richard J.","The synthesis and structural characterization of the first bis(benzocrown ethers) with polyyne linkages †","Journal of the Chemical Society, Perkin Transactions 1","2000","","16","2805","","10.1039/b001856m","","","0.71073","MoKα","","0.2049","0.1143","","0.2671","0.2226","","","","1.276","1.62","1.62","","","","","has coordinates,has disorder","180464","2020-10-21","18:00:00",""
"7213310","9.4387","0.0011","18.424","0.002","19.358","0.002","90","","90","","90","","3366.3","0.6","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C30 H27 N3 O12 P4 -","- C30 H27 N3 O12 P4 -","- C120 H108 N12 O48 P16 -","4","1","","Wang, Wenhu; Cao, Ruzhen; Liu, Lunzu","The synthesis of novel trisphosphoranylphosphine and its oxide","Journal of the Chemical Society, Perkin Transactions 1","2000","","11","1673","","10.1039/b001917h","","","0.71073","MoKα","","0.0627","0.0598","","","0.0758","0.1036","","","","","","0.817","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213311","5.4491","0.0011","8.7088","0.0015","14.951","0.003","90","","94.31","0.03","90","","707.5","0.2","180","2","180","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C17 H17 N O2 S -","- C17 H17 N O2 S -","- C34 H34 N2 O4 S2 -","2","1","","Ali, Akbar; Uddin Ahmad, Viqar; Leistner, Joachim; Liebscher, Jürgen","Optically active 1,5-benzothiazepin-4-ones by ring transformation of 5-ylidene-1,3-dioxan-4-ones with 2-aminothiophenol","Journal of the Chemical Society, Perkin Transactions 1","2000","","12","1897","","10.1039/b001928n","","","0.71073","MoKα","","0.0353","0.0328","","","0.0793","0.0804","","","","","","1.009","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213312","8.5736","0.0015","12.007","0.003","12.669","0.002","90","","90","","90","","1304.2","0.4","180","2","180","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C13 H17 N O2 S -","- C13 H17 N O2 S -","- C52 H68 N4 O8 S4 -","4","1","","Ali, Akbar; Uddin Ahmad, Viqar; Leistner, Joachim; Liebscher, Jürgen","Optically active 1,5-benzothiazepin-4-ones by ring transformation of 5-ylidene-1,3-dioxan-4-ones with 2-aminothiophenol","Journal of the Chemical Society, Perkin Transactions 1","2000","","12","1897","","10.1039/b001928n","","","0.71073","MoKα","","0.027","0.0238","","","0.0537","0.0546","","","","","","1.021","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213313","5.5486","0.0001","17.8452","0.0008","19.0424","0.0008","90","","91.93","0.003","90","","1884.43","0.12","173","","173","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C22 H24 O3 -","- C22 H24 O3 -","- C88 H96 O12 -","4","1","","Avery, Thomas D.; Greatrex, Ben W.; Taylor, Dennis K.; Tiekink, Edward R. T.","Exploitation of ylide steric bulk to alter cyclopropanation outcome during the reaction of 1,2-dioxines and stabilised phosphorus ylides","Journal of the Chemical Society, Perkin Transactions 1","2000","","9","1319","","10.1039/b001975p","","","0.7107","MoKα","","","0.073","","","","0.047","","","","","","2.54","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213314","7.5297","0.0003","22.131","0.003","9.9543","0.0006","90","","105.622","0.002","90","","1597.5","0.2","290","","290","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Quadricyclaue with carboxamide-TEMPO","","- C17 H25 N2 O2 -","- C17 H25 N2 O2 -","- C68 H100 N8 O8 -","4","1","","Nakatsuji, Shin’ichi; Ogawa, Yuya; Takeuchi, Soichi; Akutsu, Hiroki; Yamada, Jun-ichi; Naito, Akira; Sudo, Kyoko; Yasuoka, Noritake","Novel photo-responsive organic spin systems: preparation and properties of norbornadienes and spiropyrans with TEMPO radical substituents","Journal of the Chemical Society, Perkin Transactions 2","2000","","9","1969","","10.1039/b001993n","","","0.7107","MoKα","","0.0889","0.0889","","","0.1641","0.1641","","","","","","1.826","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213315","7.347","0.001","7.874","0.001","12.715","0.001","71.339","0.005","78.603","0.008","81.054","0.005","679.77","0.14","296","2","296","1","","","","","","","","3","P -1","-P 1","2","","(3SR,4SR,5SR,6RS,7RS)-2,4,6-trimethyl-nonane-3,5,7-triol","","- C12 H26 O3 -","- C12 H26 O3 -","- C24 H52 O6 -","2","1","","Delas, Christophe; Blacque, Olivier; Moïse, Claude","Study of a tandem aldol‒Tischtschenko reaction between chiral enolsilanes and aldehydes catalyzed by titanium(IV) isopropoxide","Journal of the Chemical Society, Perkin Transactions 1","2000","","14","2265","","10.1039/b002008g","","","0.71073","MoKα","","0.0664","0.0453","","","0.1235","0.1371","","","","","","1.041","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213316","9.6044","0.0008","12.3674","0.0013","11.9674","0.0006","90","","106.324","0.005","90","","1364.2","0.2","293","2","296","1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(3SR,4SR,5RS,6RS,7RS)-2,4,6-trimethyl-nonane-3,5,7-triol","","- C12 H26 O3 -","- C12 H26 O3 -","- C48 H104 O12 -","4","1","","Delas, Christophe; Blacque, Olivier; Moïse, Claude","Study of a tandem aldol‒Tischtschenko reaction between chiral enolsilanes and aldehydes catalyzed by titanium(IV) isopropoxide","Journal of the Chemical Society, Perkin Transactions 1","2000","","14","2265","","10.1039/b002008g","","","0.71073","MoKα","","0.1156","0.0477","","","0.1173","0.1433","","","","","","1.004","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213317","12.504","0.011","11.299","0.01","19.8","0.02","90","","113.3","0.1","90","","2569","5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","13,16‒dibenzyl‒2,6‒dioxa‒10,19‒dithia‒13,16‒diazatricyclo [16.3.0^7,11^]heneicosa‒1^18^,20,7^11^,8‒tetraene","","- C29 H32 N2 O2 S2 -","- C29 H32 N2 O2 S2 -","- C116 H128 N8 O8 S8 -","4","1","","Halfpenny, Joan; Sloman, Zachary S.","An effective self-templating ring closure method for mixed donor thiophene-based macrocycles","Journal of the Chemical Society, Perkin Transactions 1","2000","","12","1877","","10.1039/b002029j","","","0.71069","MoKα","","0.0741","0.0609","","","0.1415","0.1498","","","","","","1.14","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213318","11.432","0.008","24.74","0.012","7.678","0.004","90","","92.45","0.05","90","","2170","2","220","2","220","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C19.5 H18 Cl Fe N O9 -","- C19.5 H18 Cl Fe N O9 -","- C78 H72 Cl4 Fe4 N4 O36 -","4","1","","Ley, Steven V.; Wright, Edward A.","1,7-Asymmetric induction of chirality in a Mukaiyama aldol reaction using π-allyltricarbonyliron lactone complexes: highly diastereoselective synthesis of α-substituted β-hydroxy carbonyl compounds","Journal of the Chemical Society, Perkin Transactions 1","2000","","11","1677","","10.1039/b002056g","","","0.71073","MoKα","","0.0808","0.0547","","0.1356","0.1235","","","","0.982","1.102","1.102","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7213319","9.527","0.002","12.367","0.005","18.594","0.007","90","0.03","90","0.03","90","0.02","2190.8","1.3","293","2","293","2","","","","","","","","3","P 21 a b","P -2b 2a","29","","","","- C28 H25 N3 -","- C28 H25 N3 -","- C112 H100 N12 -","4","1","","Mahato, Shashi B.; Garai, Subhadra; Weber, Manuela; Luger, Peter","Synthesis of novel 1-methylindole trimer and tetramer under Friedel‒Crafts reaction conditions and determination of their structures by X-ray crystallography","Journal of the Chemical Society, Perkin Transactions 1","2000","","16","2767","","10.1039/b002074p","","","1.5418","CuKα","","0.0781","0.0459","","","0.1079","0.1226","","","","","","1.074","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213320","10.595","0.005","11.125","0.004","13.02","0.001","78.57","0.06","68.32","0.06","86.25","0.03","1397.8","1.1","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C36 H30 N4 -","- C36 H30 N4 -","- C72 H60 N8 -","2","1","","Mahato, Shashi B.; Garai, Subhadra; Weber, Manuela; Luger, Peter","Synthesis of novel 1-methylindole trimer and tetramer under Friedel‒Crafts reaction conditions and determination of their structures by X-ray crystallography","Journal of the Chemical Society, Perkin Transactions 1","2000","","16","2767","","10.1039/b002074p","","","1.5418","CuKα","","0.1588","0.0592","","","0.1297","0.163","","","","","","1.028","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213321","6.667","0.002","7.607","0.003","10.567","0.004","73.34","0.03","86.35","0.03","75.58","0.03","497.2","0.3","123","","123","","","","","","","","","3","P -1","-P 1","2","","","","- C11 H10 O4 -","- C11 H10 O4 -","- C22 H20 O8 -","2","1","","Canali, Laetitia; Cowan, Elaine; Deleuze, Hervé; Gibson, Colin L.; Sherrington, David C.","Polystyrene and polymethacrylate resin-supported Jacobsen’s alkene epoxidation catalyst","Journal of the Chemical Society, Perkin Transactions 1","2000","","13","2055","","10.1039/b002118k","","","0.71069","MoKalpha","","0.044","0.0333","","0.0517","0.0501","","","","","1.908","1.908","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213322","28.728","0.02","9.713","0.001","16.997","0.001","90","","105.95","0.02","90","","4560","3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2-(N,N-Dimethylaminophenyl)dimesitylboran","","- C26 H32 B N -","- C26 H32 B N -","- C208 H256 B8 N8 -","8","1","","Albrecht, Karsten; Kaiser, Volker; Boese, Roland; Adams, Jörg; Kaufmann, Dieter E.","Synthesis and properties of fluorescent organoboranes: triarylmethane-type dyes","Journal of the Chemical Society, Perkin Transactions 2","2000","","10","2153","","10.1039/b002184i","","","0.71073","MOKα","","0.1844","0.0744","","0.2454","0.2004","","","","1.196","1.613","1.613","","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213323","6.804","0.003","11.122","0.002","15.139","0.002","70.85","0.02","86.12","0.03","79.57","0.03","1064.3","0.6","295","","295","","","","","","","","laboratory synthesis, crystallized from hexane","4","P -1","-P 1","2","","anti-[2-(3-methoxythienyl)]di(1-adamantyl)methanol","","- C26 H36 O2 S -","- C26 H36 O2 S -","- C52 H72 O4 S2 -","2","1","","Lomas, John S.; Vauthier, Edouard; Vaissermann, Jacqueline","Trifluoroacetylation and ionic hydrogenation of [2-(3-alkoxythienyl)]di(1-adamantyl)methanols †","Journal of the Chemical Society, Perkin Transactions 2","2000","","7","1399","","10.1039/b002186p","","","0.71069","MoKα","","","0.0429","","","0.0525","","","","","1.0703","1.0703","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7213324","14.34","0.001","11.781","0.001","22.032","0.001","90","","90","","90","","3722.1","0.4","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C12 H24 F6 N4 S2 -","- C12 H24 F6 N4 S2 -","- C96 H192 F48 N32 S16 -","8","1","","Kolomeitsev, Alexander; Médebielle, Maurice; Kirsch, Peer; Lork, Enno; Röschenthaler, Gerd-Volker","Synthesis, structure and reactivity of a trifluoromethyl sulfide anionic salt stabilized with tetrakis(dimethylamino)ethylene dication (TDAE2+)","Journal of the Chemical Society, Perkin Transactions 1","2000","","14","2183","","10.1039/b002252g","","","0.71073","MoKα","","0.0592","0.0416","","","0.0854","0.0933","","","","","","1.039","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213325","22.179","0.002","10.9087","0.0008","10.7255","0.0009","90","","103.857","0.011","90","","2519.4","0.4","193","2","193","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C24 H35 N3 O6 -","- C24 H35 N3 O6 -","- C96 H140 N12 O24 -","4","1","","Maison, Wolfgang; Lützen, Arne; Kosten, Marc; Schlemminger, Imre; Westerhoff, Ole; Saak, Wolfgang; Martens, Jürgen","Multicomponent synthesis of tripeptides containing pipecolic acid derivatives: selective induction of cis- and trans-imide bonds into peptide backbones","Journal of the Chemical Society, Perkin Transactions 1","2000","","12","1867","","10.1039/b002258f","","","0.71073","MoKα","","0.0512","0.0345","","","0.0748","0.0804","","","","","","0.922","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213326","7.1046","0.0007","7.2949","0.0005","13.3142","0.0014","90","","93.036","0.012","90","","689.07","0.11","213","2","213","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C15 H19 N O3 -","- C15 H19 N O3 -","- C30 H38 N2 O6 -","2","1","","Maison, Wolfgang; Lützen, Arne; Kosten, Marc; Schlemminger, Imre; Westerhoff, Ole; Saak, Wolfgang; Martens, Jürgen","Multicomponent synthesis of tripeptides containing pipecolic acid derivatives: selective induction of cis- and trans-imide bonds into peptide backbones","Journal of the Chemical Society, Perkin Transactions 1","2000","","12","1867","","10.1039/b002258f","","","0.71073","MoKα","","0.0348","0.0319","","","0.0837","0.0855","","","","","","1.04","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213327","11.1496","0.0007","8.7609","0.0006","18.84","0.0012","90","","105.449","0.007","90","","1773.8","0.2","193","2","193","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H23 N O3 -","- C21 H23 N O3 -","- C84 H92 N4 O12 -","4","1","","Maison, Wolfgang; Lützen, Arne; Kosten, Marc; Schlemminger, Imre; Westerhoff, Ole; Saak, Wolfgang; Martens, Jürgen","Multicomponent synthesis of tripeptides containing pipecolic acid derivatives: selective induction of cis- and trans-imide bonds into peptide backbones","Journal of the Chemical Society, Perkin Transactions 1","2000","","12","1867","","10.1039/b002258f","","","0.71073","MoKα","","0.0572","0.0391","","","0.098","0.1063","","","","","","0.942","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213328","13.806","0.003","14.761","0.003","9.618","0.0019","90","","92.77","0.03","90","","1957.8","0.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H20 Cl2 F N O -","- C21 H20 Cl2 F N O -","- C84 H80 Cl8 F4 N4 O4 -","4","1","","Ooms, Frédéric; Delvosal, Sébastien; Wouters, Johan; Durant, François; Dockendolf, Gisella; Van’t Land, Clinton; Glass, Thomas; Castagnoli, Jr, Neal; Van der Schyf, Cornelis J.","Empirical and molecular modeling study of the pyridinium species RHPP+, an abundant and potentially neurotoxic metabolite of haloperidol","Journal of the Chemical Society, Perkin Transactions 2","2000","","9","1781","","10.1039/b002357o","","","1.54178","CuKα","","","0.0957","","","0.2537","","","","","","","0.971","","","","has coordinates","206958","2020-10-21","18:00:00",""
"7213329","25.7135","0.0004","9.5232","0.0001","19.8894","0.0003","90","","105.57","","90","","4691.68","0.11","120","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","5,17-Bis((E)-(2-phenyl-1-ethenyl)-11,23-dibromo- 25,26,27,28-tetrapropoxycalix[4]arene","","- C56 H58 Br2 O4 -","- C56 H58 Br2 O4 -","- C224 H232 Br8 O16 -","4","0.5","","Krebs, Frederik C.; Jørgensen, Mikkel","Calix[4]arene-5,17-dicarboxylic acids and their interactions with aliphatic amines. Part 2. A crystal engineering approach","Journal of the Chemical Society, Perkin Transactions 2","2000","","9","1935","","10.1039/b002409k","","","0.71073","MoKα","","0.0343","0.0277","","","0.0722","0.0749","","","","","","1.025","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213330","13.062","0.003","13.325","0.003","20.365","0.004","96.75","0.03","93.04","0.03","110.93","0.03","3270.4","1.4","120","2","293","2","","","","","","","","4","P -1","-P 1","2","","11,23-bis((E)-(2-phenyl-1-ethenyl)- 25,26,27,28-tetrapropoxycalix[4]arene-5,17- dicarboxylic acid bis- 1,4-diaza[2,2,2]bicyclooctane salt","","- C72 H87 N5 O8 -","- C72 H87 N5 O8 -","- C144 H174 N10 O16 -","2","1","","Krebs, Frederik C.; Jørgensen, Mikkel","Calix[4]arene-5,17-dicarboxylic acids and their interactions with aliphatic amines. Part 2. A crystal engineering approach","Journal of the Chemical Society, Perkin Transactions 2","2000","","9","1935","","10.1039/b002409k","","","0.71073","MoKα","","0.4304","0.1352","","","0.3159","0.4616","","","","","","0.906","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213331","10.754","0.002","12.014","0.002","21.851","0.004","100.97","0.03","96.83","0.03","110.11","0.03","2550","1.1","120","2","293","2","","","","","","","","4","P -1","-P 1","2","","25,26,27,28-tetrapropoxy- calix[4]arene-5,17-dicarboxylic acid 1,4-diaza[2,2,2]bicyclooctane salt","","- C54 H69 N5 O8 -","- C54 H69 N5 O8 -","- C108 H138 N10 O16 -","2","1","","Krebs, Frederik C.; Jørgensen, Mikkel","Calix[4]arene-5,17-dicarboxylic acids and their interactions with aliphatic amines. Part 2. A crystal engineering approach","Journal of the Chemical Society, Perkin Transactions 2","2000","","9","1935","","10.1039/b002409k","","","0.71073","MoKα","","0.2264","0.0796","","","0.1507","0.211","","","","","","0.963","","","","has coordinates,has disorder","180464","2020-10-21","18:00:00",""
"7213332","24.817","0.005","25.026","0.005","17.854","0.004","90","","99.88","0.03","90","","10924","4","120","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","11,23-dibromo- 25,26,27,28-tetrapropoxycalix[4]arene- 5,17-dicarboxylic acid bis-benzylamine salt","","- C57 H66 Br2 Cl2 N2 O8 -","- C57 H66 Br2 Cl2 N2 O8 -","- C456 H528 Br16 Cl16 N16 O64 -","8","1","","Krebs, Frederik C.; Jørgensen, Mikkel","Calix[4]arene-5,17-dicarboxylic acids and their interactions with aliphatic amines. Part 2. A crystal engineering approach","Journal of the Chemical Society, Perkin Transactions 2","2000","","9","1935","","10.1039/b002409k","","","0.71073","MoKα","","0.1613","0.0814","","","0.165","0.2043","","","","","","1.024","","","","has coordinates,has disorder","180464","2020-10-21","18:00:00",""
"7213333","17.865","0.003","17.865","0.003","17.263","0.004","90","","90","","90","","5509.6","1.8","120","2","293","2","","","","","","","","6","P 43 21 2","P 4nw 2abw","96","","11,23-dibromo- 25,26,27,28-tetrapropoxycalix[4]arene- 5,17-dicarboxylic acid bis-diethylamine salt","","- C53 H73 Br2 Cl2 N3 O8 -","- C53.02 H73.02 Br2 Cl1.976 N3.012 O8 -","- C212.08 H292.08 Br8 Cl7.904 N12.048 O32 -","4","0.5","","Krebs, Frederik C.; Jørgensen, Mikkel","Calix[4]arene-5,17-dicarboxylic acids and their interactions with aliphatic amines. Part 2. A crystal engineering approach","Journal of the Chemical Society, Perkin Transactions 2","2000","","9","1935","","10.1039/b002409k","","","0.71073","MoKα","","0.0507","0.0426","","","0.1276","0.135","","","","","","1.074","","","","has coordinates,has disorder","180464","2020-10-21","18:00:00",""
"7213334","17.394","0.006","23.82","0.006","27.882","0.007","90","","90","","90","","11552","6","120","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","11,23-dibromo- 25,26,27,28-tetrapropoxycalix[4]arene- 5,17-dicarboxylic acid- bis-diethylamine salt","","- C51.5 H70.5 Br2 Cl N2.5 O8 -","- C51.4 H69.4 Br2 Cl1.2 N2.4 O8 -","- C411.2 H555.2 Br16 Cl9.6 N19.2 O64 -","8","1","","Krebs, Frederik C.; Jørgensen, Mikkel","Calix[4]arene-5,17-dicarboxylic acids and their interactions with aliphatic amines. Part 2. A crystal engineering approach","Journal of the Chemical Society, Perkin Transactions 2","2000","","9","1935","","10.1039/b002409k","","","0.71073","MoKα","","0.3482","0.1662","","","0.3302","0.424","","","","","","1.04","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7213335","12.505","0.003","24.822","0.005","12.722","0.003","90","","94.8","0.03","90","","3935","1.6","120","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","11,23-dibromo- 25,26,27,28-tetrapropoxycalix[4]arene- 5,17-dicarboxylic acid","","- C42 H46 Br2 O8 -","- C42 H46 Br2 O8 -","- C168 H184 Br8 O32 -","4","1","","Krebs, Frederik C.; Jørgensen, Mikkel","Calix[4]arene-5,17-dicarboxylic acids and their interactions with aliphatic amines. Part 2. A crystal engineering approach","Journal of the Chemical Society, Perkin Transactions 2","2000","","9","1935","","10.1039/b002409k","","","0.71073","MoKα","","0.0691","0.047","","","0.104","0.1157","","","","","","1.018","","","","has coordinates,has disorder","180464","2020-10-21","18:00:00",""
"7213336","22.391","0.005","13.024","0.003","33.539","0.007","90","","97.64","0.03","90","","9694","4","120","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","11,23-Bis((E)-(phenylazo)- 25,26,27,28-tetrapropoxycalix[4]arene- 5,17-dicarboxylic acid","","- C54 H56 N4 O8 -","- C54 H56 N4 O8 -","- C432 H448 N32 O64 -","8","2","","Krebs, Frederik C.; Jørgensen, Mikkel","Calix[4]arene-5,17-dicarboxylic acids and their interactions with aliphatic amines. Part 2. A crystal engineering approach","Journal of the Chemical Society, Perkin Transactions 2","2000","","9","1935","","10.1039/b002409k","","","0.71073","MoKα","","0.4386","0.1481","","","0.2584","0.3724","","","","","","1.064","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213337","7.9732","0.0007","10.1799","0.0012","15.57","0.002","90","","90","","90","","1263.8","0.2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C13 H16 N O3 -","- C13 H16 N O3 -","- C52 H64 N4 O12 -","4","1","","Bottle, Steven E.; Gillies, Duncan G.; Hughes, David L.; Micallef, Aaron S.; Smirnov, Alex I.; Sutcliffe, Leslie H.","Synthesis, single crystal X-ray structure and W-band (95 GHz) EPR spectroscopy of a new anionic isoindoline aminoxyl: synthesis and characterisation of some derivatives","Journal of the Chemical Society, Perkin Transactions 2","2000","","7","1285","","10.1039/b002497j","","","0.71069","Mo-Kα","","0.037","0.0326","","0.0828","0.0791","","","","1.066","1.096","1.096","","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213338","8.4008","0.0005","9.9077","0.0006","11.8739","0.0008","90","","97.278","0.004","90","","980.33","0.11","200","","","","","","","","","","Local laboratory","5","P 1 21 1","P 2yb","4","","","","- C19 H30 Br N O2 -","- C19 H30 Br N O2 -","- C38 H60 Br2 N2 O4 -","2","1","","Banwell, Martin; Edwards, Alison; Harvey, Joanne; Hockless, David; Willis, Anthony","π-Allyl cation cyclisations initiated by silver(I)-promoted electrocyclic ring opening of ring-fused gem-dibromocyclopropanes possessing tethered nucleophiles: the influence of chiral auxiliaries on the diastereoselectivity of cyclisations involving meso-substrates","Journal of the Chemical Society, Perkin Transactions 1","2000","","14","2175","","10.1039/b002525i","","","0.71073","MoKα","","0.062","0.042","","0.064","0.045","0.063","","","1.179","1.129","1.129","1.129","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213339","9.591","0.002","12.8947","0.0009","14.871","0.002","90","","90","","90","","1839.1","0.5","193.2","","193.2","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H24 Br N O2 -","- C20 H24 Br N O2 -","- C80 H96 Br4 N4 O8 -","4","1","","Banwell, Martin; Edwards, Alison; Harvey, Joanne; Hockless, David; Willis, Anthony","π-Allyl cation cyclisations initiated by silver(I)-promoted electrocyclic ring opening of ring-fused gem-dibromocyclopropanes possessing tethered nucleophiles: the influence of chiral auxiliaries on the diastereoselectivity of cyclisations involving meso-substrates","Journal of the Chemical Society, Perkin Transactions 1","2000","","14","2175","","10.1039/b002525i","","","1.5418","CuKα","","0.0205","0.0198","","0.0266","","0.0264","","","1.163","","","1.166","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213340","7.08","0.003","9.637","0.001","29.064","0.002","90","","90","","90","","1983","0.9","193.2","","193.2","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C18 H29 Br2 N O2 -","- C18 H29 Br2 N O2 -","- C72 H116 Br8 N4 O8 -","4","1","","Banwell, Martin; Edwards, Alison; Harvey, Joanne; Hockless, David; Willis, Anthony","π-Allyl cation cyclisations initiated by silver(I)-promoted electrocyclic ring opening of ring-fused gem-dibromocyclopropanes possessing tethered nucleophiles: the influence of chiral auxiliaries on the diastereoselectivity of cyclisations involving meso-substrates","Journal of the Chemical Society, Perkin Transactions 1","2000","","14","2175","","10.1039/b002525i","","","1.5418","CuKα","","0.036","0.0326","","0.0416","","0.0412","","","2.48","","","2.562","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213341","17.444","0.006","7.241","0.001","13.329","0.005","90","","111.55","0.01","90","","1565.9","0.8","294","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H29 N O3 -","- C16 H29 N O3 -","- C64 H116 N4 O12 -","4","1","","Djaidi, Djamal; Leung, Ivy S. H.; Bishop, Roger; Craig, Donald C.; Scudder, Marcia L.","Ritter reactions. Part 14. Rearrangement of 3,3,7,7-tetramethyl-6-methylidenebicyclo[3.3.1]nonan-2-one","Journal of the Chemical Society, Perkin Transactions 1","2000","","13","2037","","10.1039/b002544p","","","1.54184","CuKα","","","0.042","","","","0.061","","","","","","1.5","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213342","13.73","0.005","11.477","0.004","9.621","0.004","90","","96.43","0.02","90","","1506.5","1","294","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H27 N O2 -","- C16 H27 N O2 -","- C64 H108 N4 O8 -","4","1","","Djaidi, Djamal; Leung, Ivy S. H.; Bishop, Roger; Craig, Donald C.; Scudder, Marcia L.","Ritter reactions. Part 14. Rearrangement of 3,3,7,7-tetramethyl-6-methylidenebicyclo[3.3.1]nonan-2-one","Journal of the Chemical Society, Perkin Transactions 1","2000","","13","2037","","10.1039/b002544p","","","1.54184","CuKα","","","0.065","","","","0.104","","","","","","1.81","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213343","16.222","0.007","11.361","0.003","9.661","0.004","90","","113.08","0.02","90","","1638","1.1","294","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C18 H30 N2 O2 -","- C18 H34 N2 O2 -","- C72 H136 N8 O8 -","4","0.5","","Djaidi, Djamal; Leung, Ivy S. H.; Bishop, Roger; Craig, Donald C.; Scudder, Marcia L.","Ritter reactions. Part 14. Rearrangement of 3,3,7,7-tetramethyl-6-methylidenebicyclo[3.3.1]nonan-2-one","Journal of the Chemical Society, Perkin Transactions 1","2000","","13","2037","","10.1039/b002544p","","","1.54184","CuKα","","","0.042","","","","0.061","","","","","","2.04","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213344","8.4512","0.0019","10.55","0.004","19.373","0.004","90","","93.569","0.018","90","","1723.9","0.8","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H22 I N O2 S -","- C16 H18.99 I N O2 S -","- C64 H75.96 I4 N4 O8 S4 -","4","1","","Murphy, John A.; Scott, Karen A.; Sinclair, Rhona S.; Martin, Concepcion Gonzalez; Kennedy, Alan R.; Lewis, Norman","A radical based addition‒elimination route for the preparation of indoles","Journal of the Chemical Society, Perkin Transactions 1","2000","","15","2395","","10.1039/b002565h","","","0.71069","MoKα","","0.1195","0.0412","","","0.0981","0.1186","","","","","","0.985","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213345","10.51","0.002","13.225","0.003","22.293","0.005","88.29","0.03","89.88","0.03","72.94","0.03","2960.9","1.2","293","2","293","2","","","","","","","","3","P -1","-P 1","2","1,4-(bis 1,4-dithiafulven-6-yl)benzene cyclophane","","","- C28 H36 S6 -","- C28 H36 S6 -","- C112 H144 S24 -","4","2","","Lorcy, Dominique; Guérin, David; Boubekeur, Kamal; Carlier, Roger; Hascoat, Philippe; Tallec, André; Robert, Albert","Electrochemical oxidative coupling of 1,4-bis(1,4-dithiafulven-6-yl)benzene cyclophanes","Journal of the Chemical Society, Perkin Transactions 1","2000","","16","2719","","10.1039/b002596h","","","0.71073","MoKα","","0.143","0.0532","","","0.1056","0.1232","","","","","","0.829","","","","has coordinates,has disorder","180464","2020-10-21","18:00:00",""
"7213346","7.5078","0.0006","10.7748","0.0009","11.3584","0.0009","89.381","0.002","72.055","0.002","79.252","0.002","857.73","0.12","123","2","123","2","","","","","","","chemical synthesis","6","P -1","-P 1","2","","Nitrozonium hexafluorophosphate/p-nitrosoanisol/toluene molecular complex 1:1:1","","- C14 H15 F6 N2 O3 P -","- C14 H15 F6 N2 O3 P -","- C28 H30 F12 N4 O6 P2 -","2","1","","Lindeman, Sergey V.; Bosch, Eric; Kochi, Jay K.","Electrophilic aromatic nitrosation. Isolation and X-ray crystallography of the metastable NO+ complex with nitrosoarene","Journal of the Chemical Society, Perkin Transactions 2","2000","","9","1919","","10.1039/b002686g","","","0.71073","MoKα","","0.1354","0.0772","","0.1728","0.139","","","","1.11","1.205","1.205","","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213347","11.952","0.002","13.551","0.002","17.076","0.003","90","","90","","90","","2765.7","0.8","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C22 H33 Br O12 -","- C22 H33 Br O12 -","- C88 H132 Br4 O48 -","4","1","","Idris, M. Sum; Larsen, David S.; Pritchard, Robin G.; Schofield, Anthony; Stoodley, Richard J.; Tiffin, Peter D.","Regio- and stereo-selective bromo(alkoxylation)s of (E )-α-(2,3,4,6-tetra-O-acetyl-β-D-glucopyranosyloxymethylene) carbonyl compounds. A route to near-stereopure α-bromo α-dioxymethyl carbonyl compounds †","Journal of the Chemical Society, Perkin Transactions 1","2000","","14","2195","","10.1039/b002749i","","","0.71069","MoKα","","0.1175","0.0731","","","0.1346","0.1438","","","","","","1.346","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213348","8.567","0.003","12.272","0.014","16.895","0.003","90","","90","","90","","1776","2","150","2","150","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C21 H30 O4 -","- C21 H30 O4 -","- C84 H120 O16 -","4","1","","Boehm, Haydn M.; Handa, Sandeep; Pattenden, Gerald; Roberts, Lee; Blake, Alexander J.; Li, Wan-Sheung","Cascade radical cyclisations leading to steroid ring constructions. Regio- and stereo-chemical studies using ester- and fluoro-alkene substituted polyene acyl radical intermediates","Journal of the Chemical Society, Perkin Transactions 1","2000","","20","3522","","10.1039/b002999h","","","0.71073","MoKα","","0.131","0.035","","","0.0582","0.0821","","","","","","0.406","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213349","16.12","0.009","11.511","0.009","11.189","0.008","90","","96.329","0.01","90","","2064","2","293","2","293","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C21 H27 N O3 -","- C21 H27 N O3 -","- C84 H108 N4 O12 -","4","1","","Currie, Gordon S.; Drew, Michael G. B.; Harwood, Laurence M.; Hughes, David J.; Luke, Richard W. A.; Vickers, Richard J.","Chirally templated boronic acid Mannich reaction in the synthesis of optically active α-amino acids","Journal of the Chemical Society, Perkin Transactions 1","2000","","17","2982","","10.1039/b003067h","","","0.7107","MoKα","","0.0762","0.0612","","","0.1629","0.1734","","","","","","1.064","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213350","17.527","0.002","15.29","0.002","6.912","0.001","90","","90","","90","","1852.3","0.4","293","","293","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","D-PGd-CS","D-phenylglycine(1S)-(+)-camphor-10-sulfonate","","- C18 H25 N O6 S -","- C18 H25 N O6 S -","- C72 H100 N4 O24 S4 -","4","1","","Yoshioka, Ryuzo; Hiramatsu, Hajime; Okamura, Kimio; Tsujioka, Ikuko; Yamada, Shin-ichi","Crystal structure‒solubility relationships in optical resolution by diastereomeric salt formation of DL-phenylglycine with (1S )-(+)-camphor-10-sulfonic acid","Journal of the Chemical Society, Perkin Transactions 2","2000","","10","2121","","10.1039/b003068f","","","1.54178","CuKα","","0.0576","0.0545","","","0.1517","0.1551","","","","","","1.023","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213351","24.943","0.001","7.053","0.002","11.366","0.004","90","","103.39","0.03","90","","1945.2","0.9","293","","293","","","","","","","","","5","C 1 2 1","C 2y","5","L-PGd-CS","L-phenylglycine(1S)-(+)-camphor-10-sulfonate","","- C18 H25 N O6 S -","- C18 H25 N O6 S -","- C72 H100 N4 O24 S4 -","4","1","","Yoshioka, Ryuzo; Hiramatsu, Hajime; Okamura, Kimio; Tsujioka, Ikuko; Yamada, Shin-ichi","Crystal structure‒solubility relationships in optical resolution by diastereomeric salt formation of DL-phenylglycine with (1S )-(+)-camphor-10-sulfonic acid","Journal of the Chemical Society, Perkin Transactions 2","2000","","10","2121","","10.1039/b003068f","","","1.54178","CuKα","","0.0641","0.0603","","","0.151","0.1537","","","","","","1.001","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213352","7.261","0.001","22.781","0.002","5.438","0.001","90","","90","","90","","899.5","0.2","293","","293","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","L-PGHCl","L-enylglycine hydrochloride","","- C8 H10 Cl N O2 -","- C8 H10 Cl N O2 -","- C32 H40 Cl4 N4 O8 -","4","1","","Yoshioka, Ryuzo; Hiramatsu, Hajime; Okamura, Kimio; Tsujioka, Ikuko; Yamada, Shin-ichi","Crystal structure‒solubility relationships in optical resolution by diastereomeric salt formation of DL-phenylglycine with (1S )-(+)-camphor-10-sulfonic acid","Journal of the Chemical Society, Perkin Transactions 2","2000","","10","2121","","10.1039/b003068f","","","1.54178","CuKα","","0.027","0.0266","","","0.1022","0.103","","","","","","0.989","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213353","7.389","0.002","10.165","0.002","12.128","0.003","109.6","0.01","107.55","0.02","94.24","0.02","802.5","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H16 N2 O4 S2 -","- C14 H16 N2 O4 S2 -","- C28 H32 N4 O8 S4 -","2","1","","Jeon, Moon-Kook; Kim, Kyongtae","Reactions of 5-(4-chloro-5H-1,2,3-dithiazol-5-ylidene)-2,2-dimethyl-1,3-dioxane-4,6-dione with primary and secondary alkylamines †","Journal of the Chemical Society, Perkin Transactions 1","2000","","18","3107","","10.1039/b003109g","","","0.71073","MoKα","","0.0587","0.055","","","0.1496","0.1528","","","","","","1.123","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213354","7.517","0.002","19.328","0.002","7.974","0.001","90","0.01","107.39","0.02","90","0.01","1105.6","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H10 N2 O3 S2 -","- C9 H10 N2 O3 S2 -","- C36 H40 N8 O12 S8 -","4","1","","Jeon, Moon-Kook; Kim, Kyongtae","Reactions of 5-(4-chloro-5H-1,2,3-dithiazol-5-ylidene)-2,2-dimethyl-1,3-dioxane-4,6-dione with primary and secondary alkylamines †","Journal of the Chemical Society, Perkin Transactions 1","2000","","18","3107","","10.1039/b003109g","","","0.71073","MoKα","","0.0413","0.0391","","","0.0907","0.0926","","","","","","1.124","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213355","10.571","0.0002","19.569","0.0008","13.084","0.0005","90","","101.141","0.002","90","","2655.6","0.16","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C38 H68 Li3 N3 O20 P6 -","- C38 H68 Li3 N3 O20 P6 -","- C76 H136 Li6 N6 O40 P12 -","2","1","","Iorga, Bogdan; Ricard, Louis; Savignac, Philippe","Carbanionic displacement reactions at phosphorus. Part III. Cyanomethylphosphonate vs. cyanomethylenediphosphonate. Synthesis and solid-state structures","Journal of the Chemical Society, Perkin Transactions 1","2000","","19","3311","","10.1039/b003371p","","","0.7107","MoKα","","0.0513","0.0408","","","0.11","0.1158","","","","","","1.032","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213356","10.508","0.0005","16.398","0.0007","19.333","0.0008","90","0.003","100.048","0.002","90","0.002","3280.2","0.3","293","1","293","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H21 N O6 P2 -","- C12 H21 N O6 P2 -","- C96 H168 N8 O48 P16 -","8","2","","Iorga, Bogdan; Ricard, Louis; Savignac, Philippe","Carbanionic displacement reactions at phosphorus. Part III. Cyanomethylphosphonate vs. cyanomethylenediphosphonate. Synthesis and solid-state structures","Journal of the Chemical Society, Perkin Transactions 1","2000","","19","3311","","10.1039/b003371p","","","0.7107","MoKα","","0.1316","0.0537","","","0.1065","0.1398","","","","","","1.022","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213357","14.474","0.0009","9.472","0.0006","10.552","0.0005","90","","103.753","0.004","90","","1405.18","0.14","293","1","293","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H16 N O3 P -","- C13 H16 N O3 P -","- C52 H64 N4 O12 P4 -","4","1","","Iorga, Bogdan; Ricard, Louis; Savignac, Philippe","Carbanionic displacement reactions at phosphorus. Part III. Cyanomethylphosphonate vs. cyanomethylenediphosphonate. Synthesis and solid-state structures","Journal of the Chemical Society, Perkin Transactions 1","2000","","19","3311","","10.1039/b003371p","","","0.7107","MoKα","","0.0946","0.0599","","","0.2265","0.2486","","","","","","0.982","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213358","15.9253","0.0004","15.9655","0.0004","17.882","0.0003","90","","90","","90","","4546.59","0.18","113","2","113","2","","","","","","","","3","P c c n","-P 2ab 2ac","56","","Tetra-(4-chlorophenyl)ethene (3)","","- C26 H16 Cl4 -","- C26 H16 Cl4 -","- C208 H128 Cl32 -","8","1","","Tanaka, Koichi; Fujimoto, Daisuke; Altreuther, A.; Oeser, Thomas; Irngartinger, Hermann; Toda, Fumio","Chiral inclusion crystallization of achiral tetrakis( p-halophenyl)ethylenes with achiral guest compounds","Journal of the Chemical Society, Perkin Transactions 2","2000","","10","2115","","10.1039/b003473h","","","0.71073","MoKα","","0.141","0.046","","","0.089","0.11","","","","","","0.95","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213359","9.648","0.001","16.605","0.007","15.81","0.006","90","","97.61","0.02","90","","2510.5","1.5","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Tetra-(4-jodophenyl)ethene (5)","","- C26 H16 I4 -","- C26 H16 I4 -","- C104 H64 I16 -","4","1","","Tanaka, Koichi; Fujimoto, Daisuke; Altreuther, A.; Oeser, Thomas; Irngartinger, Hermann; Toda, Fumio","Chiral inclusion crystallization of achiral tetrakis( p-halophenyl)ethylenes with achiral guest compounds","Journal of the Chemical Society, Perkin Transactions 2","2000","","10","2115","","10.1039/b003473h","","","0.71073","MoKα","","0.053","0.038","","","0.097","0.103","","","","","","1.063","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213360","8.635","0.002","14.707","0.004","22.891","0.012","90","","90","","90","","2907","1.8","173","2","173","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","Tetra-(4-chlorophenyl)ethene p-xylene inclusion compound (3.pXy)","","- C34 H26 Cl4 -","- C34 H26 Cl4 -","- C136 H104 Cl16 -","4","1","","Tanaka, Koichi; Fujimoto, Daisuke; Altreuther, A.; Oeser, Thomas; Irngartinger, Hermann; Toda, Fumio","Chiral inclusion crystallization of achiral tetrakis( p-halophenyl)ethylenes with achiral guest compounds","Journal of the Chemical Society, Perkin Transactions 2","2000","","10","2115","","10.1039/b003473h","","","0.71073","MoKα","","0.094","0.034","","","0.071","0.084","","","","","","1.037","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213361","9.3337","0.0002","15.1835","0.0003","21.9443","0.0005","90","","90","","90","","3109.91","0.12","208","2","208","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Tetra-(4-bromophenyl)ethene THF inclusion compound (2.THF)","","- C34 H32 Br4 O2 -","- C34 H32 Br4 O2 -","- C136 H128 Br16 O8 -","4","1","","Tanaka, Koichi; Fujimoto, Daisuke; Altreuther, A.; Oeser, Thomas; Irngartinger, Hermann; Toda, Fumio","Chiral inclusion crystallization of achiral tetrakis( p-halophenyl)ethylenes with achiral guest compounds","Journal of the Chemical Society, Perkin Transactions 2","2000","","10","2115","","10.1039/b003473h","","","0.71073","MoKα","","0.093","0.052","","","0.082","0.093","","","","","","1.04","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213362","9.175","0.005","9.522","0.002","17.79","0.004","91.15","0.02","97.65","0.03","104.15","0.02","1491.4","1","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","Tetra-(4-fluorophenyl)ethene xylene inclusion compound (4.pXy)","","- C38 H31 F4 -","- C38 H31 F4 -","- C76 H62 F8 -","2","1","","Tanaka, Koichi; Fujimoto, Daisuke; Altreuther, A.; Oeser, Thomas; Irngartinger, Hermann; Toda, Fumio","Chiral inclusion crystallization of achiral tetrakis( p-halophenyl)ethylenes with achiral guest compounds","Journal of the Chemical Society, Perkin Transactions 2","2000","","10","2115","","10.1039/b003473h","","","0.71073","MoKα","","0.091","0.041","","","0.104","0.122","","","","","","1.007","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213363","10.343","0.004","10.887","0.005","13.918","0.006","103.65","0.04","91.19","0.03","117.64","0.03","1333.6","1.1","223","2","223","2","","","","","","","","3","P -1","-P 1","2","","Tetra(4-hydroxyphenyl)ethene acetylacetate water inclusion compound (7.E-W)","","- C30 H30 O7 -","- C30 H30 O7 -","- C60 H60 O14 -","2","1","","Tanaka, Koichi; Fujimoto, Daisuke; Altreuther, A.; Oeser, Thomas; Irngartinger, Hermann; Toda, Fumio","Chiral inclusion crystallization of achiral tetrakis( p-halophenyl)ethylenes with achiral guest compounds","Journal of the Chemical Society, Perkin Transactions 2","2000","","10","2115","","10.1039/b003473h","","","0.71073","MoKα","","0.105","0.059","","","0.164","0.184","","","","","","1.058","","","","has coordinates,has disorder","180464","2020-10-21","18:00:00",""
"7213365","17.41","0.003","8.7394","0.0015","12.1881","0.0015","90","","107.29","0.01","90","","1770.7","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(3aSR, 4SR, 6aSR, 6RS)-3-(2,6-dichlorophenyl)-6-methyl-4- methylcarbonyloxy-5, 6-dihydro-4H cyclopenta [d][1,2] oxazol-6-yl acetate","","- C17 H17 Cl2 N O5 -","- C17 H17 Cl2 N O5 -","- C68 H68 Cl8 N4 O20 -","4","1","","Adembri, Giorgio; Giorgi, Gianluca; Lampariello, Raffaella L.; Paoli, Maria L.; Sega, Alessandro","Regio- and diastereo-selectivity in 1,3-dipolar cycloadditions of nitrile oxides to 4-substituted cyclopent-2-enones","Journal of the Chemical Society, Perkin Transactions 1","2000","","16","2649","","10.1039/b003549l","","","0.71073","MoKα","","0.0925","0.0487","","","0.0927","0.109","","","","","","1.019","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213366","37.11","0.008","10.064","0.002","20.82","0.009","90","","90","","90","","7776","4","293","2","293","2","","","","","","","","4","P b c n","-P 2n 2ab","60","MCPTweezer","MCPTweezer","","- C74 H94 Cl12 O6 -","- C74 H94 Cl12 O6 -","- C296 H376 Cl48 O24 -","4","0.5","","Sawada, Tsuyoshi; Yamada, Masaki; Thiemann, Thies; Mataka, Shuntaro","Preparation and structures of novel [2.2.2]metacyclophane tweezers","Journal of the Chemical Society, Perkin Transactions 1","2000","","16","2623","","10.1039/b003584j","","","1.54184","CuKa","","0.2754","0.0862","","0.3338","","0.229","","","1.04","","","1.256","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213367","12.033","0.002","12.768","0.001","6.244","0.002","90","","90","","90","","959.3","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C8 H12 N4 O2 -","- C8 H12 N4 O2 -","- C32 H48 N16 O8 -","4","1","","Derrer, Sam; Davies, John E.; Holmes, Andrew B.","Synthesis and conformational analysis of a dimerising eight-membered lactam dipeptide","Journal of the Chemical Society, Perkin Transactions 1","2000","","17","2943","","10.1039/b003789n","","","0.71069","MoKα","","0.1165","0.0527","","0.1892","0.1309","","","","1.043","1.079","1.079","","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213368","14.871","0.003","18.478","0.005","9.682","0.003","90","","90","","90","","2660.5","1.2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C11 H19 N3 O3 -","- C11 H19 N3 O3 -","- C88 H152 N24 O24 -","8","2","","Derrer, Sam; Davies, John E.; Holmes, Andrew B.","Synthesis and conformational analysis of a dimerising eight-membered lactam dipeptide","Journal of the Chemical Society, Perkin Transactions 1","2000","","17","2943","","10.1039/b003789n","","","0.71069","MoKα","","0.2018","0.0592","","0.2824","0.1399","","","","1.08","1.199","1.199","","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213369","7.955","0.002","18.21","0.005","10.141","0.002","90","","90.93","0.02","90","","1468.8","0.6","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","3(S)-(Acetyl-amino)-8(R)-carboxy-azacane-2-one methy ester","","- C11.5 H18.5 Cl1.5 N2 O4 -","- C11.5 H18.5 Cl1.5 N2 O4 -","- C46 H74 Cl6 N8 O16 -","4","2","","Derrer, Sam; Davies, John E.; Holmes, Andrew B.","Synthesis and conformational analysis of a type VIb β-turn mimetic based on an eight-membered lactam","Journal of the Chemical Society, Perkin Transactions 1","2000","","17","2957","","10.1039/b003791p","","","1.54178","CuKα","","0.0588","0.0513","","0.1419","0.1344","","","","1.039","1.055","1.055","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7213370","13.131","0.002","14.125","0.002","11.6791","0.0014","90","","97.061","0.012","90","","2149.8","0.5","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","compound 3f","","- C26 H28 O S -","- C26 H28 O S -","- C104 H112 O4 S4 -","4","1","","Thiemann, Thies; Ohira, Daisuke; Li, Yuanqiang; Sawada, Tsuyoshi; Mataka, Shuntaro; Rauch, Karsten; Noltemeyer, Mathias; de Meijere, Armin","[4 + 2] Cycloaddition of thiophene S-monoxides to activated methylenecyclopropanes","Journal of the Chemical Society, Perkin Transactions 1","2000","","17","2968","","10.1039/b003850o","","","0.71073","MoKα","","0.0553","0.0419","","0.1072","0.093","","","","1.083","1.067","1.067","","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213371","9.2428","0.0005","9.0959","0.0011","18.4539","0.0013","90","","103.634","0.001","90","","1507.7","0.2","123","2","123","2","","","","","","","chemical synthesis","2","C 1 2/c 1","-C 2yc","15","","2,2'-Biadamantane","","- C20 H30 -","- C20 H30 -","- C80 H120 -","4","0.5","","Rathore, Rajendra; Zhu, Chengjian; Lindeman, Sergey V.; Kochi, Jay K.","Spontaneous oxidation of organic donors to their cation radicals using Brønsted acids. Identification of the elusive oxidant †","Journal of the Chemical Society, Perkin Transactions 2","2000","","9","1837","","10.1039/b003860l","","","0.71073","MoKα","","0.0539","0.039","","0.1349","0.1039","","","","1.053","1.1","1.1","","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213372","7.131","0.001","12.598","0.002","13.699","0.002","90","","90","","90","","1230.7","0.3","228","2","228","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C16 H11 N O S -","- C16 H11 N O S -","- C64 H44 N4 O4 S4 -","4","1","","Tandel, Sagun; Wang, Anlai; Zhang, Hongming; Yousuf, Pervaiz; Biehl, Edward R.","Investigation of the reaction of 2-bromo-1-naphthol with arylacetonitriles and LiTMP: facile synthesis of 3-arylmethyl-1-hydroxynaphthalene-2-carbonitriles","Journal of the Chemical Society, Perkin Transactions 1","2000","","18","3149","","10.1039/b003935g","","","0.71073","MoKα","","0.0445","0.0322","","0.0897","0.0769","","","","1.04","1.048","1.048","","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213373","9.311","0.002","11.104","0.002","17.245","0.003","90","","90","","90","","1782.9","0.6","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H28 N2 O6 -","- C16 H28 N2 O6 -","- C64 H112 N8 O24 -","4","1","","Gravestock, Michael B.; Knight, David W.; Malik, K. M. Abdul; Thornton, Steven R.","A new version of the reverse-Cope elimination initiated by the nucleophilic addition of allylamines to nitrones: a synthesis of vicinal diamines","Journal of the Chemical Society, Perkin Transactions 1","2000","","19","3292","","10.1039/b003959o","","","0.71073","MoKα","","0.1139","0.0541","","0.1329","0.1136","","","","0.938","1.075","1.075","","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213374","15.489","0.0003","7.7878","0.0001","15.793","0.0003","90","","101.341","0.001","90","","1867.84","0.06","293","2","293","2","","","","","","","see text","3","P 1 21/c 1","-P 2ybc","14","","2,2'-diphenyl-2,2'-bis(1,3-dithianyl)","","- C20 H22 S4 -","- C20 H22 S4 -","- C80 H88 S16 -","4","1","","Lam, Yulin; Wah Wong, Ming; Huang, Hsing-Hua; Liang, Eping","Rotational isomerism and crystal structures of 2,2′-diphenyl-2,2′-bi-1,3-dithianyl and 2,2′-diphenyl-2,2′-bi-1,3-dioxolanyl †","Journal of the Chemical Society, Perkin Transactions 2","2000","","10","2090","","10.1039/b003961f","","","0.71073","MoKα","","0.063","0.0484","","0.1153","0.1079","","","","1.045","1.089","1.089","","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213375","6.0592","0.0003","6.9442","0.0004","17.666","0.001","90","","94.023","0.001","90","","741.49","0.07","296","2","296","2","","","","","","","see text","3","P 1 21/n 1","-P 2yn","14","","2,2'-diphenyl-2,2'-bis(1,3-dioxolanyl)","","- C18 H18 O4 -","- C18 H18 O4 -","- C36 H36 O8 -","2","0.5","","Lam, Yulin; Wah Wong, Ming; Huang, Hsing-Hua; Liang, Eping","Rotational isomerism and crystal structures of 2,2′-diphenyl-2,2′-bi-1,3-dithianyl and 2,2′-diphenyl-2,2′-bi-1,3-dioxolanyl †","Journal of the Chemical Society, Perkin Transactions 2","2000","","10","2090","","10.1039/b003961f","","","0.71073","MoKα","","0.0526","0.0389","","0.1021","0.0956","","","","1.059","1.123","1.123","","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213376","8.637","0.004","17.757","0.007","9.976","0.007","90","","110.15","0.03","90","","1436.3","1.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H19 N O5 -","- C15 H19 N O5 -","- C60 H76 N4 O20 -","4","1","","Hong, Bor-Cherng; Sun, Hsu-I; Shr, Yeong-Jou; Lin, Kuan-Jiuh","A novel oxidative alkylation‒nitration of 1,3-dicarbonyl compounds to dicyclopentadiene and norbornene †","Journal of the Chemical Society, Perkin Transactions 1","2000","","17","2939","","10.1039/b004095i","","","0.71069","MoKα","","0.0743","0.0427","","0.1222","0.1092","","","","1.043","1.192","1.192","","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213377","6.977","0.01","40.172","0.017","7.607","0.014","90","","115.05","0.09","90","","1932","5","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H16 Cl2 O2 S2 -","- C21 H16 Cl2 O2 S2 -","- C84 H64 Cl8 O8 S8 -","4","1","","Gabbutt, Christopher D.; Hepworth, John D.; Heron, B. Mark; Coles, Simon J.; Hursthouse, Michael B.","Synthesis of some thiochromeno[4,3-c]- and [3,4-c]-pyrazoles","Journal of the Chemical Society, Perkin Transactions 1","2000","","17","2930","","10.1039/b004149l","","","0.71069","MoKα","","0.2233","0.0562","","0.1313","0.0879","","","","0.472","0.875","0.875","","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213378","6.231","0.002","8.198","0.003","10.3","0.004","99.17","0.03","95.29","0.04","106.63","0.016","492.4","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C10 H8 N4 O2 -","- C10 H8 N4 O2 -","- C20 H16 N8 O4 -","2","1","","Gowenlock, Brian G.; Maidment, Mark J.; Orrell, Keith G.; Šik, Vladimir; Mele, Giuseppe; Vasapollo, Giuseppe; Hursthouse, Michael B.; Abdul Malik, K. M.","The solid- and solution-state structures of 2-nitrosopyridine and its 3- and 4-methyl derivatives","Journal of the Chemical Society, Perkin Transactions 2","2000","","11","2280","","10.1039/b004270f","","","0.71069","MoKα","","0.0781","0.0604","","0.126","0.1203","","","","0.775","0.947","0.947","","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213379","12.698","0.002","9.275","0.004","14.006","0.002","90","","102.88","0.01","90","","1608","0.8","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C17 H23 Br O2 -","- C17 H23 Br O2 -","- C68 H92 Br4 O8 -","4","1","","Bogdan, Elena; Grosu, Ion; Mesaros, Eugen; Toupet, Loïc; Plé, Gerard; Mager, Sorin; Muntean, Luminita","Considerations on the stereoselective synthesis of dibrominated spiro-1,3-dioxanes. Synthesis and stereochemistry of monobrominated precursors","Journal of the Chemical Society, Perkin Transactions 1","2000","","21","3635","","10.1039/b004282j","","","0.71069","MoKα","","0.0752","0.0475","","","0.1121","0.124","","","","","","1.053","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213380","12.232","0.002","9.102","0.001","12.322","0.009","90","","106.32","0.03","90","","1316.6","1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H21 Br O2 -","- C12 H21 Br O2 -","- C48 H84 Br4 O8 -","4","1","","Bogdan, Elena; Grosu, Ion; Mesaros, Eugen; Toupet, Loïc; Plé, Gerard; Mager, Sorin; Muntean, Luminita","Considerations on the stereoselective synthesis of dibrominated spiro-1,3-dioxanes. Synthesis and stereochemistry of monobrominated precursors","Journal of the Chemical Society, Perkin Transactions 1","2000","","21","3635","","10.1039/b004282j","","","0.71069","MoKα","","0.0818","0.0431","","","0.1037","0.1186","","","","","","1.065","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213381","6.6773","0.0014","8.191","0.002","9.319","0.002","71.48","0.015","79.503","0.015","73.308","0.015","460.6","0.19","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C9 H7 N3 O S -","- C9 H7 N3 O S -","- C18 H14 N6 O2 S2 -","2","1","","Chowdhry, Mubarik M.; Mingos, D. Michael P.; White, Andrew J. P.; Williams, David J.","Syntheses and characterization of 5-substituted hydantoins and thiazolines—implications for crystal engineering of hydrogen bonded assemblies. Crystal structures † of 5-(2-pyridylmethylene)hydantoin, 5-(2-pyridylmethylene)-2-thiohydantoin, 5-(2-pyridylmethylene)thiazolidine-2,4-dione, 5-(2-pyridylmethylene)rhodanine and 5-(2-pyridylmethylene)pseudothiohydantoin †","Journal of the Chemical Society, Perkin Transactions 1","2000","","20","3495","","10.1039/b004312p","","","1.54178","CuKα","","0.0375","0.035","","0.1056","0.0942","","","","1.039","1.038","1.038","","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213382","4.709","0.003","10.278","0.004","18.676","0.011","90","","92.11","0.05","90","","903.3","0.9","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H7 N3 O S -","- C9 H7 N3 O S -","- C36 H28 N12 O4 S4 -","4","1","","Chowdhry, Mubarik M.; Mingos, D. Michael P.; White, Andrew J. P.; Williams, David J.","Syntheses and characterization of 5-substituted hydantoins and thiazolines—implications for crystal engineering of hydrogen bonded assemblies. Crystal structures † of 5-(2-pyridylmethylene)hydantoin, 5-(2-pyridylmethylene)-2-thiohydantoin, 5-(2-pyridylmethylene)thiazolidine-2,4-dione, 5-(2-pyridylmethylene)rhodanine and 5-(2-pyridylmethylene)pseudothiohydantoin †","Journal of the Chemical Society, Perkin Transactions 1","2000","","20","3495","","10.1039/b004312p","","","1.54178","CuKα","","0.0364","0.0355","","0.102","0.0968","","","","1.048","1.054","1.054","","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213383","4.9555","0.0008","8.9958","0.0015","10.773","0.002","108.603","0.009","95.338","0.012","95.933","0.012","448.65","0.14","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C9 H6 N2 O2 S -","- C9 H6 N2 O2 S -","- C18 H12 N4 O4 S2 -","2","1","","Chowdhry, Mubarik M.; Mingos, D. Michael P.; White, Andrew J. P.; Williams, David J.","Syntheses and characterization of 5-substituted hydantoins and thiazolines—implications for crystal engineering of hydrogen bonded assemblies. Crystal structures † of 5-(2-pyridylmethylene)hydantoin, 5-(2-pyridylmethylene)-2-thiohydantoin, 5-(2-pyridylmethylene)thiazolidine-2,4-dione, 5-(2-pyridylmethylene)rhodanine and 5-(2-pyridylmethylene)pseudothiohydantoin †","Journal of the Chemical Society, Perkin Transactions 1","2000","","20","3495","","10.1039/b004312p","","","0.71073","MoKα","","0.0458","0.0375","","0.1119","0.1055","","","","1.128","1.156","1.156","","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213384","3.8818","0.0007","11.0381","0.0013","11.4248","0.0014","76.449","0.008","87.344","0.013","82.699","0.014","471.97","0.12","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C9 H6 N2 O S2 -","- C9 H6 N2 O S2 -","- C18 H12 N4 O2 S4 -","2","1","","Chowdhry, Mubarik M.; Mingos, D. Michael P.; White, Andrew J. P.; Williams, David J.","Syntheses and characterization of 5-substituted hydantoins and thiazolines—implications for crystal engineering of hydrogen bonded assemblies. Crystal structures † of 5-(2-pyridylmethylene)hydantoin, 5-(2-pyridylmethylene)-2-thiohydantoin, 5-(2-pyridylmethylene)thiazolidine-2,4-dione, 5-(2-pyridylmethylene)rhodanine and 5-(2-pyridylmethylene)pseudothiohydantoin †","Journal of the Chemical Society, Perkin Transactions 1","2000","","20","3495","","10.1039/b004312p","","","1.54178","CuKα","","0.0447","0.042","","0.1208","0.1165","","","","1.053","1.061","1.061","","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213385","16.318","0.001","10.782","0.001","10.295","0.001","90","","90","","90","","1811.3","0.3","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","4-nitrobenzenesulfonyl azide","","- C6 H4 N4 O4 S -","- C6 H4 N4 O4 S -","- C48 H32 N32 O32 S8 -","8","2","","Besenyei, Gábor; Párkányi, László; Foch, Isabella; Simándi, László I.; Kálmán, Alajos","Crystallographic characterisation of arenesulfonyl azides. Structural and kinetic effects induced by ortho- and para-substituents","Journal of the Chemical Society, Perkin Transactions 2","2000","","9","1798","","10.1039/b004337k","","","0.71073","MOkα","","0.0579","0.0338","","","0.0845","0.0911","","","","","","0.919","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213386","7.083","0.001","7.309","0.001","10.28","0.001","97.73","0.01","108.7","0.01","100.06","0.01","485.88","0.12","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","4-acetylbenzenesulfonyl azide","","- C8 H7 N3 O3 S -","- C8 H7 N3 O3 S -","- C16 H14 N6 O6 S2 -","2","1","","Besenyei, Gábor; Párkányi, László; Foch, Isabella; Simándi, László I.; Kálmán, Alajos","Crystallographic characterisation of arenesulfonyl azides. Structural and kinetic effects induced by ortho- and para-substituents","Journal of the Chemical Society, Perkin Transactions 2","2000","","9","1798","","10.1039/b004337k","","","0.71073","MOkα","","0.0565","0.0397","","","0.1102","0.1192","","","","","","1.001","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213387","5.174","0.001","10.727","0.001","16.762","0.001","90","0.01","94.22","0.01","90","0.01","927.8","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-methoxybenzenesulfonyl azide","","- C7 H7 N3 O3 S -","- C7 H7 N3 O3 S -","- C28 H28 N12 O12 S4 -","4","1","","Besenyei, Gábor; Párkányi, László; Foch, Isabella; Simándi, László I.; Kálmán, Alajos","Crystallographic characterisation of arenesulfonyl azides. Structural and kinetic effects induced by ortho- and para-substituents","Journal of the Chemical Society, Perkin Transactions 2","2000","","9","1798","","10.1039/b004337k","","","0.71073","MOkα","","0.0533","0.0398","","","0.122","0.1284","","","","","","1.056","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213388","7.908","0.001","14.572","0.001","8.238","0.001","90","","106.59","0.01","90","","909.79","0.18","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-nitrobenzenesulfonyl azide","","- C6 H4 N4 O4 S -","- C6 H4 N4 O4 S -","- C24 H16 N16 O16 S4 -","4","1","","Besenyei, Gábor; Párkányi, László; Foch, Isabella; Simándi, László I.; Kálmán, Alajos","Crystallographic characterisation of arenesulfonyl azides. Structural and kinetic effects induced by ortho- and para-substituents","Journal of the Chemical Society, Perkin Transactions 2","2000","","9","1798","","10.1039/b004337k","","","0.71073","MOkα","","0.083","0.0354","","","0.0882","0.0967","","","","","","0.872","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213389","5.984","0.001","35.194","0.001","10.795","0.001","90","","92.29","0.01","90","","2271.6","0.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","ferrocenesulfonyl azide","","- C10 H9 Fe N3 O2 S -","- C10 H9 Fe N3 O2 S -","- C80 H72 Fe8 N24 O16 S8 -","8","2","","Besenyei, Gábor; Párkányi, László; Foch, Isabella; Simándi, László I.; Kálmán, Alajos","Crystallographic characterisation of arenesulfonyl azides. Structural and kinetic effects induced by ortho- and para-substituents","Journal of the Chemical Society, Perkin Transactions 2","2000","","9","1798","","10.1039/b004337k","","","0.71073","MOkα","","0.0678","0.0335","","","0.0881","0.0967","","","","","","1.037","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213390","24.604","0.008","5.8049","0.0018","14.597","0.004","90","","111.784","0.006","90","","1935.9","1","150","2","150","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C22.5 H19 Br O1.5 -","- C22.5 H19 Br O1.5 -","- C90 H76 Br4 O6 -","4","1","","Aggarwal, Varinder K.; Smith, Helen W.; Hynd, George; Jones, Ray V. H.; Fieldhouse, Robin; Spey, Sharon E.","Catalytic cyclopropanation of electron deficient alkenes mediated by chiral and achiral sulfides: scope and limitations in reactions involving phenyldiazomethane and ethyl diazoacetate","Journal of the Chemical Society, Perkin Transactions 1","2000","","19","3267","","10.1039/b004367m","","","0.71073","MoKα","","0.1212","0.0658","","","0.1733","0.2006","","","","","","0.929","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213391","6.6773","0.0014","8.191","0.002","9.319","0.002","71.48","0.015","79.503","0.015","73.308","0.015","460.6","0.19","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C9 H7 N3 O S -","- C9 H7 N3 O S -","- C18 H14 N6 O2 S2 -","2","1","","Chowdhry, Mubarik M.; Mingos, D. Michael P.; White, Andrew J. P.; Williams, David J.","15N NMR and crystal structure studies of 5-(2-pyridylmethylene)pseudothiohydantoin;† dipolar dephasing experiments for establishing the preferred tautomer in the solid and solution states","Journal of the Chemical Society, Perkin Transactions 2","2000","","11","2265","","10.1039/b004368k","","","1.54178","CuKα","","0.0375","0.035","","0.1056","0.0942","","","","1.039","1.038","1.038","","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213392","14.408","0.002","7.993","0.002","14.544","0.002","90","","107.88","0.02","90","","1594","0.5","301.2","","301.2","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C21 H18 O2 -","- C21 H18 O2 -","- C84 H72 O8 -","4","1","","Kelkar, Avijit S.; Letcher, Roy M.; Cheung, Kung-Kai; Chiu, Kwei-Fung; Brown, Geoffrey D.","Synthesis of C-ring substituted xanthones from the [4 + 2] cycloaddition reaction of vinylchromones and acyclic enamines","Journal of the Chemical Society, Perkin Transactions 1","2000","","22","3732","","10.1039/b004422i","","","0.7107","MoKalpha","","","0.0712","","","0.0968","","","","","1.994","1.994","","","","","has coordinates","288197","2023-12-08","18:09:39",""
"7213393","22.123","0.003","7.04","0.001","15.937","0.003","90","0.1","92.8","0.1","90","0.1","2479.2","0.7","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C14 H9 Cl2 N O2 -","- C14 H9 Cl2 N O2 -","- C112 H72 Cl16 N8 O16 -","8","2","","Mahato, Shashi B.; Garai, Subhadra; Weber, Manuela; Luger, Peter","A novel annelation to quinolines and isoquinolines under Friedel‒Crafts conditions: a one-step synthesis of functionalized pyridoquinolines and pyridoisoquinolines","Journal of the Chemical Society, Perkin Transactions 1","2000","","17","2898","","10.1039/b004444j","","","1.5418","CuKα","","0.0519","0.0408","","","0.1377","0.1412","","","","","","1.135","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213394","5.1199","0.0013","13.998","0.004","24.286","0.006","90","","90","","90","","1740.5","0.8","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C21 H23 N O2 -","- C21 H23 N O2 -","- C84 H92 N4 O8 -","4","1","","Simpson, Alison F.; Bodkin, Corinna D.; Butts, Craig P.; Armitage, Mark A.; Gallagher, Timothy","Asymmetric reduction of prochiral cycloalkenones. The influence of exocyclic alkene geometry","Journal of the Chemical Society, Perkin Transactions 1","2000","","18","3047","","10.1039/b004540n","","","0.71073","MoKα","","0.1002","0.05","","0.1033","0.0878","","","","0.969","1.049","1.049","","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213395","11.0048","0.0015","12.097","0.0018","10.7206","0.0016","103.229","0.013","94.072","0.014","113.705","0.011","1250.6","0.4","296.2","","296.2","","","","","","","","","4","P -1","-P 1","2","","","","- C27 H37 N O3 -","- C27 H37 N O3 -","- C54 H74 N2 O6 -","2","1","","Clayden, Jonathan; Helliwell, Madeleine; McCarthy, Catherine; Westlund, Neil","Atropisomeric benzamides and naphthamides as chiral auxiliaries †","Journal of the Chemical Society, Perkin Transactions 1","2000","","19","3232","","10.1039/b004682p","","","1.5418","CuKα","","0.1272","0.0728","","","0.2005","0.2382","","","","","","1.048","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213396","12.638","0.004","14.765","0.003","10.037","0.002","94.23","0.02","100.79","0.02","108.72","0.02","1724.3","0.8","142.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C48 H30 N2 O Se2 -","- C48 H30 N2 O Se2 -","- C96 H60 N4 O2 Se4 -","2","1","","Srinivasan, Alagar; Anand, Venkataramana Rao G.; Pushpan, Simi K.; Chandrashekar, Tavarekere K.; Sugiura, Ken-ichi; Sakata, Yoshiteru","Core modified meso-aryl sapphyrins and rubyrins: structural and anion receptor properties","Journal of the Chemical Society, Perkin Transactions 2","2000","","9","1788","","10.1039/b004687f","","","0.7107","MoKα","","","0.062","","","","0.0711","","","","","","1.266","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213397","12.66","0.01","11.36","0.02","29.16","0.02","90","","95.51","0.1","90","","4174","9","234.2","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C49 H31 Cl3 N2 S3 -","- C49 H31 Cl3 N2 S3 -","- C196 H124 Cl12 N8 S12 -","4","1","","Srinivasan, Alagar; Anand, Venkataramana Rao G.; Pushpan, Simi K.; Chandrashekar, Tavarekere K.; Sugiura, Ken-ichi; Sakata, Yoshiteru","Core modified meso-aryl sapphyrins and rubyrins: structural and anion receptor properties","Journal of the Chemical Society, Perkin Transactions 2","2000","","9","1788","","10.1039/b004687f","","","0.7107","MoKα","","","0.0741","","","","0.1041","","","","","","2.572","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213398","20.8303","0.0009","18.8385","0.0009","28.3817","0.0009","90","0.01","152.539","0.001","90","0.01","5135.9","0.4","298","","","","","","","","","","Local laboratory","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H18 Br N2 -","- C13 H18 Br N2 -","- C208 H288 Br16 N32 -","16","4","","Claramunt, Rosa María; López, Concepción; García, María de los Angeles; Pierrot, Marcel; Giorgi, Michel; Elguero, José","3(5)-(1-Adamantyl)pyrazoles: chemistry and molecular structure †","Journal of the Chemical Society, Perkin Transactions 2","2000","","10","2049","","10.1039/b004690f","","","0.71073","MoKα","","0.0906","0.059","","0.066","0.056","0.056","","","1.507","1.654","1.654","1.654","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7213399","5.3697","0.0003","16.3416","0.0014","21.7265","0.0018","90","","90","","90","","1906.5","0.3","123","1","123","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","CSF93/Spivey/AN-Wafers/4999/12-3-99.","","","- C23 H24 N2 O2 -","- C23 H24 N2 O2 -","- C92 H96 N8 O8 -","4","1","","Spivey, Alan C.; Maddaford, Adrian; Fekner, Tomasz; Redgrave, Alison J.; Frampton, Christopher S.","Synthesis of C2-symmetric analogues of 4-(pyrrolidino)pyridine: new chiral nucleophilic catalysts","Journal of the Chemical Society, Perkin Transactions 1","2000","","20","3460","","10.1039/b004704j","","","0.71073","MoKα","","0.0338","0.0298","","","0.0789","0.0806","","","","","","1.002","","","","has coordinates","180464","2020-10-21","18:00:00",""
"7213400","18.906","0.002","5.616","0.006","20.119","0.002","90","","97.916","0.008","90","","2116","2","298.2","","298.2","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C24 H24 N4 -","- C24 H24 N4 -","- C96 H96 N16 -","4","1","","Ishii, Keitaro; Shimada, Yukio; Sugiyama, Shigeo; Noji, Masahiro","Photoreactions of β-aziridinylacrylonitrile. 1,3-Dipolar cycloadditions of photoinduced azomethine ylide","Journal of the Chemical Society, Perkin Transactions 1","2000","","18","3022","","10.1039/b004850j","","","1.54178","CuKα","","","0.0468","","","0.066","","","","","1.047","1.047","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213401","8.405","0.009","9.044","0.009","10.192","0.012","69.549","0.01","76.797","0.01","71.6","0.01","682.7","1.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C12 H16 O7 -","- C12 H16 O7 -","- C24 H32 O14 -","2","1","","Hodgson, David M.; Bailey, James M.; Villalonga-Barber, Carolina; Drew, Michael G. B.; Harrison, Timothy","Selectivity in the cycloadditions of carbonyl ylides with glyoxylates: an approach to the zaragozic acids—squalestatins","Journal of the Chemical Society, Perkin Transactions 1","2000","","20","3432","","10.1039/b004870o","","","0.71073","MoKα","","0.0722","0.0645","","","0.1822","0.2011","","","","","","0.291","","","","has coordinates","181910","2020-10-21","18:00:00",""
"7213402","8.982","0.003","12.471","0.003","9.086","0.003","90","","92.91","0.03","90","","1016.5","0.5","293.2","","293.2","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H20 N2 O8 -","- C20 H20 N2 O8 -","- C40 H40 N4 O16 -","2","0.5","","Kujanpää, Jukka P.; Riddell, Frank G.","Models for molecular motions within polymer chains. Part 1. A solid-state NMR study of hexane-1,6-diyl bis( p-nitrobenzoate)","Journal of the Chemical Society, Perkin Transactions 2","2000","","11","2225","","10.1039/b005005i","","","0.7107","MoKalpha","","","0.0472","","","0.0368","","","","","3.055","3.055","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213403","11.271","0.001","9.216","0.004","24.27","0.003","90","","92.27","0.06","90","","2519","1.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","diphenyl[1-(2-phenylamino-3-oxocyclopentyl)ethyl]phosphine oxide","","- C30 H26 N O3 P -","- C30 H26 N O3 P -","- C120 H104 N4 O12 P4 -","4","1","","Álvarez-Gutiérrez, Julia M.; López-Ortiz, Fernando; García-Granda, Santiago; Rodríguez-González, Alejandra","Synthesis of cyclopentenones and butenolides by reaction of the lithium salt of P,P-diphenyl-P-(alkyl)(N-phenyl)phosphazenes with electrophilic double and triple bonds","Journal of the Chemical Society, Perkin Transactions 1","2000","","24","4469","","10.1039/b005131o","","","0.71073","mokα","","0.3456","0.0492","","","0.085","0.1502","","","","","","0.896","","","","has coordinates","193991","2020-10-21","18:00:00",""
"7213404","13.294","0.002","15.467","0.002","12.047","0.001","90","","90","","90","","2477.1","0.5","296.2","","296.2","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C34 H25 N O2 -","- C34 H25 N O2 -","- C136 H100 N4 O8 -","4","1","","Kohmoto, Shigeo; Masu, Hyuma; Tatsuno, Chuya; Kishikawa, Keiki; Yamamoto, Makoto; Yamaguchi, Kentaro","Diastereoselective intramolecular [4 + 4] photocycloaddition reaction of N-(naphthylcarbonyl)anthracene-9-carboxamides: temperature effects and reversal of diastereoselectivity","Journal of the Chemical Society, Perkin Transactions 1","2000","","24","4464","","10.1039/b005142j","","","1.5418","CuKα","","","0.0887","","","0.0896","","","","","1.102","1.102","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213405","13.9906","0.0009","22.06","0.001","8.082","0.001","90","","90","","90","","2494.4","0.4","296.2","","296.2","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C34 H25 N O2 -","- C34 H25 N O2 -","- C136 H100 N4 O8 -","4","1","","Kohmoto, Shigeo; Masu, Hyuma; Tatsuno, Chuya; Kishikawa, Keiki; Yamamoto, Makoto; Yamaguchi, Kentaro","Diastereoselective intramolecular [4 + 4] photocycloaddition reaction of N-(naphthylcarbonyl)anthracene-9-carboxamides: temperature effects and reversal of diastereoselectivity","Journal of the Chemical Society, Perkin Transactions 1","2000","","24","4464","","10.1039/b005142j","","","1.5418","CuKα","","","0.0399","","","0.0384","","","","","1.647","1.647","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213406","12.384","0.002","21.405","0.002","9.292","0.002","90","","90","","90","","2463.1","0.7","296.2","","296.2","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C34 H25 N O2 -","- C34 H25 N O2 -","- C136 H100 N4 O8 -","4","1","","Kohmoto, Shigeo; Masu, Hyuma; Tatsuno, Chuya; Kishikawa, Keiki; Yamamoto, Makoto; Yamaguchi, Kentaro","Diastereoselective intramolecular [4 + 4] photocycloaddition reaction of N-(naphthylcarbonyl)anthracene-9-carboxamides: temperature effects and reversal of diastereoselectivity","Journal of the Chemical Society, Perkin Transactions 1","2000","","24","4464","","10.1039/b005142j","","","1.5418","CuKα","","","0.0395","","","0.04","","","","","2.798","2.798","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213407","8.715","0.002","18.175","0.005","21.948","0.005","90","","90","","90","","3476.5","1.5","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C16 H20 Cl N O7 -","- C16 H20 Cl N O7 -","- C128 H160 Cl8 N8 O56 -","8","2","","Boyd, Derek R.; Sharma, Narain D.; Barr, Stephen A.; Carroll, Jonathan G.; Mackerracher, Donald; Malone, John F.","Synthesis and absolute stereochemistry assignment of enantiopure dihydrofuro- and dihydropyrano-quinoline alkaloids","Journal of the Chemical Society, Perkin Transactions 1","2000","","20","3397","","10.1039/b005285j","","","1.54178","CuKα","","0.1119","0.0885","","","0.2253","0.2506","","","","","","1.012","","","","has coordinates","288183","2023-12-08","14:43:01",""
"7213408","8.12","0.021","12.457","0.019","12.139","0.019","90","","101.18","0.17","90","","1205","4","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C25 H29 N O6 -","- C25 H29 N O6 -","- C50 H58 N2 O12 -","2","1","","Boyd, Derek R.; Sharma, Narain D.; Barr, Stephen A.; Carroll, Jonathan G.; Mackerracher, Donald; Malone, John F.","Synthesis and absolute stereochemistry assignment of enantiopure dihydrofuro- and dihydropyrano-quinoline alkaloids","Journal of the Chemical Society, Perkin Transactions 1","2000","","20","3397","","10.1039/b005285j","","","0.71073","MoKα","","0.2036","0.1013","","","0.2435","0.3195","","","","","","0.945","","","","has coordinates","288183","2023-12-08","14:43:01",""
"7213409","10.33","0.003","11.287","0.004","21.203","0.006","90","","90","","90","","2472.2","1.3","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C25 H23 Br F3 N O5 -","- C25 H23 Br F3 N O5 -","- C100 H92 Br4 F12 N4 O20 -","4","1","","Boyd, Derek R.; Sharma, Narain D.; Barr, Stephen A.; Carroll, Jonathan G.; Mackerracher, Donald; Malone, John F.","Synthesis and absolute stereochemistry assignment of enantiopure dihydrofuro- and dihydropyrano-quinoline alkaloids","Journal of the Chemical Society, Perkin Transactions 1","2000","","20","3397","","10.1039/b005285j","","","0.71073","MoKα","","0.1472","0.0685","","","0.128","0.1526","","","","","","0.896","","","","has coordinates","288183","2023-12-08","14:43:01",""
"7213410","6.3717","0.0014","10.2304","0.0011","12.68","0.002","94.724","0.011","99.273","0.016","97.332","0.013","804.6","0.2","177","","177","","","","","","","","?","3","P -1","-P 1","2","","","","- C18 H30 O2 -","- C18 H30 O2 -","- C36 H60 O4 -","2","1","","Robertson, Jeremy; Hatley, Richard J. D.; Watkin, David J.","Preparation of the tricyclic ketopyrrole core of roseophilin by radical macrocyclisation and Paal‒Knorr condensation","Journal of the Chemical Society, Perkin Transactions 1","2000","","20","3389","","10.1039/b005351l","","","1.5418","CuKα","","","0.0517","","","","0.055","","","","","","0.8606","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213411","7.4089","0.0001","10.5805","0.0002","20.2337","0.0003","90","","90.491","0.001","90","","1586.06","0.04","213","2","213","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C20 H16 O4 -","- C20 H16 O4 -","- C80 H64 O16 -","4","1","","Nair, Vijay; Nandakumar, Mecheril Valsan; Anilkumar, Gopinathan Nair; Maliakal, Davis; Vairamani, Mariappanadar; Prabhakar, Sripadi; Rath, Nigam P.","Cycloaddition reactions of 2-oxo-2H-cyclohepta[b]furan derivatives with arylacetylenes and the di-π-methane rearrangement of homobarrelene derivatives","Journal of the Chemical Society, Perkin Transactions 1","2000","","22","3795","","10.1039/b005377p","","","0.71073","MoKα","","0.0603","0.0377","","","0.0892","0.1003","","","","","","1.014","","","","has coordinates,has disorder","180465","2020-10-21","18:00:00",""
"7213412","12.738","0.006","14.973","0.008","28.374","0.015","90","","93.06","0.04","90","","5404","5","130","2","130","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","{5-(1-Methylpropyl)-10,20-diphenylporphy- rinato}nickel(II)","","- C36 H28 N4 Ni -","- C36 H23.5 N4 Ni -","- C288 H188 N32 Ni8 -","8","2","","Senge, Mathias O.; Feng, Xiangdong","Regioselective reaction of 5,15-disubstituted porphyrins with organolithium reagents—synthetic access to 5,10,15-trisubstituted porphyrins and directly meso-meso-linked bisporphyrins","Journal of the Chemical Society, Perkin Transactions 1","2000","","21","3615","","10.1039/b005411i","","","1.54178","CuKα","","0.117","0.0786","","","0.2048","0.2365","","","","","","1.024","","","","has coordinates,has disorder","180465","2020-10-21","18:00:00",""
"7213413","12.157","0.005","18.255","0.01","13.045","0.006","90","","116.75","0.03","90","","2585","2","130","2","130","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","5-isopropyl-10,20-diphenylporphyrin","","- C35 H28 N4 -","- C35 H28 N4 -","- C140 H112 N16 -","4","1","","Senge, Mathias O.; Feng, Xiangdong","Regioselective reaction of 5,15-disubstituted porphyrins with organolithium reagents—synthetic access to 5,10,15-trisubstituted porphyrins and directly meso-meso-linked bisporphyrins","Journal of the Chemical Society, Perkin Transactions 1","2000","","21","3615","","10.1039/b005411i","","","1.54178","CuKα","","0.0514","0.0418","","","0.1109","0.1182","","","","","","1.026","","","","has coordinates","180465","2020-10-21","18:00:00",""
"7213416","7.15","0.009","9.834","0.011","12.116","0.013","90","","94.66","0.01","90","","849.1","1.7","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C14 H25 N O3 Si -","- C14 H25 N O3 Si -","- C28 H50 N2 O6 Si2 -","2","1","","Basra, Sanjivanjit K.; Drew, Michael G. B.; Mann, John; Kane, Peter D.","A novel approach to bis-isoxazolines using a latent form of cyclopentadienone","Journal of the Chemical Society, Perkin Transactions 1","2000","","21","3592","","10.1039/b005520o","","","0.71073","MoKα","","0.0964","0.0645","","","0.1513","0.165","","","","","","1.066","","","","has coordinates","180465","2020-10-21","18:00:00",""
"7213417","7.091","0.009","25.43","0.03","11.529","0.014","90","","96.49","0.01","90","","2066","4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H24 Br N O3 Si -","- C18 H24 Br N O3 Si -","- C72 H96 Br4 N4 O12 Si4 -","4","1","","Basra, Sanjivanjit K.; Drew, Michael G. B.; Mann, John; Kane, Peter D.","A novel approach to bis-isoxazolines using a latent form of cyclopentadienone","Journal of the Chemical Society, Perkin Transactions 1","2000","","21","3592","","10.1039/b005520o","","","0.71073","MoKα","","0.2598","0.1249","","","0.3276","0.3912","","","","","","1.087","","","","has coordinates,has disorder","180465","2020-10-21","18:00:00",""
"7213418","5.513","0.008","49.82","0.06","10.84","0.014","90","","103.71","0.01","90","","2892","7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H13 Br N2 O3 -","- C15 H13 Br N2 O3 -","- C120 H104 Br8 N16 O24 -","8","2","","Basra, Sanjivanjit K.; Drew, Michael G. B.; Mann, John; Kane, Peter D.","A novel approach to bis-isoxazolines using a latent form of cyclopentadienone","Journal of the Chemical Society, Perkin Transactions 1","2000","","21","3592","","10.1039/b005520o","","","0.71073","MoKα","","0.2013","0.108","","","0.2553","0.2893","","","","","","1.088","","","","has coordinates","180465","2020-10-21","18:00:00",""
"7213419","11.2827","0.001","13.2262","0.001","9.239","0.001","90","","98.352","0.01","90","","1364.1","0.2","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C16 H13 N O2 S -","- C16 H13 N O2 S -","- C64 H52 N4 O8 S4 -","4","1","","Ram, Vishnu J.; Nath, Mahendra; Srivastava, Pratibha; Sarkhel, Sanjay; Maulik, Prakas R.","A facile access to the synthesis of functionalised unsymmetrical biaryls from 2H-pyran-2-ones through carbanion induced C‒C bond formation †","Journal of the Chemical Society, Perkin Transactions 1","2000","","22","3719","","10.1039/b005572g","","","0.71073","MoKα","","0.0402","0.0386","","0.1119","0.1075","","","","1.105","1.083","1.083","","","","","has coordinates","180465","2020-10-21","18:00:00",""
"7213420","13.7018","0.0003","14.3753","0.0003","14.4362","0.0003","108.261","0.002","107.53","0.002","103.187","0.002","2406.02","0.11","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C30 H24 O6 -","- C30 H24 O6 -","- C120 H96 O24 -","4","2","","Pigge, F. Christopher; Ghasedi, Fatemeh; Zheng, Zhanmiao; Rath, Nigam P.; Nichols, Gary; Chickos, James S.","Structural characterization of crystalline inclusion complexes formed from 1,3,5-triaroylbenzene derivatives—a new family of inclusion hosts","Journal of the Chemical Society, Perkin Transactions 2","2000","","12","2458","","10.1039/b005702i","","","0.71073","MoKα","","0.1145","0.0471","","","0.0914","0.1098","","","","","","1.015","","","","has coordinates","180465","2020-10-21","18:00:00",""
"7213421","10.3402","0.0009","10.4427","0.0009","13.4887","0.0011","87.854","0.006","80.536","0.005","64.23","0.005","1292.8","0.2","218","2","218","2","","","","","","","","4","P -1","-P 1","2","","","","- C30 H18 N3 O9 -","- C30 H18 N3 O9 -","- C60 H36 N6 O18 -","2","1","","Pigge, F. Christopher; Ghasedi, Fatemeh; Zheng, Zhanmiao; Rath, Nigam P.; Nichols, Gary; Chickos, James S.","Structural characterization of crystalline inclusion complexes formed from 1,3,5-triaroylbenzene derivatives—a new family of inclusion hosts","Journal of the Chemical Society, Perkin Transactions 2","2000","","12","2458","","10.1039/b005702i","","","0.71073","MoKα","","0.1486","0.084","","","0.2201","0.2702","","","","","","1.018","","","","has coordinates","180465","2020-10-21","18:00:00",""
"7213422","8.8361","0.0002","10.4985","0.0002","15.1193","0.0003","80.305","0.001","85.321","0.001","80.857","0.001","1362.79","0.05","213","2","213","2","","","","","","","","4","P -1","-P 1","2","","","","- C30 H21 N3 O10 -","- C30 H15 N3 O10 -","- C60 H30 N6 O20 -","2","1","","Pigge, F. Christopher; Ghasedi, Fatemeh; Zheng, Zhanmiao; Rath, Nigam P.; Nichols, Gary; Chickos, James S.","Structural characterization of crystalline inclusion complexes formed from 1,3,5-triaroylbenzene derivatives—a new family of inclusion hosts","Journal of the Chemical Society, Perkin Transactions 2","2000","","12","2458","","10.1039/b005702i","","","0.71073","MoKα","","0.1224","0.0622","","","0.145","0.1838","","","","","","1.065","","","","has coordinates,has disorder","180465","2020-10-21","18:00:00",""
"7213423","9.7537","0.0002","10.5838","0.0002","14.6243","0.0002","82.543","0.001","81.724","0.001","71.179","0.001","1408.47","0.04","223","2","223","2","","","","","","","","4","P -1","-P 1","2","","","","- C28.5 H19.5 N4.5 O12 -","- C28.5 H19.5 N4.5 O12 -","- C57 H39 N9 O24 -","2","1","","Pigge, F. Christopher; Ghasedi, Fatemeh; Zheng, Zhanmiao; Rath, Nigam P.; Nichols, Gary; Chickos, James S.","Structural characterization of crystalline inclusion complexes formed from 1,3,5-triaroylbenzene derivatives—a new family of inclusion hosts","Journal of the Chemical Society, Perkin Transactions 2","2000","","12","2458","","10.1039/b005702i","","","0.71073","MoKα","","0.1005","0.0546","","","0.1278","0.154","","","","","","1.013","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7213424","13.352","0.0002","12.0843","0.0002","15.0708","0.0002","90","","95.994","0.001","90","","2418.37","0.06","218","2","218","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C27 H15 N3 O9 -","- C27 H15 N3 O9 -","- C108 H60 N12 O36 -","4","1","","Pigge, F. Christopher; Ghasedi, Fatemeh; Zheng, Zhanmiao; Rath, Nigam P.; Nichols, Gary; Chickos, James S.","Structural characterization of crystalline inclusion complexes formed from 1,3,5-triaroylbenzene derivatives—a new family of inclusion hosts","Journal of the Chemical Society, Perkin Transactions 2","2000","","12","2458","","10.1039/b005702i","","","0.71073","MoKα","","0.0541","0.04","","","0.0975","0.1054","","","","","","1.035","","","","has coordinates","180465","2020-10-21","18:00:00",""
"7213425","10.781","0.002","11.994","0.003","12.33","0.003","79.69","0.02","81.95","0.02","78","0.03","1525.6","0.6","200","2","200","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H41 N3 O6 Si -","- C27 H41 N3 O6 Si -","- C54 H82 N6 O12 Si2 -","2","1","","Al-Sehemi, Abdullah G.; Atkinson, Robert S.; Fawcett, John; Russell, David R.","Stereoisomerism in 3-[N-(2-acetoxypropanoyl)-N-acylamino]quinazolin-4(3H )-ones, enantioselective acylating agents","Journal of the Chemical Society, Perkin Transactions 1","2000","","24","4413","","10.1039/b005814i","","","0.71073","MoKα","","0.1494","0.0699","","","0.1848","0.2251","","","","","","1.097","","","","has coordinates","180465","2020-10-21","18:00:00",""
"7213426","9.555","0.001","10.182","0.001","25.711","0.002","90","","98.75","0.01","90","","2472.3","0.4","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C30 H29 N P2 -","- C30 H29 N P2 -","- C120 H116 N4 P8 -","4","1","","Batsanov, Andrei S.; Davidson, Matthew G.; Fernández, Ignacio; Howard, Judith A. K.; López-Ortiz, Fernando; Price, Richard D.","One pot synthesis of a chiral N-phosphine substituted iminophosphorane: X-ray structure and in situ NMR study","Journal of the Chemical Society, Perkin Transactions 1","2000","","24","4237","","10.1039/b005816p","","","0.71073","MoKα","","0.1068","0.0622","","0.1336","0.1055","","","","1.138","1.192","1.192","","","","","has coordinates","180465","2020-10-21","18:00:00",""
"7213427","12.9858","0.0004","11.7576","0.0003","25.6292","0.0008","90","","90","","90","","3913.1","0.2","180","2","180","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C20 H28 B N O4 -","- C20 H28 B N O4 -","- C160 H224 B8 N8 O32 -","8","1","","Green, Stuart; Nelson, Adam; Warriner, Stuart; Whittaker, Benjamin","Synthesis and investigation of the configurational stability of some dimethylammonium borate salts","Journal of the Chemical Society, Perkin Transactions 1","2000","","24","4403","","10.1039/b005954o","","","1.54184","CuKα","","0.0582","0.0415","","","0.0991","0.1098","","","","","","1.086","","","","has coordinates,has disorder","180465","2020-10-21","18:00:00",""
"7213430","9.538","0.002","16.348","0.004","8.395","0.002","90","","90","","90","","1309","0.5","123","","123","","","","","","","","ether/ pet. ether solution","3","P 21 21 21","P 2ac 2ab","19","","","","- C17 H18 O2 -","- C17 H18 O2 -","- C68 H72 O8 -","4","1","","Kennedy, Alan R.; Kerr, William J.; Lindsay, David M.; Scott, James S.; Watson, Stephen P.","Stereochemical and mechanistic features of asymmetric Pauson‒Khand processes","Journal of the Chemical Society, Perkin Transactions 1","2000","","24","4366","","10.1039/b006523o","","","0.71069","MoKα","","0.0518","0.0363","","0.0448","0.0429","","","","","1.525","1.525","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213431","9.537","0.003","10.64","0.004","27.931","0.011","90.85","0.02","92.16","0.02","89.99","0.02","2831.9","1.8","200","2","200","2","","","","","","","","5","P -1","-P 1","2","NORBORNADIEN EXO","","","- C35 H39 Cl18 N9 Sb2 -","- C36 H24 Cl18 N8 Sb2 -","- C72 H48 Cl36 N16 Sb4 -","2","1","","Wirschun, Wolfgang G.; Al-Soud, Yaseen A.; Nusser, Konstanze A.; Orama, Olli; Maier, Gerd-Michael; Jochims, Johannes C.","Cycloadditions of 1-aza-2-azoniaallene ions to alkenes","Journal of the Chemical Society, Perkin Transactions 1","2000","","24","4356","","10.1039/b006525k","","","0.71069","MoKα","","0.072","0.057","","0.3901","0.1558","","","","1.07","0.99","0.99","","","","","has coordinates","180465","2020-10-21","18:00:00",""
"7213432","6.423","0.003","11.868","0.003","14.006","0.003","90","","93.3","0.03","90","","1065.9","0.6","173.2","","173.2","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C21 H30 O5 Si -","- C21 H30 O5 Si -","- C42 H60 O10 Si2 -","2","1","","Banwell, Martin; Hockless, David; Jarrott, Bevyn; Kelly, Brian; Knill, Andrew; Longmore, Robert; Simpson, Gregory","Chemoenzymatic approaches to the decahydro-as-indacene cores associated with the spinosyn class of insecticide","Journal of the Chemical Society, Perkin Transactions 1","2000","","21","3555","","10.1039/b006759h","","","1.5418","CuKα","","0.0973","0.0551","","0.0538","","0.0501","","","1.964","","","2.227","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213433","21.2325","0.0006","12.0459","0.0005","18.7578","0.0008","90","","91.173","0.002","90","","4796.6","0.3","173","2","173","2","","","","","","","synthesis as described","3","P 1 21/c 1","-P 2ybc","14","[C60F17(CF3)].2(toluene)]","","","- C75 H16 F20 -","- C74.09 H9.35 Cl0.26 F20 -","- C296.36 H37.4 Cl1.04 F80 -","4","1","","Boltalina, Olga V.; Hitchcock, Peter B.; Troshin, Pavel A.; Street, Joan M.; Taylor, Roger","Isolation and spectroscopic characterisation of C60F17CF2CF3 and isomers of C60F17CF3; insertion of :CF2 into fluorofullerene C‒F bonds","Journal of the Chemical Society, Perkin Transactions 2","2000","","12","2410","","10.1039/b006890j","","x-ray","0.71073","MoKα","","0.1034","0.0661","","","0.1591","0.1829","","","","","","1.024","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7213436","8.6255","0.0003","9.9353","0.0004","22.5592","0.0007","90","","90","","90","","1933.25","0.12","160","2","160","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C24 H27 N -","- C24 H27 N -","- C96 H108 N4 -","4","1","","Wyatt, Paul; Butts, Craig P.; Patel, Vipulkumar; Voysey, Ben","Synthesis of the novel amine (R*,R*,R*)-tris(α-methylbenzyl)amine. X-Ray crystal structures of racemic and enantiomerically pure forms","Journal of the Chemical Society, Perkin Transactions 1","2000","","24","4222","","10.1039/b007710k","","","1.54184","CuKα","","0.0322","0.0311","","","0.0809","0.0827","","","","","","1.05","","","","has coordinates","180465","2020-10-21","18:00:00",""
"7213437","11.522","0.002","11.522","0.002","50.079","0.009","90","","90","","120","","5757.6","1.8","173","2","173","2","","","","","","","","3","R -3 :H","-R 3","148","","","","- C24 H27 N -","- C24 H27 N -","- C288 H324 N12 -","12","0.666667","","Wyatt, Paul; Butts, Craig P.; Patel, Vipulkumar; Voysey, Ben","Synthesis of the novel amine (R*,R*,R*)-tris(α-methylbenzyl)amine. X-Ray crystal structures of racemic and enantiomerically pure forms","Journal of the Chemical Society, Perkin Transactions 1","2000","","24","4222","","10.1039/b007710k","","","0.71073","MoKα","","0.0744","0.0443","","0.1156","0.1012","","","","1.024","1.093","1.093","","","","","has coordinates","180465","2020-10-21","18:00:00",""
"7221038","5.771","","5.7801","","8.164","","90","","90.2","","90","","272.325","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Sr2 Ho Ru O6","","- Ho O6 Ru Sr2 -","- Ho O6 Ru Sr2 -","- Ho2 O12 Ru2 Sr4 -","2","0.5","","Doi, Y.; Hinatsu, Y.; Shimojo, Y.; Oikawa, K.; Morii, Y.","Magnetic and neutron diffraction study on the ordered perovskite Sr2 Ho Ru O6","Journal of Materials Chemistry","2000","10","","797","800","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221041","6.807","","11.714","","12.665","","90","","101.6","","90","","989.245","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Cs (Nb6 Cl10 O2) Cl2","","- Cl12 Cs Nb6 O2 -","- Cl12 Cs0.992 Nb6 O2 -","- Cl24 Cs1.984 Nb12 O4 -","2","0.5","","Gulo, F.; Perrin, C.","The crystal structure of Cs Nb6 Cl12 O2, a novel niobium cluster oxychloride with interconnected Nb6 Cl14 O4 units","Journal of Materials Chemistry","2000","10","","1721","1724","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221043","3.8495","","3.8495","","15.3927","","90","","90","","90","","228.099","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","Cs La2 (Ti2 Nb O10)","","- Cs La2 Nb O10 Ti2 -","- Cs La2 Nb O10 Ti2 -","- Cs La2 Nb O10 Ti2 -","1","0.0625","","Hong, Y.-S.; Kim, S.-J.; Choy, J.-H.","B-site cation arrangement and crystal structure of layered perovskite compounds Cs Ln2 Ti2 Nb O10 (Ln = La, Pr, Nd, Sm) and CsCa La Ti Nb2 O10","Journal of Materials Chemistry","2000","10","","1209","1214","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221044","3.869","","3.869","","15.235","","90","","90","","90","","228.055","","","","","","","","","","","","","6","P 4/m m m","-P 4 2","123","","Cs (Ca La) (Ti Nb2 O10)","","- Ca Cs La Nb2 O10 Ti -","- Ca Cs La Nb2 O10 Ti -","- Ca Cs La Nb2 O10 Ti -","1","0.0625","","Hong, Y.-S.; Kim, S.-J.; Choy, J.-H.","B-site cation arrangement and crystal structure of layered perovskite compounds Cs Ln2 Ti2 Nb O10 (Ln = La, Pr, Nd, Sm) and Cs Ca La Ti Nb2 O10","Journal of Materials Chemistry","2000","10","","1209","1214","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221045","3.8376","","3.8376","","15.3015","","90","","90","","90","","225.348","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","Cs Pr2 (Ti2 Nb O10)","","- Cs Nb O10 Pr2 Ti2 -","- Cs Nb O10 Pr2 Ti2 -","- Cs Nb O10 Pr2 Ti2 -","1","0.0625","","Hong, Y.-S.; Kim, S.-J.; Choy, J.-H.","B-site cation arrangement and crystal structure of layered perovskite compounds Cs Ln2 Ti2 Nb O10 (Ln = La, Pr, Nd, Sm) and Cs Ca La Ti Nb2 O10","Journal of Materials Chemistry","2000","10","","1209","1214","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221046","3.8319","","3.8319","","15.2764","","90","","90","","90","","224.31","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","Cs Nd2 (Ti2 Nb O10)","","- Cs Nb Nd2 O10 Ti2 -","- Cs Nb Nd2 O10 Ti2 -","- Cs Nb Nd2 O10 Ti2 -","1","0.0625","","Hong, Y.-S.; Kim, S.-J.; Choy, J.-H.","B-site cation arrangement and crystal structure of layered perovskite compounds Cs Ln2 Ti2 Nb O10 (Ln = La, Pr, Nd, Sm) and Cs Ca La Ti Nb2 O10","Journal of Materials Chemistry","2000","10","","1209","1214","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221047","3.8195","","3.8195","","15.2371","","90","","90","","90","","222.288","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","Cs Sm2 (Ti2 Nb O10)","","- Cs Nb O10 Sm2 Ti2 -","- Cs Nb O10 Sm2 Ti2 -","- Cs Nb O10 Sm2 Ti2 -","1","0.0625","","Hong, Y.-S.; Kim, S.-J.; Choy, J.-H.","B-site cation arrangement and crystal structure of layered perovskite compounds Cs Ln2 Ti2 Nb O10 (Ln = La, Pr, Nd, Sm) and Cs Ca La Ti Nb2 O10","Journal of Materials Chemistry","2000","10","","1209","1214","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221067","15.875","","15.875","","20.752","","90","","90","","120","","4529.16","","","","","","","","","","","","","2","R 3 :H","R 3","146","","H3 (P Mo12 O40)","","- Mo12 P -","- Mo12 P -","- Mo72 P6 -","6","0.666667","","Marosi, L.; Escalona Platero, E.; Cifre, J.; Otero Arean, C.","Thermal dehydration of H3+x P Vx M12-x O40 . y(H2 O) Keggin type heteropolyacids; formation, thermal stability and structure of the anhydrous acids H3 P M12 O40, of the corresponding anhydrides P M12 O38.5 and of a novel trihydrate H3 P W12 O40","Journal of Materials Chemistry","2000","10","","1949","1955","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221068","11.75","","11.75","","11.75","","90","","90","","90","","1622.23","","","","","","","","","","","","","4","P n -3 m :2","-P 4bc 2bc 3","224","","H3 (P W12 O40) (H2 O)3","","- H9 O43 P W12 -","- O43 P W12 -","- O86 P2 W24 -","2","0.0416667","","Marosi, L.; Otero Arean, C.; Escalona Platero, E.; Cifre, J.","Thermal dehydration of H3+x P Vx M12-x O40 . y(H2 O) Keggin type heteropolyacids; formation, thermal stability and structure of the anhydrous acids H3 P M12 O40, of the corresponding anhydrides P M12 O38.5 and of a novel trihydrate H3 P W12 O40","Journal of Materials Chemistry","2000","10","","1949","1955","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221069","16.5779","","9.8223","","13.8562","","90","","90","","90","","2256.25","","","","","","","","","","","","","7","P n a 21","P 2c -2n","33","","(Ga16 P16 O60 (O H)2 F6 O4) (H2 ((C H3)2 N) (C H2)3 (N (C H3)2))4","","- C28 H82 F6 Ga16 N8 O66 P16 -","- C28 F6 Ga16 N8 O66 P16 -","- C28 F6 Ga16 N8 O66 P16 -","1","0.25","","Matijasic, A.; Patarin, J.; Paillaud, J.L.","Synthesis, characterisation and structure determination of Mu-15: anew fluorogallophosphate with fluoride as a specific template of the D4R units","Journal of Materials Chemistry","2000","10","","1345","1351","","","","","","","","","","","","","","","","","","","","","","has coordinates","141047","2020-10-21","18:00:00",""
"7221070","8.608","","12.215","","8.929","","90","","90","","90.76","","938.772","","","","","","","","","","","","","4","P 1 1 21/n","-P 2n","14","","Li3 Fe2 (As O4)3","","- As3 Fe2 Li3 O12 -","- As3 Fe2 Li3 O12 -","- As12 Fe8 Li12 O48 -","4","1","","Mesa, J.L.; Moreno, N.O.; Goni, A.; Brandl, A.L.; Barberis, G.E.; Rojo, T.","Structure and magnetic properties of Li3 Fe2 (As O4)3-x (P O4)x (x=0, 1, 1.5, 2): two sublattice weak ferromagnets","Journal of Materials Chemistry","2000","10","","2779","2785","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7221071","15.777","","4.1669","","17.358","","90","","99.249","","90","","1126.3","","","","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","K0.66 Sn4.82 Bi11.18 Se22","","- Bi11.18 K0.66 Se22 Sn4.82 -","- Bi11.18 K0.66 Se22 Sn4.82 -","- Bi11.18 K0.66 Se22 Sn4.82 -","1","0.25","","Mrotzek, A.; Chung, D.-Y.; Hogan, T.; Kanatzidis, M.G.","Structure and thermoelectric properties of the new quaternary tin selenide K1-x Sn5-x Bi11+x Se22","Journal of Materials Chemistry","2000","10","","1667","1672","","","","","","","","","","","","","","","","","","","","","","has coordinates","141087","2020-10-21","18:00:00",""
"7221080","8.1379","","8.1379","","8.1379","","90","","90","","90","","538.936","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","Li2 Co Mn3 O8","","- Co Li2 Mn3 O8 -","- Co Li2 Mn3 O8 -","- Co4 Li8 Mn12 O32 -","4","0.0208333","","Strobel, P.; Ibarra Palos, A.; Anne, M.; le Cras, F.","Structural, magnetic and lithium insertion properties of spinel-type Li2 Mn3 M O8 oxides (M= Mg, Co, Ni, Cu)","Journal of Materials Chemistry","2000","10","","429","436","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221081","8.1888","","8.1888","","8.1888","","90","","90","","90","","549.112","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","Li2 Cu Mn3 O8","","- Cu Li2 Mn3 O8 -","- Cu Li2 Mn3 O8 -","- Cu4 Li8 Mn12 O32 -","4","0.0208333","","Strobel, P.; Ibarra Palos, A.; Anne, M.; le Cras, F.","Structural, magnetic and lithium insertion properties of spinel-type Li2 Mn3 M O8 oxides (M = Mg, Co, Ni, Cu)","Journal of Materials Chemistry","2000","10","","429","436","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221098","7.9734","","7.9734","","13.8178","","90","","90","","90","","878.468","","","","","","","","","","","","","4","I 4/m c m","-I 4 2c","140","","","","- Ba La2 Mn S5 -","- Ba La2 Mn S5 -","- Ba4 La8 Mn4 S20 -","4","0.125","","Wakeshima, M.; Hinatsu, Y.; Oikawa, K.; Shimojo, Y.; Morii, Y.","Crystal and magnetic structure of the antiferromagnetic manganese sulfide Ba La2 Mn S5 by powder neutron diffraction measurements","Journal of Materials Chemistry","2000","10","","2183","2185","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"7221099","3.83382","","3.83382","","28.52129","","90","","90","","90","","419.211","","","","","","","","","","","","","6","I 4/m m m","-I 4 2","139","","Ru Sr2 (Gd1.3 Ce0.7) Cu2 O9.8","","- Ce0.7 Cu2 Gd1.3 O9.8 Ru Sr2 -","- Ce0.7 Cu2 Gd1.3 O9.8 Ru Sr2 -","- Ce1.4 Cu4 Gd2.6 O19.6 Ru2 Sr4 -","2","0.0625","","Knee, C.S.; Rainford, B.D.; Weller, M.T.","Crystal structure of the ferromagnetic superconductor Ru Sr2 (Gd1.3 Ce0.7) Cu2 O10-d by powder neutron diffraction","Journal of Materials Chemistry","2000","10","","2445","2447","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221100","3.84237","","3.84237","","28.58029","","90","","90","","90","","421.954","","","","","","","","","","","","","6","I 4/m m m","-I 4 2","139","","Ru Sr2 (Gd1.3 Ce0.7) Cu2 O9.74","","- Ce0.7 Cu2 Gd1.3 O9.74 Ru Sr2 -","- Ce0.7 Cu2 Gd1.3 O9.74 Ru Sr2 -","- Ce1.4 Cu4 Gd2.6 O19.48 Ru2 Sr4 -","2","0.0625","","Knee, C.S.; Rainford, B.D.; Weller, M.T.","Crystal structure of the ferromagnetic superconductor Ru Sr2 (Gd1.3 Ce0.7) Cu2 O10-d by powder neutron diffraction","Journal of Materials Chemistry","2000","10","","2445","2447","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221101","22.058","","3.6078","","9.3619","","90","","90","","90","","745.028","","","","","","","","","","","","","4","P c m n","-P 2n 2ac","62","","Na1.29 (V3 O8) (H2 O)0.64","","- H1.28 Na1.29 O8.64 V3 -","- Na1.29 O8.64 V3 -","- Na5.16 O34.56 V12 -","4","0.5","","Legagneur, V.; le Gal la Salle, A.; Verbaere, A.; Guyomard, D.; Piffard, Y.","New layered vanadium oxides My H1-y V3 O8 . n(H2 O) (M = Li, Na, K)obtained by oxidation of the precursor H2 V3 O8","Journal of Materials Chemistry","2000","10","","2805","2810","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7221103","6.4655","","11.545","","12.9333","","90","","105.04","","90","","932.326","","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(Na0.5 K0.5) K (Sn Si3 O9) (H2 O)","","- H2 K1.5 Na0.5 O10 Si3 Sn -","- K1.5 Na0.5 O10 Si3 Sn -","- K6 Na2 O40 Si12 Sn4 -","4","1","","Lin, Z.; Rocha, J.; Pedrosa de Jesus, J.D.; Ferreira, A.","Synthesis and structure of a novel microporous framework stannosilicate","Journal of Materials Chemistry","2000","10","","1353","1356","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221104","11.739","","11.739","","11.739","","90","","90","","90","","1617.68","","","","","","","","","","","","","5","F m -3 m","-F 4 2 3","225","","Th Er2 F10 (H2 O)","","- Er2 F10 H2 O Th -","- Er2.001 F10 O Th0.999 -","- Er16.008 F80 O8 Th7.992 -","8","0.0416667","","le Berre, F.; Boucher, E.; Allain, M.; Courbion, G.","Synthesis, stability and zeolitic behaviour of delta-(A Ln3 F10).x(H2 O) and gamma-(Th Ln2 F10).(H2 O) phases (Ln=lanthanide)","Journal of Materials Chemistry","2000","10","","2578","2586","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221277","9.7405","","9.7405","","7.004","","90","","90","","120","","575.492","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Ca10 (V O4)6 (O H)2","","- Ca10 H2 O26 V6 -","- Ca10 O26 V6 -","- Ca10 O26 V6 -","1","0.0833333","","Bauer Boechat, C.; Eon, J.G.; da Silva San Gil, R.A.; Malta Rossi, A.; de Castro Perez, C.A.","Structure of vanadate in calcium phosphate and vanadate apatite solid solutions","Physical Chemistry Chemical Physics","2000","2","","4225","4230","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221319","24.027","","7.346","","21.572","","90","","104.52","","90","","3685.9","","","","","","","","","","","","","3","I 1 2/a 1","-I 2ya","15","","Na4 (Ti Se4)","","- Na4 Se4 Ti -","- Na4 Se4 Ti -","- Na64 Se64 Ti16 -","16","2","","Klepp, K.O.","Preparation and crystal structure of Na4 Ti Se4. A selenotitanate with discrete tetrahedral atoms","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2000","55","","39","44","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222642","9.163","","9.163","","25.014","","90","","90","","120","","1818.82","","","","","","","","","","","","","4","R -3 :H","-R 3","148","","Rb1.13 Ti (Nb6 Cl18)","","- Cl18 Nb6 Rb1.13 Ti -","- Cl18 Nb6 Rb1.128 Ti -","- Cl54 Nb18 Rb3.384 Ti3 -","3","0.166667","","Naegele, A.; Anokhina, E.V.; Sitar, J.; Lachgar, A.; Meyer, H.J.","Synthesis and crystal structures of A Ti (Nb6 Cl18) compounds (A= Cs, Rb, K, In, Tl)","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2000","55","","139","144","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7223708","7.6764","","11.543","","13.386","","90","","99.169","","90","","1170.96","","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Cs (B (C F3)3 N2 (C F3))","","- C4 B Cs F12 N2 -","- C4 B Cs F12 N2 -","- C16 B4 Cs4 F48 N8 -","4","1","","Brauer, D.J.; Pawelke, G.; Buerger, H.; Chebude, Y.","A diazenidoborate: formation and structure of Cs ((C F3)3 B N=N C F3)","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2000","55","","269","272","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7238072","7.884","0.0005","12.514","0.001","14.297","0.001","90","0","90","0","90","0","1410.55","0.17","298","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(3R^*^,1'S^*^)-2-(1'-hydroxy-1',2'-dihydrobenzocyclobuten-1'-yl)-2,4-dimethyl- pentan-3-ol","","- C15 H22 O2 -","- C15 H22 O2 -","- C60 H88 O8 -","4","1","","Kawata, Etsuya; Saito, Masaichi; Yoshioka, Michikazu","Thermal reaction of diastereomeric benzocyclobutenols. Evidence for reversible opening of 1,2-dihydrobenzocyclobutenols to hydroxy-o-xylylenes","Journal of the Chemical Society, Perkin Transactions 1","2000","","6","1015","","10.1039/a908326j","","","0.71073","MoKa","","","0.049","","","","0.062","","","","","","1.276","","","","has coordinates","243864","2020-10-21","18:00:00",""
"7238073","11.308","0.002","9.46","0.001","13.187","0.001","90","0","96.191","0.008","90","0","1402.4","0.3","298","","","","","","","","","","","3","P 1 21 1 (a,b,c-1/4)","P 2ybc","4","","(2S^*^,1'S^*^)-2-Acetoxy-3-(1'-hydroxy-1',2'-dihydrobenzocyclobuten-1'-yl)-3 -methylbutane","","- C15 H20 O3 -","- C7.5 H10 O1.5 -","- C30 H40 O6 -","4","","","Kawata, Etsuya; Saito, Masaichi; Yoshioka, Michikazu","Thermal reaction of diastereomeric benzocyclobutenols. Evidence for reversible opening of 1,2-dihydrobenzocyclobutenols to hydroxy-o-xylylenes","Journal of the Chemical Society, Perkin Transactions 1","2000","","6","1015","","10.1039/a908326j","","","0.71073","MoKa","","","0.053","","","","0.067","","","","","","1.604","","","","has coordinates","243864","2020-10-21","18:00:00",""
"7238074","10.106","0.001","25.218","0.002","12.298","0.002","90","0","90.176","0.005","90","0","3134.2","0.6","298","","","","","","","","","","","3","P 1 21 1 (a,b,c-1/4)","P 2ybc","4","","(3S^*^,1'R^*^)-3-Acetoxy-2-(1'-hydroxy-1',2'-dihydrobenzocyclobuten-1'-yl)-2 ,4-dimethylpentane","","- C17 H24 O3 -","- C8.5 H12 O1.5 -","- C68 H96 O12 -","8","","","Kawata, Etsuya; Saito, Masaichi; Yoshioka, Michikazu","Thermal reaction of diastereomeric benzocyclobutenols. Evidence for reversible opening of 1,2-dihydrobenzocyclobutenols to hydroxy-o-xylylenes","Journal of the Chemical Society, Perkin Transactions 1","2000","","6","1015","","10.1039/a908326j","","","0.71073","MoKa","","","0.054","","","","0.071","","","","","","2.364","","","","has coordinates","243864","2020-10-21","18:00:00",""
"7238075","15.217","0.006","33.919","0.009","7.85","0.01","90","","90","","90","","4052","6","293.2","","293.2","","","","","","","","","4","P c c n","-P 2ab 2ac","56","","","","- C24 H14 O2 S4 -","- C24 H14 O2 S4 -","- C192 H112 O16 S32 -","8","1","","Tanaka, Kazuhiko; Osuga, Hideji; Kitahara, Yoshinori","Clathrate formation by and self-assembled supramolecular structures of a “molecular spring”","Journal of the Chemical Society, Perkin Transactions 2","2000","","12","2492","","10.1039/b005070i","","","1.5418","CuKα","","","0.0851","","","0.1106","","","","","1.411","1.411","","","","","has coordinates","243869","2020-10-21","18:00:00",""
"7238076","11.4866","0.0009","11.4866","0.0009","15.493","0.003","90","","90","","90","","2044.2","0.5","298.2","","298.2","","","","","","","","","4","P 43","P 4cw","78","","","","- C24 H14 O2 S4 -","- C24 H14 O2 S4 -","- C96 H56 O8 S16 -","4","1","","Tanaka, Kazuhiko; Osuga, Hideji; Kitahara, Yoshinori","Clathrate formation by and self-assembled supramolecular structures of a “molecular spring”","Journal of the Chemical Society, Perkin Transactions 2","2000","","12","2492","","10.1039/b005070i","","","1.5418","CuKα","","","0.0322","","","0.0515","","","","","1.34","1.34","","","","","has coordinates","243869","2020-10-21","18:00:00",""
"7238077","8.612","0.002","29.042","0.003","18.387","0.003","90","","101.77","0.02","90","","4502.1","1.4","299.2","","299.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C25 H16 Cl O2 S4 -","- C25 H16 Cl O2 S4 -","- C200 H128 Cl8 O16 S32 -","8","2","","Tanaka, Kazuhiko; Osuga, Hideji; Kitahara, Yoshinori","Clathrate formation by and self-assembled supramolecular structures of a “molecular spring”","Journal of the Chemical Society, Perkin Transactions 2","2000","","12","2492","","10.1039/b005070i","","","1.5418","CuKα","","","0.0535","","","0.0472","","","","","2.78","2.78","","","","","has coordinates","243869","2020-10-21","18:00:00",""
"7238078","9.724","0.001","17.123","0.002","11.515","0.001","90","","103.278","0.009","90","","1866","0.3","293.2","","293.2","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C43 H42 O4 S4 -","- C43 H36 O4 S4 -","- C86 H72 O8 S8 -","2","1","","Tanaka, Kazuhiko; Osuga, Hideji; Kitahara, Yoshinori","Clathrate formation by and self-assembled supramolecular structures of a “molecular spring”","Journal of the Chemical Society, Perkin Transactions 2","2000","","12","2492","","10.1039/b005070i","","","1.5418","CuKα","","","0.0434","","","0.0678","","","","","1.39","1.39","","","","","has coordinates","243869","2020-10-21","18:00:00",""
"7238079","10.715","0.002","11.387","0.0007","8.308","0.002","93.3","0.01","105.42","0.02","89.685","0.009","975.5","0.3","289.2","","289.2","","","","","","","","","3","P -1","-P 1","2","","","","- C24 H14 S4 -","- C24 H14 S4 -","- C48 H28 S8 -","2","1","","Tanaka, Kazuhiko; Osuga, Hideji; Kitahara, Yoshinori","Clathrate formation by and self-assembled supramolecular structures of a “molecular spring”","Journal of the Chemical Society, Perkin Transactions 2","2000","","12","2492","","10.1039/b005070i","","","1.5418","CuKα","","","0.0399","","","0.0739","","","","","1.557","1.557","","","","","has coordinates","243869","2020-10-21","18:00:00",""
"7702433","20.517","0.002","27.241","0.003","15.7733","0.0017","90","","90","","90","","8815.8","1.6","158","2","158","2","","","","","","","","7","P b c n","-P 2n 2ab","60","","","","- C31 H41.5 Cl2 N4 Ni2 O8.75 S2 -","- C31 H41.5 Cl2 N4 Ni2 O8.75 S2 -","- C248 H332 Cl16 N32 Ni16 O70 S16 -","8","1","","Brooker, Sally; Caygill, Graham B.; Croucher, Paul D.; Davidson, Tony C.; Clive, Derrick L. J.; Magnuson, Stephen R.; Cramer, Stephen P.; Ralston, Corie Y.","Conversion of some substituted phenols to the corresponding masked thiophenols, synthesis of a dinickel(II) dithiolate macrocyclic complex and isolation of some metal- and ligand-based oxidation products","Journal of the Chemical Society, Dalton Transactions","2000","","18","3113","","10.1039/b004214p","","","0.71073","MoKα","","0.1927","0.1374","","","0.3812","0.4096","","","","","","1.173","","","","has coordinates,has disorder","243866","2020-10-21","18:00:00",""
"7702434","11.854","0.007","15.45","0.007","25.559","0.014","90","","91.291","0.01","90","","4680","4","183","2","183","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C26 H30 I12 N4 S2 -","- C26 H30 I12 N4 S2 -","- C104 H120 I48 N16 S8 -","4","0.5","","Brooker, Sally; Caygill, Graham B.; Croucher, Paul D.; Davidson, Tony C.; Clive, Derrick L. J.; Magnuson, Stephen R.; Cramer, Stephen P.; Ralston, Corie Y.","Conversion of some substituted phenols to the corresponding masked thiophenols, synthesis of a dinickel(II) dithiolate macrocyclic complex and isolation of some metal- and ligand-based oxidation products","Journal of the Chemical Society, Dalton Transactions","2000","","18","3113","","10.1039/b004214p","","","0.71073","MoKα","","0.1144","0.0645","","","0.1587","0.1854","","","","","","1.04","","","","has coordinates","243866","2020-10-21","18:00:00",""
"7702435","8.9104","0.0019","9.1521","0.0019","12.172","0.003","70.605","0.003","85.336","0.003","68.074","0.003","867.5","0.3","168","2","168","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H30 I6 N4 S2 -","- C26 H30 I6 N4 S2 -","- C26 H30 I6 N4 S2 -","1","0.5","","Brooker, Sally; Caygill, Graham B.; Croucher, Paul D.; Davidson, Tony C.; Clive, Derrick L. J.; Magnuson, Stephen R.; Cramer, Stephen P.; Ralston, Corie Y.","Conversion of some substituted phenols to the corresponding masked thiophenols, synthesis of a dinickel(II) dithiolate macrocyclic complex and isolation of some metal- and ligand-based oxidation products","Journal of the Chemical Society, Dalton Transactions","2000","","18","3113","","10.1039/b004214p","","","0.71073","MoKα","","0.0346","0.0284","","","0.0692","0.0715","","","","","","1.093","","","","has coordinates","243866","2020-10-21","18:00:00",""
"7702436","25.0993","0.0016","10.9758","0.0007","17.1135","0.0011","90","","122.574","0.001","90","","3972.9","0.4","158","2","158","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C32 H40 F6 N4 Ni2 O7 S4 -","- C32 H40 F6 N4 Ni2 O7 S4 -","- C128 H160 F24 N16 Ni8 O28 S16 -","4","0.5","","Brooker, Sally; Caygill, Graham B.; Croucher, Paul D.; Davidson, Tony C.; Clive, Derrick L. J.; Magnuson, Stephen R.; Cramer, Stephen P.; Ralston, Corie Y.","Conversion of some substituted phenols to the corresponding masked thiophenols, synthesis of a dinickel(II) dithiolate macrocyclic complex and isolation of some metal- and ligand-based oxidation products","Journal of the Chemical Society, Dalton Transactions","2000","","18","3113","","10.1039/b004214p","","","0.71073","MoKα","","0.0446","0.0361","","","0.0917","0.0959","","","","","","1.034","","","","has coordinates,has disorder","243866","2020-10-21","18:00:00",""
"7702437","21.884","0.006","9.948","0.003","18.441","0.005","90","","117.713","0.003","90","","3554.1","1.7","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C30 H40 N8 Ni2 O8 S2 -","- C30 H40 N8 Ni2 O8 S2 -","- C120 H160 N32 Ni8 O32 S8 -","4","0.5","","Brooker, Sally; Caygill, Graham B.; Croucher, Paul D.; Davidson, Tony C.; Clive, Derrick L. J.; Magnuson, Stephen R.; Cramer, Stephen P.; Ralston, Corie Y.","Conversion of some substituted phenols to the corresponding masked thiophenols, synthesis of a dinickel(II) dithiolate macrocyclic complex and isolation of some metal- and ligand-based oxidation products","Journal of the Chemical Society, Dalton Transactions","2000","","18","3113","","10.1039/b004214p","","","0.71073","MoKα","","0.0416","0.0255","","","0.0582","0.0602","","","","","","0.931","","","","has coordinates","243866","2020-10-21","18:00:00",""
"7702440","8.1339","0.0002","15.9462","0.0005","13.365","0.0004","90","","95.52","0.002","90","","1725.47","0.09","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Ru(H2dcbpy)(CO)2Cl2.(H2O)","","","- C14 H10 Cl2 N2 O7 Ru -","- C14 H10 Cl2 N2 O7 Ru -","- C56 H40 Cl8 N8 O28 Ru4 -","4","1","","Eskelinen, Esa; Luukkanen, Saija; Haukka, Matti; Ahlgrén, Markku; Pakkanen, Tapani A.","Redox and photochemical behaviour of ruthenium(II) complexes with H2dcbpy ligand (H2dcbpy = 2,2′-bipyridine-4,4′-dicarboxylic acid)","Journal of the Chemical Society, Dalton Transactions","2000","","16","2745","","10.1039/b004751l","","","0.71073","MoKα","","0.0763","0.038","","","0.063","0.0711","","","","","","1.01","","","","has coordinates","243868","2020-10-21","18:00:00",""
"7702441","10.141","0.0002","18.2804","0.0006","21.0357","0.0007","90","","100.998","0.002","90","","3828","0.2","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Ru(H2dcbpy)2(dcbpy).6(H2O)","","","- C36 H34 N6 O18 Ru -","- C36 H34 N6 O18 Ru -","- C144 H136 N24 O72 Ru4 -","4","1","","Eskelinen, Esa; Luukkanen, Saija; Haukka, Matti; Ahlgrén, Markku; Pakkanen, Tapani A.","Redox and photochemical behaviour of ruthenium(II) complexes with H2dcbpy ligand (H2dcbpy = 2,2′-bipyridine-4,4′-dicarboxylic acid)","Journal of the Chemical Society, Dalton Transactions","2000","","16","2745","","10.1039/b004751l","","","0.71073","MoKα","","0.0735","0.0458","","","0.1069","0.1229","","","","","","1.076","","","","has coordinates","243868","2020-10-21","18:00:00",""
"7702442","22.1485","0.0003","18.7892","0.0003","21.4865","0.0002","90","","118.593","0.001","90","","7851.15","0.19","150","2","150","2","","","","","","","","6","C 1 c 1","C -2yc","9","(Ru(H2dcbpy))Cl2.2 3/4H2O","","","- C36 H29.5 Cl2 N6 O14.75 Ru -","- C36 H29.5 Cl2 N6 O14.75 Ru -","- C288 H236 Cl16 N48 O118 Ru8 -","8","2","","Eskelinen, Esa; Luukkanen, Saija; Haukka, Matti; Ahlgrén, Markku; Pakkanen, Tapani A.","Redox and photochemical behaviour of ruthenium(II) complexes with H2dcbpy ligand (H2dcbpy = 2,2′-bipyridine-4,4′-dicarboxylic acid)","Journal of the Chemical Society, Dalton Transactions","2000","","16","2745","","10.1039/b004751l","","","0.71073","MoKα","","0.0265","0.0249","","","0.0624","0.0634","","","","","","1.041","","","","has coordinates","243868","2020-10-21","18:00:00",""
"7702443","12.1882","0.0002","11.2737","0.0001","19.815","0.0003","90","","106.01","0.001","90","","2617.1","0.06","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Ru(H2dcbpy)2Br2.(H2O)","","","- C24 H17 Br2 N4 O9 Ru -","- C24 H17 Br2 N4 O9 Ru -","- C96 H68 Br8 N16 O36 Ru4 -","4","1","","Eskelinen, Esa; Luukkanen, Saija; Haukka, Matti; Ahlgrén, Markku; Pakkanen, Tapani A.","Redox and photochemical behaviour of ruthenium(II) complexes with H2dcbpy ligand (H2dcbpy = 2,2′-bipyridine-4,4′-dicarboxylic acid)","Journal of the Chemical Society, Dalton Transactions","2000","","16","2745","","10.1039/b004751l","","","0.71073","MoKα","","0.034","0.0274","","","0.0663","0.07","","","","","","1.05","","","","has coordinates","243868","2020-10-21","18:00:00",""
"7702444","3.7891","0.0012","8.0997","0.0016","15.421","0.004","90","","93.96","0.03","90","","472.1","0.2","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","2.7-diazapyrene","2,7-Diazapyrene","","- C14 H8 N2 -","- C14 H8 N2 -","- C28 H16 N4 -","2","0.5","","Blake, Alexander J.; Baum, Gerhard; Champness, Neil R.; Chung, Simon S. M.; Cooke, Paul A.; Fenske, Dieter; Khlobystov, Andrei N.; Lemenovskii, Dmitrii A.; Li, Wan-Sheung; Schröder, Martin","Long-range chain orientation in 1-D co-ordination polymers as a function of anions and intermolecular aromatic interactions","Journal of the Chemical Society, Dalton Transactions","2000","","23","4285","","10.1039/b006202m","","","0.71073","MoKα","","0.0484","0.0366","","","0.09","0.1002","","","","","","1.1","","","","has coordinates","243870","2020-10-21","18:00:00",""
"7702445","18.47","0.001","3.748","0.012","16.667","0.005","90","","90","","90","","1154","4","150","2","150","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","[Ag(2,7-diazapyrene)]NO3","(2,7-Diazapyrene)nitratosilver(I)","","- C28 H16 Ag2 N6 O6 -","- C28 H16 Ag2 N6 O6 -","- C56 H32 Ag4 N12 O12 -","2","0.25","","Blake, Alexander J.; Baum, Gerhard; Champness, Neil R.; Chung, Simon S. M.; Cooke, Paul A.; Fenske, Dieter; Khlobystov, Andrei N.; Lemenovskii, Dmitrii A.; Li, Wan-Sheung; Schröder, Martin","Long-range chain orientation in 1-D co-ordination polymers as a function of anions and intermolecular aromatic interactions","Journal of the Chemical Society, Dalton Transactions","2000","","23","4285","","10.1039/b006202m","","","0.71073","MoKα","","0.0438","0.0293","","","0.0731","0.0747","","","","","","1.049","","","","has coordinates","243870","2020-10-21","18:00:00",""
"7702446","8.175","0.003","7.147","0.002","14.917","0.004","90","","91.28","0.03","90","","871.3","0.5","298","2","298","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","{[Ag(pybut)]BF4.MeCN}n","'{Ag[1,4-bis(4-pyridyl)butadiyne]tetrafluoroborate}.acetonitrile solvate'","","- C16 H11 Ag B F4 N3 -","- C16 H8 Ag B F4 N3 -","- C32 H16 Ag2 B2 F8 N6 -","2","0.5","","Blake, Alexander J.; Baum, Gerhard; Champness, Neil R.; Chung, Simon S. M.; Cooke, Paul A.; Fenske, Dieter; Khlobystov, Andrei N.; Lemenovskii, Dmitrii A.; Li, Wan-Sheung; Schröder, Martin","Long-range chain orientation in 1-D co-ordination polymers as a function of anions and intermolecular aromatic interactions","Journal of the Chemical Society, Dalton Transactions","2000","","23","4285","","10.1039/b006202m","","","0.71073","MoKα","","0.0575","0.0456","","","0.1115","0.1241","","","","","","1.051","","","","has coordinates,has disorder","243870","2020-10-21","18:00:00",""
"7702447","7.273","0.002","10.506","0.003","10.642","0.003","96.33","0.04","103.29","0.03","98.16","0.03","774.7","0.4","220","2","220","2","","","","","","","","7","P -1","-P 1","2","4,4-Bipy*AgBF4*H2O","4,4'-Bipyridyl silver tetraflouroborate complex monohydrate acetonitrile solvate","","- C12 H13 Ag B F4 N3 O -","- C12 H13 Ag B F4 N3 O -","- C24 H26 Ag2 B2 F8 N6 O2 -","2","1","","Blake, Alexander J.; Baum, Gerhard; Champness, Neil R.; Chung, Simon S. M.; Cooke, Paul A.; Fenske, Dieter; Khlobystov, Andrei N.; Lemenovskii, Dmitrii A.; Li, Wan-Sheung; Schröder, Martin","Long-range chain orientation in 1-D co-ordination polymers as a function of anions and intermolecular aromatic interactions","Journal of the Chemical Society, Dalton Transactions","2000","","23","4285","","10.1039/b006202m","","","0.71073","MoKα","","0.0851","0.0637","","","0.1527","0.173","","","","","","1.122","","","","has coordinates,has disorder","243870","2020-10-21","18:00:00",""
"7702448","7.134","0.002","7.322","0.002","31.725","0.004","90","","97.53","0.02","90","","1642.9","0.7","150","2","150","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","AgNO3*Pubut","1,4-bis(4'-Bipyridyl)buta-1,3-diyne silver nitrate complex acetonitrile sollvate","","- C16 H11 Ag N4 O3 -","- C16 H11 Ag N4 O3 -","- C64 H44 Ag4 N16 O12 -","4","1","","Blake, Alexander J.; Baum, Gerhard; Champness, Neil R.; Chung, Simon S. M.; Cooke, Paul A.; Fenske, Dieter; Khlobystov, Andrei N.; Lemenovskii, Dmitrii A.; Li, Wan-Sheung; Schröder, Martin","Long-range chain orientation in 1-D co-ordination polymers as a function of anions and intermolecular aromatic interactions","Journal of the Chemical Society, Dalton Transactions","2000","","23","4285","","10.1039/b006202m","","","0.71073","MoKα","","0.1085","0.0882","","","0.2331","0.2645","","","","","","1.047","","","","has coordinates,has disorder","243870","2020-10-21","18:00:00",""
"7702449","7.493","0.0015","8.285","0.0017","14.723","0.003","101.91","0.03","90.11","0.03","107.69","0.03","850","0.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","[agdbp]PO2F2","[1,4-Bis(4'-pyridyl)butadiynesilver(I)] bis(difluorodioxophosphate) acetonitrile solvate","","- C16 H11 Ag F2 N3 O2 P -","- C16 H11 Ag F2 N3 O2 P -","- C32 H22 Ag2 F4 N6 O4 P2 -","2","1","","Blake, Alexander J.; Baum, Gerhard; Champness, Neil R.; Chung, Simon S. M.; Cooke, Paul A.; Fenske, Dieter; Khlobystov, Andrei N.; Lemenovskii, Dmitrii A.; Li, Wan-Sheung; Schröder, Martin","Long-range chain orientation in 1-D co-ordination polymers as a function of anions and intermolecular aromatic interactions","Journal of the Chemical Society, Dalton Transactions","2000","","23","4285","","10.1039/b006202m","","","0.71073","MoKα","","0.0372","0.0308","","","0.0718","0.077","","","","","","1.142","","","","has coordinates","243870","2020-10-21","18:00:00",""
"7702450","13.8638","0.0012","14.1102","0.0012","15.8947","0.0013","82.284","0.002","89.338","0.002","72.359","0.002","2934.9","0.4","150","2","150","2","","","","","","","","5","P -1","-P 1","2","[agdbp]Ac","[1,4-Bis(4'-pyridyl)butadiynesilver(I)] acetate tris(hydrate) methanol solvate","","- C17.17 H19.18 Ag N2 O4.92 -","- C17.1633 H14.3333 Ag N2 O4.91667 -","- C102.98 H86 Ag6 N12 O29.5 -","6","3","","Blake, Alexander J.; Baum, Gerhard; Champness, Neil R.; Chung, Simon S. M.; Cooke, Paul A.; Fenske, Dieter; Khlobystov, Andrei N.; Lemenovskii, Dmitrii A.; Li, Wan-Sheung; Schröder, Martin","Long-range chain orientation in 1-D co-ordination polymers as a function of anions and intermolecular aromatic interactions","Journal of the Chemical Society, Dalton Transactions","2000","","23","4285","","10.1039/b006202m","","","0.71073","MoKα","","0.0509","0.0413","","","0.1101","0.1255","","","","","","0.948","","","","has coordinates,has disorder","243870","2020-10-21","18:00:00",""
"7702451","9.263","0.002","18.543","0.004","30.16","0.006","90","","91.93","0.03","90","","5177.5","1.9","190","2","193","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","{[Ag*PyCCPhCCPy]PF6*CH3CN}n","1,4-Bis(4'-pyridylethynyl)benzenesilver(I) hexafluorophosphate acetonitrile solvate","","- C22 H15 Ag F6 N3 P -","- C22 H15 Ag F6 N3 P -","- C176 H120 Ag8 F48 N24 P8 -","8","1","","Blake, Alexander J.; Baum, Gerhard; Champness, Neil R.; Chung, Simon S. M.; Cooke, Paul A.; Fenske, Dieter; Khlobystov, Andrei N.; Lemenovskii, Dmitrii A.; Li, Wan-Sheung; Schröder, Martin","Long-range chain orientation in 1-D co-ordination polymers as a function of anions and intermolecular aromatic interactions","Journal of the Chemical Society, Dalton Transactions","2000","","23","4285","","10.1039/b006202m","","","0.71073","MoKα","","0.0715","0.0577","","","0.1711","0.1906","","","","","","1.089","","","","has coordinates","243870","2020-10-21","18:00:00",""
"8000209","3.8351","","3.8351","","15.2273","","90","","90","","90","","223.963","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","Rb La2 (Ti2 Nb O10)","","- La2 Nb O10 Rb Ti2 -","- La2 Nb O10 Rb Ti2 -","- La2 Nb O10 Rb Ti2 -","1","0.0625","","Hong, Y.-S.; Kim, K.","New-type ordering behaviour in the layered perovskite compound Rb La2 Ti2 Nb O10","Chemistry Letters","2000","2000","","690","691","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8000210","24.63409","","24.63409","","24.63409","","90","","90","","90","","14948.9","","","","","","","","","","","","","4","F 2 3","F 2 2 3","196","","K128.08 (Si96.96 Al95.04 O384)","","- Al95.04 K128.08 O384 Si96.96 -","- Al95.04 K128.08 O384 Si96.96 -","- Al95.04 K128.08 O384 Si96.96 -","1","0.0208333","","Ikeda, T.; Kodaira, T.; Ohshima, K.; Izumi, F.; Kamiyama, T.","Neutron powder diffraction study of potassium clusters in zeolite K-LTA","Chemical Physics Letters","2000","318","","93","101","","","","","","","","","","","","","","","","","","","","","","has coordinates","140886","2020-10-21","18:00:00",""
"8101156","7.6031","0.0006","7.5028","0.0002","8.7984","0.0006","90","","92.962","0.006","90","","501.23","0.05","566","2","566","2","","","","","","","","4","P 1 21 1","P 2yb","4","Hydroxyethylammonium L-tartrate monohydrate","","","- C6 H15 N O8 -","- C6 H15 N O8 -","- C12 H30 N2 O16 -","2","1","","Akkurt, M.; Çelik, İ.; Özbey, S.; Kendi, E.","Crystal structure of hydroxyethylammonium L-tartrate monohydrate, C~2~H~8~NO^+^C~4~H~5~O~6~^‒^ · H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","71","72","","","","","","","","0.0495","","","0.1096","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101157","11.546","0.002","6.885","0.004","15.949","0.003","90","","101.75","0.02","90","","1241.3","0.8","300","","300","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H8 Br2 O4 -","- C12 H8 Br2 O4 -","- C48 H32 Br8 O16 -","4","1","","Kokila, M. K.; Puttaraja; Nethaji, M.; Kulkarni, M. V.; Shivaprakash, N. C.","Crystal structure of 8-methoxy-3-dibromoacetylcoumarin, C~12~H~8~Br~2~O~4~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","69","70","","","","","","","","","","","","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101158","8.283","0.001","11.31","0.002","20.669","0.007","90","","99.11","0.01","90","","1911.7","0.6","569.2","","569.2","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","2,2'-Bipyridine-bridged macrocyclic polyether","","","- C40 H48 N2 O8 S2 -","- C40 H48 N2 O8 S2 -","- C80 H96 N4 O16 S4 -","2","0.5","","Nabeshima, T.; Horn, E.; Aoki, Taizo; Yano, Yumihiko","Crystal structure of 3,6,9,12,20,23,26,29-octaoxa-36,49-dithia-51, 52-diaza-hexacyclo[16.16.16.1^38,42^.1^43,47^.0^14,50^.0^31,35^]dopentaconta- 1(35),14,16,18(50),31,33,38,40,42(52),43,45,47(51)-dodecaene, C~40~H~48~N~2~O~8~S~2~, a 2,2'-bipyridine-bridged macrocyclic polyether","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","19","20","","","","","","","","0.0487","","","0.0452","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101159","7.428","0.002","10.898","0.002","16.906","0.003","90","","90","","90","","1368.5","0.4","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C14 H20 O5 -","- C14 H20 O5 -","- C56 H80 O20 -","4","1","","Lamarque, Laurent; Méou, Alain; Brun, Pierre; Pèpe, Gérard","Crystal structure of (1S,3S,5R,7R,8R)-1,4,4-trimethyl-8-carbomethoxy- 8-hydroxy-10-oxatricyclo[5.3.0.0^3,5^]decan-9-one, C~14~H~20~O~5~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","59","60","","","","","","","","0.0443","","","0.0986","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101160","8.57","0.001","9.459","0.001","12.232","0.002","90","","90","","90","","991.6","0.2","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C10 H12 O4 -","- C10 H12 O4 -","- C40 H48 O16 -","4","1","","Pèpe, Gérard; Lamarque, Laurent; Méou, Alain; Brun, Pierre","Crystal structure of (1β,6β,7α)-7-carbomethoxy-9- oxabicyclo[4.3.0]non-2-en-8-one, C~10~H~12~O~4~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","61","62","","","","","","","","0.0317","","","0.0652","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101161","15.4958","0.0009","17.9197","0.001","22.2069","0.0008","90","","90","","90","","6166","3","123","2","123","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C70 H90 N2 O6 -","- C70 H90 N2 O6 -","- C280 H360 N8 O24 -","4","1","","Thuéry, Pierre; Nierlich, Martine; Abidi, Rym; Baklouti, Lassaad; Asfari, Zouhair; Vicens, Jacques","Crystal structure of 5,11,17,23-tetra(tert-butyl)-25,27-di(phenylmethoxy)- 26,28-di(diethylacetamido)calix[4]arene, C~70~H~90~N~2~O~6~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","65","68","","","","","","","","0.062","","","","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101162","6.0534","0.001","11.703","0.004","22.88","0.009","90","0.05","90","0.05","90","0.05","1620.8","0.9","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C16 H20 Br N O4 -","- C16 H20 Br N O4 -","- C64 H80 Br4 N4 O16 -","4","1","","Pulz, R.; Schade, W.; Reißig, H.-U.; Rademacher, O.","Crystal structure of (3R,5R,4'S)-2-benzyl-5-bromo-3-(2',2'-dimethyl- 1',3'-dioxolan-4'-yl)-3,4,5,6-tetrahydro-2H-1,2-oxazin-4-one, C~16~H~20~BrNO~4~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","73","74","","","","","","","","0.0382","","","0.0944","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101163","13.417","0.002","10.1528","0.0016","15.402","0.003","90","0.015","92.641","0.014","90","0.013","2095.8","0.6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C34 H30 F24 N4 P4 S -","- C34 H30 F24 N4 P4 S -","- C68 H60 F48 N8 P8 S2 -","2","0.5","","Scheytza, H.; Reißig, H.-U.; Rademacher, O; Hahn, F.; Richter, J.","Crystal structure of 5,13,20,27-tetraazonia-32-thia-heptacyclo[25.2.2.2 ^2,5^.2^13,16^.2^17,20^.1^7,11^.1^22,25^]nonatriaconta-2,4,7,9,11 (37),13,15,17,19,22,24,27,29,30,33,35,38-heptadecaene tetrakis(hexafluorophosphate), C~34~H~30~F2~4~N~4~P~4~S","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","75","76","","","","","","","","0.0448","","","0.0996","","","","","","","","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8101164","11.504","0.007","11.621","0.008","10.337","0.008","95.46","0.06","115.96","0.05","98.48","0.05","1208","1","293","","293","","","","","","","","","4","P -1","-P 1","2","","","","- C33 H22 O S -","- C33 H22 O S -","- C66 H44 O2 S2 -","2","1","","Crisp, G. T.; Turner, P. D.; Tiekink, E. R. T.","Crystal structure of 11^0^-methoxy-6-thia-1(1,8)-anthracena-4,8(1,3)- dibenzacyclodeca-2,9-diynaphane, C~33~H~22~OS","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","77","78","","","","","","","","0.0746","","","0.0881","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101165","39.146","0.008","9.445","0.002","21.076","0.004","90","","116.41","0.03","90","","6979","2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","triethylenetetramine 1.5 zirconium tris(nitrilotriacetate) dihydrate","","","- C24 H43 N7 O20 Zr1.5 -","- C24 H43 N7 O20 Zr1.5 -","- C192 H344 N56 O160 Zr12 -","8","1","","Haussühl, Eiken; Haussühl, Siegfried; Schreuer, Jürgen","Crystal structure of bis(triethylenetetramine) tris(zirconium) hexa (nitrilotriacetate) tetrahydrate, (NH~3~(CH~2~)~2~NH(CH~2~)~2~NH~2~ (CH~2~)~2~NH~3~)~2~(Zr)~3~(N(CH~2~COO)~3~)~6~ · 4H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","98","100","","","","","","","","0.0271","","","0.0728","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101166","11.164","0.002","10.373","0.002","21.431","0.004","90","","92.21","0.03","90","","2478.2","0.8","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H60 N10 Ni O36 Zr2 -","- C26 H60 N10 Ni O36 Zr2 -","- C52 H120 N20 Ni2 O72 Zr4 -","2","0.5","","Haussühl, Eiken; Giester, Gerald; Tillmanns, Ekkehart","Crystal structure of nickel bis(guanidinium) bis(zirconium) tetra (nitrilotriacetate) dodecahydrate, Ni(C(NH~2~)~3~)~2~(Zr(N(CH~2~COO) ~3~)~2~)~2~ · 12H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","101","102","","","","","","","","0.02","","","0.048","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101167","5.9172","0.0015","8.0811","0.0012","8.1539","0.0012","114.533","0.005","100.912","0.011","95.448","0.01","341.65","0.11","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C6 H12 Cd N2 O2 S4 -","- C6 H12 Cd N2 O2 S4 -","- C6 H12 Cd N2 O2 S4 -","1","0.5","","Wang, Xin Qiang; Yu, Wen Tao; Xu, Dong; Yuan, Duo Rong; Lu, Meng Kai; Tian, Yu Peng; Yang, Ping; Meng, Fan Qing; Guo, Shi Yi; Jiang, Min Hua","Crystal structure of catena-bis(dimethyl sulfoxide)bis(μ~2~- thiocyanato)-cadmium(II), C~6~H~12~CdN~2~O~2~S~4~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","91","92","","","","","","","","0.0235","","","0.0624","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101168","18.759","0.004","16.104","0.003","21.211","0.004","90","","108.52","0.03","90","","6076","2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H88 Ge4 N4 Se10 -","- C36 H88 Ge4 N4 Se10 -","- C144 H352 Ge16 N16 Se40 -","4","1","","Blachnik, Roger; Fehlker, Andreas","Crystal structure of tetrakis(tripropylammonium) decaselenidotetragermanate (IV), [C~9~H~21~NH]~4~[Ge~4~Se~10~]","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","95","97","","","","","","","","0.0436","","","0.0809","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101169","7.659","0.007","9.178","0.008","11.23","0.004","90.51","0.02","105.72","0.02","112.44","0.02","696.7","0.9","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H26 Cl2 Cu2 N4 O6 -","- C26 H26 Cl2 Cu2 N4 O6 -","- C26 H26 Cl2 Cu2 N4 O6 -","1","0.5","","Pardo, Olivier; Tomas, Alain; Mazurier, Alain; Nguyen-Huy, Dung; Viossat, Bernard","Crystal structure of bis(μ-chloro)bis[N,O-1- isoquinolinecarboxylatodimethylformamidecopper(II)], C~26~H~26~Cl~2~Cu~2~N~4~O~6~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","111","112","","","","","","","","0.0658","","","0.1454","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101170","6.929","0.002","8","0.002","16.943","0.005","94.82","0.02","94.35","0.02","101.2","0.02","914","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H15 N3 O3 S -","- C20 H15 N3 O3 S -","- C40 H30 N6 O6 S2 -","2","1","","Meents, A.; Barbier, B.; Euler, H.; Kirfel, A.; Schwierz, H.; Vögtle, F.","Crystal structure of toluene-4-sulfonic acid 4-(4'-cyano-phenylazo)- phenyl ester, C~20~H~15~N~3~O~3~S","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","115","116","","","","","","","","0.0331","","","0.0655","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101171","8.743","0.001","10.139","0.001","16.218","0.001","106.58","0.01","100.77","0.01","100.79","0.01","1308.7","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H25 Cd N3 O7 -","- C27 H25 Cd N3 O7 -","- C54 H50 Cd2 N6 O14 -","2","1","","Mazurier, Alain; Billy, Isabelle; Lemoine, Pascale; Viossat, Bernard; Tomas, Alain","Crystal structure of bis(salicylato)(1,10-phenanthroline) (dimethylformamide) cadmium(II), C~27~H~25~CdN~3~O~7~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","113","114","","","","","","","","0.0496","","","0.1366","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101172","10.213","0.004","17.005","0.005","23.524","0.004","90","","92.34","0.02","90","","4082","2","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C41 H37 Cl3 O4 Sn2 -","- C41 H37 Cl3 O4 Sn2 -","- C164 H148 Cl12 O16 Sn8 -","4","1","","Smyth, D. R.; Tiekink, E. R. T.","Crystal structure of catena-poly-(μ-acetato)triphenyltin chloroform (2/1), Ph~3~Sn(O~2~CMe) · 0.5CHCl~3~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","79","80","","","","","","","","0.051","","","0.051","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101173","15.119","0.005","12.573","0.002","11.139","0.003","90","","111.34","0.02","90","","1972.2","0.9","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H16 Cl2 O2 Sn -","- C20 H16 Cl2 O2 Sn -","- C80 H64 Cl8 O8 Sn4 -","4","1","","Smyth, D. R.; Tiekink, E. R. T.","Crystal structure of catena-poly-(μ-dichloroacetato)triphenyltin, [Ph~3~Sn(O~2~CHCl~2~)]~n~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","81","82","","","","","","","","0.027","","","0.031","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101174","3.7081","0.0005","9.9879","0.0014","10.4309","0.0014","90","","94.349","0.002","90","","385.21","0.09","295","2","295","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C5 H8 N4 O3 -","- C5 H8 N4 O3 -","- C10 H16 N8 O6 -","2","1","","Kristiansson, Olof","Crystal structure of 2,6-diaminopyridinium nitrate, C~5~H~8~N~3~NO~3~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","138","138","","","","","","","","0.0438","","","0.1032","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101175","16.144","0.003","6.239","0.001","16.387","0.004","90","","106.56","0.02","90","","1582.1","0.5","291","1","291","1","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C18 H19 O P -","- C18 H19 O P -","- C72 H76 O4 P4 -","4","1","","Böduel, Rainer René; Hölemann, Alexandra; Schürmann, Markus; Preut, Hans; Mitchell, Terence","Crystal structure of 1-hexynyl(diphenyl)phosphine oxide, C~18~H~19~OP","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","117","118","","","","","","","","0.0398","","","0.0965","","","","","","","","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8101176","10.084","0.006","7.92","0.006","11.772","0.004","90","","92.21","0.03","90","","939.5","0.8","113","","113","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C9 H11 N5 -","- C9 H11 N5 -","- C36 H44 N20 -","4","1","","Crisp, G. T.; Jiang, Y.-L.; Tiekink, E. R. T.","Crystal structure of 9-(3-butenyl)-adenine, C~9~H11N~5~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","83","84","","","","","","","","0.052","","","0.059","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101177","6.121","0.003","8.84","0.004","13.346","0.008","90","","90.49","0.04","90","","722.1","0.6","113","","113","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C6 H10 N2 O3 -","- C6 H10 N2 O3 -","- C24 H40 N8 O12 -","4","1","","Crisp, G. T.; Jiang, Y.-L.; Tiekink, E. R. T.","Crystal structure of N-carboethoxycarbonyl-2-imidazolidinone, C~6~H~10~N~2~O~3~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","85","86","","","","","","","","0.054","","","0.065","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101178","7.758","0.001","14.471","0.002","9.432","0.001","90","","100.18","0.02","90","","1042.2","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Chlortoluron","","","- C10 H13 Cl N2 O -","- C10 H13 Cl N2 O -","- C40 H52 Cl4 N8 O4 -","4","1","","Pèpe, Gérard; Veesler, Stéphane; Astier, Jean-Pierre; Pfefer, Guillaume; Corti, Christelle","Crystal structure of 3-(3-chloro-p-tolyl)-1,1-dimethylurea, C~10~H~13~ClN~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","63","64","","","","","","","","0.0425","","","0.0855","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101179","11.588","0.001","13.724","0.001","7.522","0.001","90","","90","","90","","1196.3","0.2","293","2","293","2","","","","","","","","5","P c a 21","P 2c -2ac","29","2-thiophenealdoxime","","","- C5 H5 N O S -","- C5 H5 N O S -","- C40 H40 N8 O8 S8 -","8","2","","Joannou, John; Martin, Lisandra L.; Taylor, Max R.","Crystal structure of 2-thiophenealdoxime, C~5~H~5~NOS","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","119","120","","","","","","","","0.046","","","0.121","","","","","","","","","","","has coordinates","203903","2020-10-21","18:00:00",""
"8101180","8.843","0.001","9.648","0.002","19.941","0.002","90","","91.54","0.01","90","","1700.8","0.4","296.2","","296.2","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C12 H19 F6 N2 O P Te -","- C12 H19 F6 N2 O P Te -","- C48 H76 F24 N8 O4 P4 Te4 -","4","1","","Kobayashi, Katsutoshi; Sato, Soichi; Horn, Ernst; Furukawa, Naomichi","Crystal structure of bis[2,6-{bis(dimethylamino)methyl}phenyl]-di- μ-oxoditellurium bis(hexafluorophosphate), [Te(C~12~H~19~N~2~)O]~2~(PF~6~)~2~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","21","22","10.1515/ncrs-2000-0114","","","","","","","0.0395","","","0.0522","","","","","","","","","","","has coordinates","270960","2021-12-01","15:00:02",""
"8101181","18.887","0.004","20.582","0.004","8.165","0.002","90","","90","","90","","3174","1.2","293","2","293","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","Phenyl 2-biphenyl-2´-carboxamide diselenide","","","- C38 H28 N2 O2 Se2 -","- C38 H28 N2 O2 Se2 -","- C152 H112 N8 O8 Se8 -","4","1","","Spirlet, Marie-Rose; Mohsine, Abdelaziz; Christians, Léon","Crystal structure of phenyl 2-biphenyl-2-carboxamide diselenide, C~38~H~28~N~2~O~2~Se~2~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","121","122","","","","","","","","","","","","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101182","8.4415","0.0014","12.961","0.002","23.313","0.005","90","","90","","90","","2550.6","0.8","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C18 H33 N O11 S2 -","- C18 H33 N O11 S2 -","- C72 H132 N4 O44 S8 -","4","1","","Frey, Wolfgang; Zimmermann, Peter Jan; Jäger, Volker","Crystal structure of (2S,3R,4R,5R,1'R,2'S)-3,4-dimethanesulfonyloxy- 2-[2,3-O-isopropylidenedioxy-1-(tert-butoxycarbonylamino)propyl]-5- methyl-tetrahydrofuran, C~18~H~33~NO~11~S~2~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","125","126","","","","","","","","0.0645","","","0.1073","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101183","12.407","0.002","9.254","0.0012","13.8122","0.0013","90","","104.836","0.01","90","","1533","0.4","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C24 H41 N O13 S2 -","- C22 H41 N O13 S2 -","- C44 H82 N2 O26 S4 -","2","1","","Frey, Wolfgang; Zimmermann, Peter Jan; Jäger, Volker","Crystal structure of (2S,3R,4R,5S,1'R,2'S)-3,4-dimethanesulfonyloxy- 2-[2,3-O-isopropylidenedioxy-1-(tert-butoxycarbonylamino)propyl]-5- methyl-tetrahydrofuran ethyl acetate, C~18~H~33~NO~11~S~2~ · C~4~H~8~O~2~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","127","128","","","","","","","","0.0659","","","0.1595","","","","","","","","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8101184","8.2006","0.0015","9.368","0.002","10.141","0.002","76.382","0.014","67.417","0.014","71.612","0.014","676.8","0.2","293","2","293","2","","","","","","","","5","P 1","P 1","1","","","","- C19 H35 N O11 S2 -","- C19 H35 N O11 S2 -","- C19 H35 N O11 S2 -","1","1","","Frey, Wolfgang; Blanarikova, Iva; Zimmermann, Peter Jan; Jäger, Volker","Crystal structure of (2S,3R,4S,1'R,2'S)-3,4-dimethanesulfonyloxy-2- [2,3-O-isopropylidenedioxy-1-(tert-butoxycarbonylamino)propyl]-5,5- dimethyltetrahydrofuran, C~19~H~3~5NO~11~S~2~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","129","130","","","","","","","","0.042","","","0.1155","","","","","","","","","","","has coordinates,has disorder","176466","2020-10-21","18:00:00",""
"8101185","10.017","0.002","11.206","0.002","10.461","0.002","90","","116.46","0.01","90","","1051.2","0.3","298","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C13 H20 Cs N5 O13 Zr -","- C13 H20 Cs N5 O13 Zr -","- C26 H40 Cs2 N10 O26 Zr2 -","2","1","","Haussühl, Eiken; Tillmanns, Ekkehart","Crystal structure of cesium guanidinium zirconium bis(nitrilotriacetate) hydrate, Cs(C(NH~2~)~3~)Zr(N(CH~2~COO)~3~)~2~ · H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","103","104","","","","","","","","0.0187","","","0.0476","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101186","9.221","0.0011","9.877","0.0006","20.783","0.002","90","","90","","90","","1892.8","0.3","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","guanidinium salicilate","","","- C8 H11 N3 O3 -","- C8 H11 N3 O3 -","- C64 H88 N24 O24 -","8","1","","Fleck, Michel; Tillmanns, Ekkehart; Haussühl, Siegfried","Crystal structure of guanidinium salicilate, C(NH~2~)~3~C~7~H~5~O~3~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","105","106","","","","","","","","0.0411","","","0.1047","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101187","4.816","0.001","9.869","0.002","11.716","0.002","90","","99.16","0.03","90","","549.75","0.19","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","magnesium adipate tetrahydrate","","","- C6 H16 Mg O8 -","- C6 H16 Mg O8 -","- C12 H32 Mg2 O16 -","2","0.5","","Fleck, Michel; Tillmanns, Ekkehart; Haussühl, Siegfried","Crystal structure of tetraaquamagnesium adipate, Mg(H~2~O)~4~(C~6~H~8~O~4~)","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","107","108","","","","","","","","0.026","","","0.0644","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101188","14.1657","0.0002","16.1074","0.0002","17.1227","0.0001","89.4677","0.0005","65.9674","0.0005","79.0775","0.0002","3493.56","0.07","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C33 H48 F2 N2 O2.5 Si -","- C33 H48 F2 N2 O2.5 Si -","- C132 H192 F8 N8 O10 Si4 -","4","2","","Haberecht, Jörg; Böhme, Uwe; Lang, Heinrich; Rheinwald, Gerd; Roewer, Gerhard","Crystal structure of N,N'-ethylenebis(3,5-di-tert-butylsalicylideneiminato) difluorosilane—dioxane (4/1), 4C~32~H~46~F~2~N~2~O~2~Si~4~ · C~4~H~8~O~2~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","135","137","","","","","","","","0.0577","","","0.1278","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101189","14.315","0.009","8.107","0.007","19.888","0.005","90","","90","","90","","2308","2","293","","293","","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C19 H24 Br4 Te2 -","- C19 H24 Br4 Te2 -","- C76 H96 Br16 Te8 -","4","0.5","","Dakternieks, D.; O'Connell, J.; Tiekink, E. R. T.","Crystal structure of dibromo[(1,1-dibromo-1-mesityl-l4-telluranyl) methyl]-mesityl-l4-tellurane, [MesTeBr~2~]~2~CH~2~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","87","88","","","","","","","","0.051","","","0.043","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101190","14.896","0.003","16.279","0.003","20.375","0.004","92.74","0.03","96.51","0.03","111.81","0.03","4535.8","1.6","243","2","243","2","","","","","","","","6","P -1","-P 1","2","[K([2.2.2]crypt)] salt of Nonastannide(3-), 0.5 ethylenediamine solvate","","","- C55 H112 K3 N7 O18 Sn9 -","- C55 H112 K3 N7 O18 Sn9 -","- C110 H224 K6 N14 O36 Sn18 -","2","1","","Fässler, Thomas F.; Hoffmann, Rudolf","Crystal structure of tris[2.2.2]crypt-kalium nonastannide(3‒)— ethylenediamine (2/1), C~55~H~112~K~3~N~7~O~18~Sn~9~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","139","142","","","","","","","","0.0622","","","0.1802","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101191","6.232","0.001","8.444","0.001","26.141","0.004","90","","90","","90","","1375.6","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C14 H15 N O5 -","- C14 H15 N O5 -","- C56 H60 N4 O20 -","4","1","","Henkel, Sonja; Fengler-Veith, Marion; Jäger, Volker","Crystal structure of (+)-(3aS,6aS,1'R)-6-oxo-3-(1'-O-benzyl-1',2'- dihydroxyethyl)-3a,4,6a-tetrahydrofuro[3,4-d]isoxazole, C~14~H~15~NO~5~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","131","132","","","","","","","","0.0598","","","0.1349","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101192","5.155","0.001","20.146","0.006","13.494","0.002","90","","93.21","0.02","90","","1399.2","0.5","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C26 H36 N2 O10 -","- C13 H18 N O5 -","- C52 H72 N4 O20 -","4","2","","Henkel, Sonja; Fengler-Veith, Marion; Jäger, Volker","Crystal structure of (+)-(4S,5R,2'R,4'S,5'R,1''S)-5-(2''-acetoxy-1''- benzyloxyethyl)-3-(5'-acetoxy-2'-methyl-1',3'-dioxan-4'-yl)-4-(tert- butoxycarbonylamino)-4,5-dihydroisoxazole, C~26~H~36~N~2~O~10~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","133","134","","","","","","","","0.0731","","","0.191","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101193","11.7604","0.0008","12.9764","0.0006","14.4341","0.001","90","","90","","90","","2202.8","0.2","","","293","1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Cedrelone","","","- C26 H29 O5 -","- C26 H29 O5 -","- C104 H116 O20 -","4","1","","Zeumer, Britta; Zukerman-Schpector, J.; Caracelli, I.; Castro-Gamboa, Ian; Da Silva, M. F.; Fernandes, J. B.; Vieira, P. C.","Crystal structure of 6-(3-furyl)-17-hydroxy-1,7,11,15,15-pentamethyl- 3-oxapentacyclo[8.8.0.0^2,4^.0^2,7^.0^11,16^]octadeca-12,16(17)diene- 14,18-dione, cedrelone, C~26~H~30~O~5~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","143","144","10.1515/ncrs-2000-0172","","","","","","","0.0415","","","0.1124","","","","","","","","","","","has coordinates","209513","2020-10-21","18:00:00",""
"8101194","4.045","0.002","12.068","0.002","15.813","0.002","90","","95.3","0.02","90","","768.6","0.6","294","","294","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C6 H11 N3 O2 -","- C6 H11 N3 O2 -","- C24 H44 N12 O8 -","4","1","","Klepp, Kurt O.; Stähr, Monika; Schmidt, Harald","Crystal structure of 1,3,5-trimethyl-2,4-dioxohexahydro-1,3,5-triazine, C~6~H~11~N~3~O~2~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","147","148","","","","","","","","0.04","","","0.036","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:54",""
"8101195","9.892","0.007","17.98","0.01","4.952","0.005","90","","90","","90","","881","2","294","","294","","","","","","","","","4","P n a 21","","","","","","- C7 H9 N3 O4 -","- C7 H9 N3 O4 -","- C28 H36 N12 O16 -","4","1","","Klepp, Kurt O.; Schmidt, Harald","Crystal structure of 1,5-diacetyl-2,4-dioxohexahydro-1,3,5-triazine, C~7~H~9~N~3~O~4~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","149","150","","","","","","","","0.066","","","0.063","","","","","","","","","","","has coordinates","102815","2020-10-21","18:00:00",""
"8101196","7.1256","0.001","14.871","0.002","16.954","0.002","90","","90","","90","","1796.6","0.4","","","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C20 H24 O5 -","- C20 H24 O5 -","- C80 H96 O20 -","4","1","","Zukerman-Schpector, J.; Camillo, Robinson L.; Lemos, Francisco C. D.; Truiti, M. C. T.; Sarragiotto, Maria Helena","Crystal structure of 11-hydroxy-5-(5-hydroxy-4-methylpent-3-enyl)- 4,5,13-trimethyl-3,8-dioxatricyclo[7.4.0.0^2,6^]trideca-1(13),2(6), 9(10),11-tetraen-7-one, C~20~H~24~O~5~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","145","146","10.1515/ncrs-2000-0173","","","","","","","0.0473","","","0.1126","","","","","","","","","","","has coordinates","209540","2020-10-21","18:00:00",""
"8101197","13.117","0.002","8.736","0.001","22.362","0.003","90","","101.36","0.02","90","","2512.3","0.6","300","2","300","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C23 H44 O5 Si -","- C23 H44 O5 Si -","- C92 H176 O20 Si4 -","4","1","","Wittenberg, J.; Wartchow, Rudolf; Hoffmann, H. M. R.","Crystal structure of 1,8-dimethyl-7α-methoxy-10α-(triisopropylsilyloxy)- (2β)-12-oxatricyclo[6.3.1.0^2,7^]dodecane-3β,4α- diol, [(C~3~H~7~)~3~SiO](CH~3~)~2~(OH)~2~(OCH~3~)(C~11~H~12~O)","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","153","154","","","","","","","","0.0597","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101198","7.6063","0.0012","11.2078","0.0017","12.4564","0.0019","92.058","0.016","102.435","0.016","104.23","0.016","1000.7","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H22 Cu N6 O8 -","- C16 H22 Cu N6 O8 -","- C32 H44 Cu2 N12 O16 -","2","1","","Hueso-Ureña, Francisco; Moreno-Carretero, Miguel N.; Peñas-Chamorro, Antonio L.; Debaerdemaeker, Tony; Esteve, Vicente; Amigó, José M.","Crystal structure of aqua-ethanol-O-(6-amino-5-formyl-1,3-dimethyluracilato- benzoylhydrazone-N,N',O) copper(II) nitrate, C~16~H~22~CuN~6~O~8~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","155","156","","","","","","","","0.0391","","","0.0984","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101199","15.602","0.002","21.668","0.002","45.865","0.006","90","","90","","90","","15505","3","173","2","173","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C12 H18 Cl6 N6 Na Ta -","- C12 H18 Cl6 N6 Na Ta -","- C288 H432 Cl144 N144 Na24 Ta24 -","24","0.75","","Müller, Ulrich; Noll, Andrea","Crystal structure of hexakis(acetonitrile)sodium hexachlorotantalate(V), [Na(NCCH~3~)~6~][TaCl~6~]","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","191","192","10.1515/ncrs-2000-0194","","","","","","","","","","","","","","","","","","","","","has coordinates","209540","2020-10-21","18:00:00",""
"8101200","8.65","0.01","9.49","0.01","30.22","0.01","90","","93.53","0.09","90","","2476","4","293","","293","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C30 H34 Fe O2 -","- C30 H34 Fe O2 -","- C120 H136 Fe4 O8 -","4","2","","Jones, C. M.; Mocellin, E.; Tiekink, E. R. T.","Crystal structure of 17α-ethynylferrocenyl-17β-hydroxyestr- 4-en-3-one, C~30~H~34~FeO~2~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","89","90","","","","","","","","0.074","","","0.076","","","","","","","","","","","has coordinates","200412","2020-10-21","18:00:00",""
"8101201","7.395","0.001","14.713","0.003","7.702","0.002","90","","99.74","0.02","90","","825.9","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C4 H12 Ni O8 -","- C4 H12 Ni O8 -","- C16 H48 Ni4 O32 -","4","1","","Zheng, Yue-Qing; Lin, Jian-Li","Crystal structure of catena-tetraaquasuccinato-O,O'-nickel(II), Ni (C~4~H~4~O~4~)(H~2~O)~4~, p. 157"">","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","157","158","","","","","","","","0.044","","","0.1184","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101202","7.397","0.004","14.792","0.005","7.775","0.004","90","","99.73","0.03","90","","838.4","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C4 H12 Co O8 -","- C4 H12 Co O8 -","- C16 H48 Co4 O32 -","4","1","","Zheng, Yue-Qing; Lin, Jian-Li","Crystal structure of catena-tetraaquasuccinato-O,O'-cobalt(II), Co (C~4~H~4~O~4~)(H~2~O)~4~, p.~ ~159","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","159","160","","","","","","","","0.0424","","","0.1106","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101203","14.856","0.002","7.449","0.001","9.614","0.001","90","","97.44","0.01","90","","1055","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H16 Co O6 -","- C8 H16 Co O6 -","- C32 H64 Co4 O24 -","4","1","","Zheng, Yue-Qing; Lin, Jian-Li; Sun, Jie; Pan, Ai-Ya","Crystal structure of diaquasuberatocobalt(II), Co(C~8~H~12~O~4~)(H~2~O) ~2~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","161","162","","","","","","","","0.0431","","","0.0958","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101204","13.196","0.003","7.139","0.0014","21.793","0.004","90","","107.03","0.03","90","","1963","0.7","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C5 H14 Mn O8 -","- C5 H14 Mn O8 -","- C40 H112 Mn8 O64 -","8","1","","Zheng, Yue-Qing; Lin, Jian-Li; Sun, Jie; Zhang, Hong-Liang","Crystal structure of tetraaquaglutaratomanganese(II), Mn(C~5~H~6~O~4~) (H~2~O)~4~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","163","164","","","","","","","","0.0292","","","0.0753","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101205","6.941","0.001","20.688","0.002","13.36","0.001","90","","93.046","0.007","90","","1915.7","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 H24 Cu Na2 O16 -","- C8 H24 Cu Na2 O16 -","- C32 H96 Cu4 Na8 O64 -","4","1","","Zheng, Yue-Qing; Lin, Jian-Li","Crystal structure of disodium disuccinatocuperate octahydrate, Na~2~Cu (C~4~H~4~O~4~)~2~ · 8H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","165","166","","","","","","","","0.0497","","","0.1299","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101206","9.456","0.006","11.218","0.003","8.658","0.006","90","","90","","90","","918.4","0.9","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","5-phenylhydantoic acid","","","- C9 H10 N2 O3 -","- C9 H10 N2 O3 -","- C36 H40 N8 O12 -","4","1","","Isea, Raúl; Capparelli, Mario V.; Gómez, Dora; Gil, Herminia","Crystal structure of 5-phenylhydantoic acid, C~6~H~5~NHCONHCH~2~COOH","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","167","168","","","","","","","","0.0348","","","0.0915","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101207","6.2028","0.0007","8.253","0.001","17.592","0.002","94.295","0.001","100.153","0.001","112.072","0.004","811.6","0.2","273.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C28 H36 Cd2 N4 O14 -","- C28 H28 Cd2 N4 O14 -","- C28 H28 Cd2 N4 O14 -","1","0.5","","Hauptmann, Ralf; Kondo, Mitsuru; Kitagawa, Susumu","Crystal structure of bis(4-aminobenzoato)aquacadmium dihydrate, [Cd (H~2~NC~6~H~4~COO)~2~(H~2~O)]~n~ · 2nH~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","169","170","","","","","","","","0.0444","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101208","6.3973","0.0006","6.941","0.001","9.336","0.001","95.527","0.006","104.386","0.002","112.518","0.002","362.33","0.08","273.2","","273.2","","","","","","","","","5","P -1","-P 1","2","","","","- C12 H16 Mn N2 O8 -","- C12 H16 Mn N2 O8 -","- C12 H16 Mn N2 O8 -","1","0.5","","Hauptmann, Ralf; Kondo, Mitsuru; Kitagawa, Susumu","Crystal structure of diisonicotinatotetraaquamanganese(II), [Mn(C~5~H~4~NCOO) ~2~(H~2~O)~4~]","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","171","172","","","","","","","","0.0408","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101209","8.9948","0.0006","6.4157","0.0004","13.7402","0.0009","90","","108.539","0.001","90","","751.77","0.08","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C4 H10 Co O6 -","- C4 H10 Co O6 -","- C16 H40 Co4 O24 -","4","1","","Jiao, Xiang-Dong; Guzei, Ilia A.; Espenson, James H.","Crystal structure of catena-poly[mono(μ-aqua)di(μ-acetato) cobalt(II)] monohydrate, [Co(CH~3~COO)~2~(H~2~O)] · H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","173","174","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101210","16.054","0.002","6.486","0.001","24.04","0.002","90","","97.78","0.01","90","","2480.2","0.5","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C25 H34 O3 S Si -","- C25 H34 O3 S Si -","- C100 H136 O12 S4 Si4 -","4","2","","Tinant, Bernard; Declercq, Jean-Paul; Mathieu, Benoit; Ghosez, Leon","Crystal structure of [3-(dimethylphenylsilyl)-6,6-dimethylbicyclo [3.1.1]hept-2-yl]methyl-toluene-4-sulfonate, C~25~H~34~O~3~Ssi","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","175","177","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"8101211","13.467","0.003","10.326","0.003","16.633","0.003","90","","95.954","0.013","90","","2300.5","0.9","241","2","241","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C16 H32 Cl4 Cr Li O4 -","- C16 H32 Cl4 Cr Li O4 -","- C64 H128 Cl16 Cr4 Li4 O16 -","4","0.5","","Rabe, Gerd W.; Rheingold, A. L.; Incarvito, C. D.","Crystal structure of di-μ-chlorobis(tetrahydrofurano)lithium bis(tetrahydrofurano)dichlorochromate, (THF)~2~Li(μ-Cl)~2~Cr (THF)~2~Cl~2~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","181","182","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101212","15.057","0.003","8.669","0.002","22.84","0.005","90","","101.57","0.03","90","","2920.7","1.1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H84 Cl16 N12 O18 Pt -","- C24 H82 Cl16 N12 O18 Pt -","- C48 H164 Cl32 N24 O36 Pt2 -","2","0.5","","Gencheva, G.; Bontchev, P. R.; Sander, J.; Hegetschweiler, K.","Crystal structure of tetrakis(1,3,5-triammonio-1,3,5-trideoxy-cis- inositol) decachloride hexachloroplatinate hexahydrate, (H~3~taci) ~4~[PtCl~6~]Cl~10~ · 6H~2~O, two different forms of (H~3~taci)^3+ ^ in one crystal","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","183","185","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101213","4.7007","0.0001","16.2044","0.0007","6.3696","0.0003","90","","102.072","0.002","90","","474.46","0.03","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","ethylenediammonium hydrogenphosphite","","","- C2 H14 N2 O6 P2 -","- C2 H14 N2 O6 P2 -","- C4 H28 N4 O12 P4 -","2","0.5","","Fleck, Michel; Tillmanns, Ekkehart; Haussühl, Siegfried","Crystal structure of ethylenediammonium hydrogenphosphite, (C~2~N~2~H~8~) (H~3~PO~3~)~2~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","109","110","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101214","8.968","0.002","10.071","0.002","17.722","0.004","105.11","0.03","97.49","0.03","98.93","0.03","1501.8","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H38 Br3 Co N6 O7 -","- C24 H35 Br3 Co N6 O7 -","- C48 H70 Br6 Co2 N12 O14 -","2","1","","Sander, J.; Hegetschweiler, K.","Crystal structure of 1,3,5-trideoxy-1,3,5-tris((2-pyridylmethyl)amino)- cis-inositolcobalt(III) bromide tetrahydrate, [Co(pmaci)]Br~3~ · ~4~H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","186","188","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101215","9.135","0.003","14.269","0.001","9.318","0.004","90","","118.84","0.02","90","","1064","1","294","","294","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C9 H11 N3 O5 -","- C9 H11 N3 O5 -","- C36 H44 N12 O20 -","4","1","","Klepp, Kurt O.; Staehr, Monika; Schmidt, Harald","Crystal structure of 1,3,5-triacetyl-2,4-dioxohexahydro-1,3,5-triazine, (CH~3~CO)~3~C~3~H~2~N~3~O~2~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","151","152","","","","","","","","0.035","","","0.033","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"8101216","11.418","0.002","16.676","0.003","8.517","0.0009","93.03","0.01","103.1","0.01","86.51","0.01","1575.3","0.4","296.2","","296.2","","","","","","","","","4","P -1","-P 1","2","dibromodiselenide","","","- C32 H20 Br4 Se4 -","- C16 H10 Br2 Se2 -","- C64 H40 Br8 Se8 -","4","2","","Horn, Ernst; Nakahodo, Tsukasa; Furukawa, Naomichi","Crystal structure of 1,6-dibromo-2-phenyl-1,2-diselenaacenaphthylene, BrSe(C~10~H~5~Br)Se(C~6~H~5~)","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","23","24","","","","","","","","0.04","","","0.044","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101217","9.101","0.002","10.162","0.002","13.066","0.002","97.91","0.01","109.97","0.01","100.68","0.01","1089.3","0.4","203","2","203","2","","","","","","","","6","P -1","-P 1","2","","","","- C16 H24 Fe N8 O4 S -","- C16 H24 Fe N8 O4 S -","- C32 H48 Fe2 N16 O8 S2 -","2","1","","Dittmar, Heinrich; Böhn, Karlheinz; Walker, Nigel","Crystal structure of tetrakis(3-methylpyrazole)iron(II) sulphate, C~16~H~24~FeN~8~O~4~S","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","189","190","","","","","","","","0.0436","","","0.1029","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101218","7.595","0.002","8.0214","0.0017","12.538","0.003","89.042","0.017","83.44","0.02","79.71","0.019","746.6","0.3","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C10 H12 Cl4 N2 Zn -","- C10 H12 Cl4 N2 Zn -","- C20 H24 Cl8 N4 Zn2 -","2","1","","Blachnik, Roger; Reuter, Hans; Gather, Marianne; Eickmeier, Henning","Crystal structure of dipyridinium tetrachlorozincate, [C~5~H~6~N]~2~ [ZnCl~4~]","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","93","94","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101219","10.8049","0.0015","9.0496","0.0015","17.03","0.002","90","","96.956","0.012","90","","1652.9","0.4","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C18 H51 F6 N12 O9 V -","- C18 H51 F6 N12 O9 V -","- C36 H102 F12 N24 O18 V2 -","2","1","","Ramos Silva, M.; Matos Beja, A.; Paixão, J. A.; Alte da Veiga, L.","Crystal structure of L-argininium hexafluorovanadate trihydrate, (C~6~H~15~N~4~O~2~)~3~VF~6~ · 3H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","178","180","","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8101220","10.2097","0.0001","13.2263","0.0001","15.0706","0.0002","90","","94.09","","90","","2029.91","0.04","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H18 Cl2 Cu N4 -","- C22 H18 Cl2 Cu N4 -","- C88 H72 Cl8 Cu4 N16 -","4","1","","Barhács, László; Czaun, Miklós; Speier, Edit; Speier, Gábor; Noll, Bruce C.; Pierpont, Cortlandt G.","Crystal structure of dichloro(phenanthroline)pyridinecopper(II) pyridine solvate, CuCl~2~(C~12~H~8~N~2~)(C~5~H~5~N) · C~5~H~5~N","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","193","194","","","","","","","","0.0254","","","0.068","","","","","","","","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8101221","6.835","0.001","14.8","0.003","3.7334","0.0003","97.163","0.01","97.803","0.009","91.53","0.01","370.85","0.1","296.2","","296.2","","","","","","","","","4","P -1","-P 1","2","","","","- C20 H10 N4 O2 -","- C20 H10 N4 O2 -","- C20 H10 N4 O2 -","1","0.5","","Mizuguchi, Jin; Matsumoto, Shinya","Crystal structure of 3,6-bis(3-cyanophenyl)pyrrolo[3,4-c]pyrrole-1, 4-dione, C~20~H~10~N~4~O~2~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","195","196","","","","","","","","0.0612","","","0.0774","","","","","","","","","","","has coordinates","277875","2022-09-15","11:59:41",""
"8101222","18.278","0.003","17.766","0.005","5.85","0.001","90","","90.62","0.02","90","","1899.5","0.7","193","2","193","2","","","","","","","","2","C 1 2/m 1","-C 2y","12","","","","- Cl10 Ta2 -","- Cl10 Ta2 -","- Cl60 Ta12 -","6","0.75","","Rabe, Susanne; Müller, Ulrich","Crystal structure of tantalum pentachloride, (TaCl~5~)~2~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","1","2","","","","","","","","0.061","","","0.1699","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101223","12.59","0.001","26.183","0.002","4.1271","0.0004","90","","90","","90","","1360.5","0.2","293","2","293","2","","","","","","","","3","P n n m","-P 2 2n","58","Trirubidium heptadysprosium(III) dodekaselenide","","","- Dy7 Rb3 Se12 -","- Dy7 Rb3.04 Se12 -","- Dy14 Rb6.08 Se24 -","2","0.25","","Folchnandt, Matthias; Schleid, Thomas","Crystal structure of trirubidium dodekaselenoheptadysprosate(III), Rb~3~Dy~7~Se~12~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","9","10","","","","","","","","0.0536","","","0.1192","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101224","5.666","0.001","5.666","0.001","22.968","0.005","90","","90","","120","","638.6","0.2","293","2","293","2","","","","","","","","3","P -3 c 1","-P 3 2""c","165","","","","- Nb4 O15 Sr5 -","- Nb4 O15 Sr5 -","- Nb8 O30 Sr10 -","2","0.166667","","Teneze, Nicolas; Mercurio, Danièle; Trolliard, Gilles; Champarnaud-Mesjard, Jean Claude","Reinvestigation of the crystal structure of pentastrontium tetraniobate, Sr~5~Nb~4~O~15~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","11","12","","","","","","","","0.0441","","","0.124","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101225","5.5636","0.0005","5.5636","0.0005","5.5636","0.0005","90","","90","","90","","172.2","0.2","294","","294","","","","","","","","","3","P -4 3 m","","","","","","- Cu3 Se4 V -","- Cu3 Se4 V -","- Cu3 Se4 V -","1","0.0416667","","Klepp, Kurt O.; Gurtner, Doris","Crystal structure of tricopper tetraselenidovanadate(V), Cu~3~VSe~4~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","4","4","","","","","","","","0.031","","","0.031","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101226","7.2096","0.0005","3.4742","0.0002","7.0475","0.0006","90","","119.61","0.005","90","","153.47","0.019","293","2","293","2","","","","","","","","2","C 1 2/m 1","-C 2y","12","copper dibromide","","","- Br2 Cu -","- Br2 Cu -","- Br4 Cu2 -","2","0.25","","Oeckler, Oliver; Simon, Arndt","Redetermination of the crystal structure of copper dibromide, CuBr~2~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","13","13","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101227","6.626","0.001","8.604","0.001","4.707","0.001","90","","102.94","0.02","90","","261.53","0.07","300","2","300","2","","","","","","","","3","C 1 2/m 1","-C 2y","12","","","","- In2 O7 Si2 -","- In2 O7 Si2 -","- In4 O14 Si4 -","2","0.25","","Patzke, Greta R.; Wartchow, Rudolf; Binnewies, Michael","Refinement of the crystal structure of diindium disilicate, In~2~ (Si~2~O~7~)","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","15","16","","","","","","","","0.0248","","","0.059","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101228","6.154","0.001","20.963","0.004","12.169","0.002","90","","90","","90","","1569.7","0.5","293","2","293","2","","","","","","","","4","A m a 2","A 2 -2a","40","","","","- N2 O Rb2 W -","- N3 Rb2 W -","- N36 Rb24 W12 -","12","1.5","","Niewa, Rainer; Jacobs, Herbert","Crystal structure of dirubidium oxodinitridotungstate(VI), Rb~2~[WN~2~O]","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","17","18","","","","","","","","0.0409","","","0.0952","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101229","7.691","0.004","11.403","0.006","12.471","0.007","90","","90","","90","","1094","2","294","","294","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Fe2 Rb3 Se4 -","- Fe2 Rb3 Se4 -","- Fe8 Rb12 Se16 -","4","0.5","","Klepp, Kurt O.; Pantschov, Silvio; Boller, Herbert","Crystal structure of mixed-valent trirubidium tetraselenidodiferrate, Rb~3~Fe~2~Se~4~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","5","6","","","","","","","","0.052","","","0.048","","","","","","","","","","","has coordinates","278244","2022-09-28","13:56:22",""
"8101230","15.714","0.003","15.858","0.002","9.491","0.002","90","","106.74","0.02","90","","2265","1","294","","294","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- Cs4 Ge4 S10 -","- Cs4 Ge4 S10 -","- Cs16 Ge16 S40 -","4","0.5","","Klepp, O. Kurt; Zeitlinger, Martin","Crystal structure of tetracesium decasulfidotetragermanate, Cs~4~Ge~4~S~10~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","7","8","","","","","","","","0.027","","","0.025","","","","","","","","","","","has coordinates","208362","2020-10-21","18:00:00",""
"8101231","3.822","0.001","3.822","0.001","12.622","0.002","90","","90","","90","","184.38","0.07","293","2","293","2","","","","","","","","4","I 4/m m m","-I 4 2","139","Strontium Praseodym Gallate","","","- Ga O4 Pr Sr -","- Ga O4 Pr Sr -","- Ga2 O8 Pr2 Sr2 -","2","0.0625","","Gesing, Thorsten M.; Uecker, Reinhard; Buhl, J.-C.","Crystal structure of strontium praseodum gallium oxide, SrPrGaO~4~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","14","14","","","","","","","","0.0284","","","0.0821","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101233","8.961","0.002","16.663","0.003","18.08","0.008","94.83","","95.82","0.03","98.23","0.02","2645","1","293","","293","","","","","","","","","4","P 1","P 1","1","","","","- C32 H27 N P2 -","- C32 H29 N P2 -","- C128 H116 N4 P8 -","4","4","","Robert, Frédéric; Gimbert, Yves; Averbuch-Pouchot, Marie-Thér; Greene, Andrew","Crystal structure of <i>N,N</i>-bis(diphenylphosphino)-<i>N</i>-( (S)-α-methylbenzyl)amine, C~32~H~29~NP~2~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","2","233","236","","","","","","","","0.0344","","","0.0293","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101234","9.366","0.002","11.6932","0.001","14.5539","0.0006","90","","99.777","0.0009","90","","1570.8","0.3","180.2","","180.2","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C19 H17 O2 P -","- C19 H17 O2 P -","- C76 H68 O8 P4 -","4","1","","Hein, Peter; Lügger, Thomas; Hahn, F. Ekkehardt; Rettig, Steven J.; Orvig, Chris","Crystal structure of (2-hydroxy-5-methylphenyl)diphenylphosphineoxide, (C~6~H~5~)~2~P(O)(CH~3~C~6~H~3~OH)","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","2","237","238","","","","","","","","","","","","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101235","14.502","0.003","34.015","0.007","15.307","0.003","90","","100.6","0.03","90","","7421.8","2.6","123","2","123","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C75 H65 I4 N15 Nd2 O2 -","- C75 H65 I4 N15 Nd2 O2 -","- C300 H260 I16 N60 Nd8 O8 -","4","1","","Rivière, Christelle; Lance, Monique; Madic, Charles; Ephritikhine, Michel; Nierlich, Martine","Crystal structure of bis[tris(2,2'-bipyridyl)-(μ-hydroxo)neodymium (III)] tetraiodide pyridine solvate, (C~60~H~50~O~2~N~12~Nd~2~)I~4~ · 3(NC~5~H~5~)","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","2","239","241","","","","","","","","0.0597","","","0.1089","","","","","","","","","","","has coordinates","211156","2020-10-21","18:00:00",""
"8101236","8.5897","0.0017","20.792","0.004","11.28","0.002","90","","90","","90","","2014.6","0.7","293","2","293","2","","","","","","","","6","P n m a","-P 2ac 2n","62","Di-[S-(2-aminoethyl)thiouronium]tribromocuprate dibromide","","","- C6 H22 Br5 Cu N6 S2 -","- C6 H22 Br5 Cu N6 S2 -","- C24 H88 Br20 Cu4 N24 S8 -","4","0.5","","Blachnik, Roger; Wiest, Thomas; Eickmeier, Henning; Dülmer, Ansgar","Crystal structure of di-[<i>S</i>-(2-aminoethyl)thiouronium] tribromocuprate dibromide, [C~3~H~11~N~3~S]~2~[CuBr~3~][Br]~2~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","2","245","246","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101237","10.1","0.01","12.296","0.004","18.225","0.002","90","","98.1","0.03","90","","2240.9","1.7","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H46 F10 O8 Sn4 -","- C32 H44 F10 O8 Sn4 -","- C64 H88 F20 O16 Sn8 -","2","0.5","","Gielen, M.; Tiekink, E. R. T.","Crystal structure of bis[tetraethyl-μ-hydroxyperfluorophenylacetato μ~3~-oxoditin], [(F~5~C~6~CH~2~CO~2~)Et~2~Sn(OH)OSnEt~2~]~2~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","2","255","256","","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101238","13.7","0.004","7.681","0.002","18.889","0.006","90","","106.37","0.02","90","","1907.1","1","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C17 H30 O4 Si -","- C17 H30 O4 Si -","- C68 H120 O16 Si4 -","4","1","","Tinant, Bernard; Trembleau, Laurent; Ghosez, Leon","Crystal structure of (3<i>R</i>*,3a<i>R</i>*,4<i>S</i>*,7<i>S</i>*, 7a<i>R</i>*)-4-(<i>tert</i>-butyldimethyl silyloxy)-4,7-epoxy-3-methoxy- 7-methyloctahydro-1<i>H</i>-inden-1-one, C~17~H~30~O~4~Si","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","2","261","262","","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8101239","19.052","0.004","13.764","0.003","18.952","0.004","90","","92.425","0.019","90","","4965.3","1.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H48 I9 N3 Sb2 -","- C30 H48 I9 N3 Sb2 -","- C120 H192 I36 N12 Sb8 -","4","1","","Ahmed, Ibrahim Abdelhalim; Blachnik, Roger; Reuter, Hans","Crystal structure of the low temperature modification of tris(ethyldimethylphenylammonium) nanoiododiantimonate(III), [EtMe~2~PhN]~3~[Sb~2~I~9~]","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","2","253","254","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101240","9.727","0.003","10.854","0.003","11.62","0.003","106.3","0.02","104.11","0.02","104.43","0.02","1073.4","0.5","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C60 H40 N4 -","- C60 H40 N4 -","- C60 H40 N4 -","1","0.5","","Blömker, Jens; Frey, Wolfgang","Crystal structure of pyrene—5,10,15,20-tetraphenyl-21<i>H</i>,23 <i>H</i>-porphyrin (1/1), C~60~H~40~N~4~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","2","263","264","","","","","","","","0.0608","","","0.1424","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101241","9.4576","0.0014","10.786","0.0013","11.6798","0.0014","106.182","0.01","102.811","0.011","104.213","0.011","1054","0.2","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C58 H40 N4 -","- C58 H40 N4 -","- C58 H40 N4 -","1","0.5","","Blömker, Jens; Frey, Wolfgang","Crystal structure of phenanthrene—5,10,15,20-tetraphenyl-21<i>H </i>,23<i>H</i>-porphyrin (1/1), C~58~H~40~N~4~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","2","265","266","","","","","","","","0.0715","","","0.1365","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101242","9.3524","0.0011","10.9001","0.0012","11.7806","0.0011","106.393","0.008","101.822","0.009","105.468","0.009","1058.2","0.2","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C58 H40 N4 -","- C58 H40 N4 -","- C58 H40 N4 -","1","0.5","","Blömker, Jens; Frey, Wolfgang","Crystal structure of anthracene—5,10,15,20-tetraphenyl-21<i>H</i>, 23<i>H</i>-porphyrin (1/1), C~58~H~40~N~4~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","2","267","268","","","","","","","","0.062","","","0.1259","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101243","10.913","0.002","17.618","0.004","19.848","0.004","90","","99.97","0.03","90","","3758.5","1.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","1,2-Vinylen-bis(triphenylphosphonium)tetrabrom","","","- C38 H32 Br4 P2 Pb -","- C38 H32 Br4 P2 Pb -","- C152 H128 Br16 P8 Pb4 -","4","0.5","","Blachnik, Roger; Reuter, Hans; Wiest, Thomas; Eickmeier, Henning","Crystal structure of 1,2-vinylenbis(triphenylphosphonium) tetrabromoplumbate (II), [Ph~3~P‒CH=CH‒PPh~3~][PbBr~4~]","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","2","247","248","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101244","10.191","0.003","18.205","0.004","19.884","0.003","90","","100.35","0.03","90","","3629","1.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","1,2-Vinylen-bis(triphenylphosphonium)tetrabromocuprate(II)","","","- C38 H32 Br4 Cu P2 -","- C38 H32 Br4 Cu P2 -","- C152 H128 Br16 Cu4 P8 -","4","0.5","","Blachnik, Roger; Reuter, Hans; Wiest, Thomas; Eickmeier, Henning","Crystal structure of 1,2-vinylenbis(triphenylphosphonium) tetrabromocuprate(II), [Ph~3~P‒CH=CH‒PPh~3~][CuBr~4~]","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","2","249","250","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101245","11.716","0.003","14.145","0.004","11.25","0.003","90","","115.39","0.02","90","","1684.2","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","1,2-Vinylen-bis(triphenylphosphonium)dibromide-dihydrate","","","- C19 H18 Br O P -","- C19 H18 Br O P -","- C76 H72 Br4 O4 P4 -","4","1","","Blachnik, Roger; Reuter, Hans; Wiest, Thomas; Eickmeier, Henning","Crystal structure of 1,2-vinylenbis(triphenylphosphonium) dibromide dihydrate, [Ph~3~P‒CH=CH‒PPh~3~][Br]~2~ · 2H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","2","251","252","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101246","5.331","0.004","9.179","0.002","23.057","0.004","90","","95.62","0.03","90","","1122.8","0.9","293","","293","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C15 H10 O4 -","- C15 H10 O4 -","- C60 H40 O16 -","4","1","","Shoja, M.; Kirkava, A.; Kabbani, R.","Crystal structure of 5,2'-dihydroxyflavone, C~15~H~10~O~4~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","2","269","270","","","","","","","","0.044","","","0.045","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101247","10.615","0.005","14.257","0.002","16.509","0.002","90","","90","","90","","2498.4","1.3","293","","293","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C16 H12 O4 -","- C16 H12 O4 -","- C128 H96 O32 -","8","1","","Shoja, M.; Krikava, A","Crystal structure of 8-hydroxy-7-methoxyflavone, C~16~H~12~O~4~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","2","271","272","","","","","","","","0.091","","","0.097","","","","","","","","","","","has coordinates","206173","2020-10-21","18:00:00",""
"8101248","4.567","0.009","10.723","0.008","17.095","0.006","90","","100","0.1","90","","824.5","1.8","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H10 Cu N4 O6 -","- C18 H10 Cu N4 O6 -","- C36 H20 Cu2 N8 O12 -","2","0.5","","Shoja, M.; Gershon, H.; Clarke, D. D.","Crystal structure of bis(7-nitro-8-quinolinolato)copper(II), CuC~18~H~10~O~6~N~4~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","2","273","274","","","","","","","","0.043","","","0.067","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"8101249","10.051","0.002","12.187","0.002","13.152","0.002","94.42","0.02","111.02","0.02","93.12","0.02","1493.5","0.4","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H56 Li2 N6 O2 Zr -","- C20 H56 Li2 N6 O2 Zr -","- C40 H112 Li4 N12 O4 Zr2 -","2","1","","Kempe, Rhett","Crystal structure of bis(diethyloxy-<i>O</i>-dilithium) hexakis(μ~2~- dimethylamido)zirconate, C~20~H~56~Li~2~N~6~O~2~Zr","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","2","275","276","","","","","","","","0.0335","","","0.0492","","","","","","","","","","","has coordinates,has disorder","130149","2020-10-21","18:00:00",""
"8101250","10.594","0.0013","12.548","0.002","12.948","0.002","110.57","0.014","97.57","0.014","91.28","0.014","1593.1","0.4","473","2","473","2","","","","","","","","6","P -1","-P 1","2","","","","- C49 H108 N4 O2 Si8 Sn2 -","- C49 H108 N4 O2 Si8 Sn2 -","- C49 H108 N4 O2 Si8 Sn2 -","1","0.5","","Kempe, Rhett","Crystal structure of 1,1,5,5-tetrakis[bis(trimethylsilyl)amido]-4, 8-diphenyl-2,6-dioxa-1,5-distannacyclooctane—cyclohexane (1/0.75), C~49~H~108~N~4~O~2~Si~8~Sn~2~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","2","277","278","","","","","","","","0.0407","","","0.1174","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101251","11.705","0.002","13.185","0.003","29.061","0.006","90","","90","","90","","4485","1.6","293","2","293","2","","","","","","","","3","C 2 2 21","C 2c 2","20","","","","- C30 H22 N4 -","- C30 H22 N4 -","- C240 H176 N32 -","8","1","","Kempe, Rhett; Hillebrand, Gerhard","Crystal structure of 1,1'-binaphthyl-2,2'-di(pyrid-2-ylamine), C~30~H~22~N~4~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","2","279","280","","","","","","","","0.062","","","0.135","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101252","7.624","0.001","19.709","0.003","10.924","0.002","90","","104.72","0.013","90","","1587.6","0.4","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C41 H34 N4 O -","- C41 H34 N4 O -","- C82 H68 N8 O2 -","2","1","","Kempe, Rhett; Hillebrand, Gerhard","Crystal structure of 1,1'-binaphthyl-2,2'-di(lepid-2font-ylamine)— methanol (1/1), (C~40~H~30~N~4~) · CH~3~OH","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","2","281","282","","","","","","","","0.0716","","","0.1812","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101253","15.957","0.003","7.958","0.002","26.041","0.005","90","","90","","90","","3307","1.2","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","3aS^*^.4S^*^7aR^*^-4-Ethoxy-3a,7a-dihydro-3,7-diphenyl-4H-1,5-dioxa-2,6-diaza- indene","","","- C19 H18 N2 O3 -","- C19 H18 N2 O3 -","- C152 H144 N16 O24 -","8","1","","Schmidt, E.; Reißig, H.-U.; Rademacher, O.","Crystal structure of 3a<i>S</i>*,4<i>S</i>*,7a<i>R</i>*-4-ethoxy-3a, 7a-dihydro-3,7-diphenyl-4<i>H</i>-1,5-dioxa-2,6-diaza-indene, C~19~H~18~N~2~O~3~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","2","283","284","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101254","16.631","0.004","16.322","0.003","17.405","0.006","90","","102.24","0.03","90","","4617","2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","1,5-benzodiazepine","","","- C16 H11 Cl3 N2 -","- C16 H11 Cl3 N2 -","- C192 H132 Cl36 N24 -","12","3","","Schulz Lang, Ernesto; Gauze Bonacorso, Helio; Bittencourt, Sandra R. T.","Crystal structure of 2-trichloromethyl-4-phenyl-3<i>H</i>-1,5-benzodiazepine, C~16~H~11~Cl~3~N~2~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","2","242","244","","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8101255","17.007","0.001","21.319","0.001","18.343","0.001","90","","90","","90","","6650.7","0.6","291","1","291","1","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C44 H90 F6 K2 O17 Sn4 -","- C44 H80 F6 K2 O17 Sn4 -","- C176 H320 F24 K8 O68 Sn16 -","4","0.5","","Altmann, Reiner; Jurkschat, Klaus; Schürmann, Markus","Crystal structure of bis[potassium 18-crown-6-1,2-bis(dimethylfluorostannyl) benzene fluoride] pentahydrate, 2{[K·18-Crown-6]^+^[O-C~6~H~4~(SnMe~2~F) ~2~·F]^‒^} · 5H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","2","309","311","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101256","5.8623","0.0004","8.5835","0.0004","35.864","0.002","90","","90","","90","","1804.6","0.2","173","","173","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C22 H24 O3 -","- C22 H24 O3 -","- C88 H96 O12 -","4","1","","Avery, T. D.; Fallon, G. D.; Taylor, D. K.; Tiekink, E. R. T.","Crystal structure of <i>tert</i>-butyl 2-(2-benzoyl-3-phenylcyclopropyl) acetate, C~22~H~24~O~3~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","2","257","258","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101257","7.686","0.001","22.427","0.007","9.624","0.003","90","","98.68","0.009","90","","1639.9","0.6","173","","173","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C11 H17 B10 N O2 -","- C11 H17 B10 N O2 -","- C44 H68 B40 N4 O8 -","4","1","","Rendina, L. M.; Todd, J. A.; Tiekink, E. R. T.","Crystal structure of 1-(phthalimidomethyl)-1,2-dicarba-<i>closo</i>- dodecaborane, C~11~H~17~B~10~NO~2~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","2","259","260","","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101258","12.105","0.001","12.105","0.001","12.105","0.001","90","","90","","90","","1773.8","0.3","293","2","293","2","","","","","","","","2","P m -3 n","-P 4n 2 3","223","","","","- Cs8 Sn44 -","- Cs8 Sn43.96 -","- Cs8 Sn43.96 -","1","0.0208333","","von Schnering, Hans Georg; Kroener, Rudolf; Baitinger, Michael; Peters, Karl; Nesper, Reinhard; Grin, Yuri","Crystal structure of the defect clathrate Cs~8~Sn~44◊2~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","2","205","206","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101259","12.105","0.001","12.105","0.001","12.105","0.001","90","","90","","90","","1773.8","0.3","293","2","293","2","","","","","","","","2","P m -3 n","-P 4n 2 3","223","","","","- Cs8 Sn44 -","- Cs8 Sn44.236 -","- Cs8 Sn44.236 -","1","0.0208333","","von Schnering, Hans Georg; Kroener, Rudolf; Baitinger, Michael; Peters, Karl; Nesper, Reinhard; Grin, Yuri","Crystal structure of the defect clathrate Cs~8~Sn~44◊2~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","2","205","206","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101260","4.092","0.001","4.092","0.001","5.145","0.002","90","","90","","120","","74.61","0.04","300","2","300","2","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","","","- Co Cr Ge -","- Co Cr Ge -","- Co2 Cr2 Ge2 -","2","0.0833333","","Wirringa, Jörg; Wartchow, Rudolf; Binnewies, Michael","Crystal structure of cobalt chromium germanium, CoCrGe","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","2","197","198","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101261","4.1789","0.0006","4.1789","0.0006","7.055","0.002","90","","90","","120","","106.7","0.04","293","2","293","2","","","","","","","","3","P -3 m 1","-P 3 2""","164","YbAl2Ge2","","","- Al2 Ge2 Yb -","- Al2 Ge2 Yb -","- Al2 Ge2 Yb -","1","0.0833333","","Zhao, Jing-Tai; Paschen, Silke; Schnelle, Walter; Grin, Yuri","Crystal structure of ytterbium-dialuminium-digermanium, YbAl~2~Ge~2~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","2","200","200","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101262","7.95419","0.00006","7.95419","0.00006","7.3613","0.00001","90","","90","","120","","403.345","0.001","295","2","295","2","","","","","","","","4","P 3","P 3","143","Cr2BP3O12","","","- B2 Cr4 O24 P6 -","- B Cr2 O12 P3 -","- B2 Cr4 O24 P6 -","2","0.666667","","Mi, Jin-Xiao; Zhao, Jing-Tai; Mao, Shao-Yu; Huang, Ya-Xi; Engelhardt, Holger; Kniep, Rüdiger","Crystal structure of dichromium monoborotriphosphate, Cr~2~[BP~3~O~12~]","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","2","201","202","10.1515/ncrs-2000-0205","powder diffraction","","","","","","","","","","","","0.0488","","","","","","","","has coordinates","209540","2020-10-21","18:00:00",""
"8101263","9.3789","0.0005","8.3296","0.0004","9.6701","0.0003","90","","102.078","0.0008","90","","738.73","0.06","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- B H O9 P2 Rb V -","- B H O9 P2 Rb V -","- B4 H4 O36 P8 Rb4 V4 -","4","1","","Engelhardt, Holger; Borrmann, Horst; Kniep, Rüdiger","Crystal structure of rubidium vanadium(III) catena-[monohydrogenmonoborate- bis(monophosphate)], RbV[BP~2~O~8~(OH)]","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","2","203","206","","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101264","17.825","0.002","11.1644","0.0009","12.541","0.001","90","","97.92","0.01","90","","2472","0.4","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","tetrayttrium hexabromide monoboride","","","- B Br6 Tb4 -","- B Br6 Tb4 -","- B8 Br48 Tb32 -","8","1","","Mattausch, Hansjuergen; Oeckler, Oliver; Simon, Arndt","Crystal structure of tetraterbium hexabromide monoboride, Tb~4~Br~6~B","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","2","199","199","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101265","6.979","0.001","8.309","0.001","13.128","0.001","105.566","0.009","105.287","0.008","93.15","0.01","701","0.2","292.2","","292.2","","","","","","","","","4","P -1","-P 1","2","","","","- C15 H13 N3 O5 -","- C15 H13 N3 O5 -","- C30 H26 N6 O10 -","2","1","","Galitsky, N.; Cody, V.; Wallet, J.-C.","Crystal structure of diphenylguanidinium dihydrogenphosphite‒phosphoric acid‒water (2/1/1), 2[(C~13~N~3~H~14~)(H~2~PO~3~)] · H~3~PO~3~ · H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","352","356","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101266","8.638","0.004","14.07","0.003","10.735","0.003","90","","111.82","0.02","90","","1211.2","0.6","296.2","","296.2","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","S-p-nitrophenyl-S-phenyl-S-fluorothiazyne","","","- C12 H9 F N2 O2 S -","- C12 H9 F N2 O2 S -","- C48 H36 F4 N8 O8 S4 -","4","1","","Horn , E.; Dong, T.; Fujii, T.; Yoshimura, T.; Shimasaki, C.","Crystal structure of S-p-nitrophenyl-S-phenyl-S-fluorothiazyne, (C~6~H~5~) NFS(C~6~H~4~NO~2~)","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","357","358","","","","","","","","0.042","","","0.0388","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101267","15.51","0.003","9.213","0.002","12.888","0.003","90","0","96.52","0.03","90","0","1829.7","0.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C19 H18 Cl N O4 S -","- C19 H18 Cl N O4 S -","- C76 H72 Cl4 N4 O16 S4 -","4","1","","Duque, Julio; Pomés, Ramón; Suárez Margarita; Ochoa, Estael; Verdecia, Yamila; Punte, Graciela; Echevarría, Gustavo","Crystal structure of 2-carbonylethoxy-5-carbonylmethoxy-4-(2-chloro- phenyl)-6-methyl-4,7-dihydrothiene-[2,3-b]pyridine, C~19~H~18~NO~4~SCl","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","361","362","","","","","","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"8101268","7.782","0.002","8.642","0.002","10.23","0.003","90","","90","","90","","688","0.3","293","2","293","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","","","- C4 H10 N2 O4 -","- C4 H10 N2 O4 -","- C16 H40 N8 O16 -","4","0.5","","Marković, Zorica B.; Bogdanović, Goran A.; Spasojević-de Biré, Anne; Sabo, Tibor J.; Trifunovíc, Srecḱo R.","Crystal structure of ammonium iminodiacetate, NH~4~C~4~H~6~NO~4~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","363","364","10.1515/ncrs-2000-0328","","","","","","","","","","","","","","","","","","","","","has coordinates","209512","2020-10-21","18:00:00",""
"8101269","10.961","0.003","12.204","0.004","14.128","0.004","76.4","0.03","73.33","0.03","64.5","0.04","1620.4","0.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H37 N6 O10 P3 -","- C26 H35.654 N6 O10.033 P3 -","- C52 H71.308 N12 O20.066 P6 -","2","1","","Paixão, J. A.; Matos Beja, A.; Ramos Silva, M.; Alte da Veiga, L.","Crystal structure of diphenylguanidinium dihydrogenphosphite‒phosphoric acid‒water (2/1/1), 2[(C~13~N~3~H~14~)(H~2~PO~3~)] · H~3~PO~3~ · H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","352","356","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101270","12.267","0.001","11.548","0.001","13.242","0.001","90","","91.13","0.01","90","","1875.3","0.2","569.2","","569.2","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C14 H22 O3 S2 Si2 -","- C14 H22 O3 S2 Si2 -","- C56 H88 O12 S8 Si8 -","4","1","","Zhang, S.-Z.; Sato, S.; Horn, E.; Furukawa, Naomichi","Crystal structure of 1-oxa-6-thia-7,10-bis(trimethylsilyl)-11-sulfoxide- spiro[4.4.5]undeca-3,8-dien-2-one, C~14~H~22~O~3~S~2~Si~2~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","359","360","","","","","","","","0.0337","","","0.0356","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101271","19","0.004","14.383","0.003","7.907","0.002","90","","90","","90","","2160.8","0.8","293","2","293","2","","","","","","","","4","C m c 21","C 2c -2","36","","","","- C24 H34 N2 Ti -","- C24 H34 N2 Ti -","- C96 H136 N8 Ti4 -","4","0.5","","Spannenberg, Anke; Zippel, Thorsten; Rosenthal, Uwe","Crystal structure of bis(cyclopentadienyl)titanium-N,N-bis(cyclohexyl) diazabuta-1,3-diene, C~24~H~34~N~2~Ti","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","365","366","","","","","","","","0.0294","","","0.0642","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101272","19.522","0.004","7.891","0.002","25.1","0.005","90","","96.52","0.03","90","","3841.6","1.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C42 H40 O6 Ti4 -","- C42 H40 O6 Ti4 -","- C168 H160 O24 Ti16 -","4","1","","Spannenberg, Anke; Zippel, Thorsten; Burlakov, Vladimir V.; Rosenthal, Uwe","Crystal structure of di(bis(cyclopentadienyl)titanocene) carbonate, C~42~H~40~O~6~Ti~4~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","367","368","","","","","","","","0.0353","","","0.0655","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101273","18.177","0.004","12.304","0.002","20.595","0.004","90","","90.31","0.03","90","","4606","1.5","293","2","293","2","","","","","","","","4","I 1 2/a 1","-I 2ya","15","trilithium citrate tetrahydrate","","","- C6 H13 Li3 O11 -","- C6 H13 Li3 O11 -","- C96 H208 Li48 O176 -","16","2","","Schreuer, Jürgen; Haussühl, Siegfried","The pseudo-orthorhomic crystal structure of monoclinic trilithium citrate tetrahydrate, Li~3~HOC(COO)(CH~2~COO)~2~ · 4H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","369","370","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101274","5.275","0.001","8.022","0.002","15.865","0.003","90","","90","","90","","671.3","0.2","299","2","299","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Lithium L-pyroglutamate monohydrate","","","- C5 H8 Li N O4 -","- C5 H8 Li N O4 -","- C20 H32 Li4 N4 O16 -","4","1","","Schreuer, Jürgen","Crystal structure of lithium (S)-2-pyrrolidone-5-carboxylate monohydrate, LiC~5~H~6~NO~3~ · H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","371","372","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101275","9.956","0.002","11.208","0.002","10.615","0.002","90","","113.53","0.01","90","","1086","0.4","298","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C13 H22 N5 O14 Rb Zr -","- C13 H22 N5 O14 Rb Zr -","- C26 H44 N10 O28 Rb2 Zr2 -","2","1","","Haussühl, Eiken","Crystal structure of rubidium guanidinium zirconium bis(nitrilotriacetate) dihydrate, Rb(C(NH~2~)~3~)Zr(N(CH~2~COO)~3~)~2~ · 2H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","373","374","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101276","8.894","0.002","16.667","0.003","16.907","0.003","90","","96.03","0.03","90","","2492.4","0.8","298","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C13 H32 N8 O15 Zr -","- C13 H32 N8 O15 Zr -","- C52 H128 N32 O60 Zr4 -","4","0.5","","Haussühl, Eiken; Gramlich, Volker","Redetermination of the crystal structure of bis(guanidinium) carbonato (ethylenediaminetetraacetato) zirconate tetrahydrate, (CN~3~H~6~)~2~ [Zr((CH~2~COO)~2~N(CH~2~)~2~N(CH~2~COO)~2~)CO~3~] · 4H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","375","376","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101277","9.5971","0.0006","11.4837","0.0007","12.8316","0.0009","87.408","0.005","83.313","0.005","66.373","0.004","1286.81","0.14","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C29 H24 Mn N4 O5 -","- C29 H24 Mn N4 O5 -","- C58 H48 Mn2 N8 O10 -","2","1","","Wang, Ze-Xin; Zhou, Xin-Hong; Yu, Wen-Tao; Fu, You-Jun","Crystal structure of bis(phenanthroline-κ^2^N,N')propanedionato- κ^2^O,O'-manganese(II) ethanol solvate, C~27~H~18~N~4~O~4~Mn · CH~3~CH~2~OH","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","423","424","","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","200415","2020-10-21","18:00:00",""
"8101278","16.4319","0.0018","7.3794","0.0009","13.4711","0.001","90","","90","","90","","1633.5","0.3","293","2","293","2","","","","","","","","7","P c a 21","P 2c -2ac","29","","","","- C7 H8 Cd Hg N4 O2 S4 -","- C7 H8 Cd Hg N4 O2 S4 -","- C28 H32 Cd4 Hg4 N16 O8 S16 -","4","1","","Zhou, Mei; Yu, Wen Tao; Xu, Dong; Guo, Shi Yi; Lu, Meng Kai; Yuan, Duo Rong","Crystal structure of cadmium mercury tetrathiocyanate (glycol monomethyl ether), C~7~H~8~CdHgN~4~O~2~S~4~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","425","426","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101279","17.781","0.008","5.974","0.003","15.361","0.008","90","","117.78","0.04","90","","1443.6","1.2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C4 H12 N2 O10 S2 U -","- C4 H12 N2 O10 S2 U -","- C16 H48 N8 O40 S8 U4 -","4","0.5","","Saßmannshausen, Markus; Lutz, Heinz Dieter; Zazhogin, Alexandre","Crystal structure of bis(dimethylsulfoxide) dinitrato dioxo uranium(VI), UO~2~(NO~3~)~2~[(CH~3~)~2~SO]~2~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","427","428","","","","","","","","","","","","","","","","","","","","","","has coordinates","189250","2020-10-21","18:00:00",""
"8101280","9.623","0.005","8.477","0.004","21.064","0.004","90","","93.17","0.03","90","","1715.6","1.2","193","2","193","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- C24 H20 -","- C24 H20 -","- C96 H80 -","4","1","","Klinga, Martti; Rieger, Bernhard; Leskelä, Markku; Jany, Gerhard; Repo, Timo","Crystal structure of 1-(9-fluorenyl)-2-(1-indenyl)ethane, C~24~H~20~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","421","422","","","","","","","","","","","","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101281","7.513","0.002","14.915","0.003","7.891","0.002","90","","99.94","0.02","90","","871","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","tetraaquamanganese succinate","","","- C4 H12 Mn O8 -","- C4 H12 Mn O8 -","- C16 H48 Mn4 O32 -","4","1","","Fleck, Michel; Tillmanns, Ekkehart; Bohaty, Ladislav","Crystal structure of tetraaquamanganese succinate, Mn(H~2~O)~4~C~4~H~4~O~4~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","429","430","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101282","8.933","0.001","11.391","0.001","27.983","0.001","90","","90","","90","","2847.2","0.5","293","2","293","2","","","","","","","","5","P n a a","-P 2ac 2bc","56","","","","- C14 H16 N2 O3 S -","- C14 H16 N2 O3 S -","- C112 H128 N16 O24 S8 -","8","1","","İngeç,Σebnem Kandil; Aydın, Abdullah; Soylu, Hüseyin; Arıcı , Cengiz; Çakír, Bilge; Şahin, M. Fethi","Crystal structure of 1-[2(3H)-benzothiazolone-3-yl]propanoylmorpholine, C~14~H~16~N~2~O~3~S","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","431","432","","","","","","","","","","","","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101283","7.002","0.001","7.432","0.001","16.762","0.002","90","","90","","90","","872.3","0.2","300","2","300","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C8 H12 Br N O -","- C8 H12 Br N O -","- C32 H48 Br4 N4 O4 -","4","1","","Wartchow, R.; Frackenpohl, J.; Hoffmann, H. M. R.","Crystal structure of (1S,2R,4S)-2-bromomethyl-1-azabicyclo[2.2.2]- octan-5-one, C~8~H~12~BrNO","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","435","436","","","","","","","","0.0305","","","0.0473","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101284","8.907","0.002","12.002","0.002","12.844","0.002","92.246","0.013","108.274","0.013","107.044","0.014","1233.5","0.4","297","2","297","2","","","","","","","","3","P -1","-P 1","2","biscalix[4]arene-crown-6","","","- C64 H60 O6 -","- C64 H60 O6 -","- C64 H60 O6 -","1","0.5","","Bryan, Jeffrey C.; Haverlock, Tamara J.; Sachleben, Richard A.","Crystal structure of biscalix[4]arene-crown-6, C~64~H~60~O~6~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","439","440","","","","","","","","","","","","","","","","","","","","","","has coordinates","277875","2022-09-15","11:59:41",""
"8101285","8.141","0.002","9.117","0.001","11.893","0.001","105.4","0.3","95.25","0.01","115.08","0.01","749.5","0.9","293","","293","","","","","","","","","5","P -1","-P 1","2","","hexaaquo cobalt(II) theophylline-7-acetate tetrahydrate","","- C18 H38 Co N8 O18 -","- C18 H38 Co0.5 N8 O18 -","- C18 H38 Co0.5 N8 O18 -","1","0.5","","Horn, E.; Botello, A. F.; Salas, J. M.; Tiekink, E. R. T.","Crystal structure of hexaaquocobalt(II) theophylline-7-acetate tetrahydrate, [Co(OH~2~)~6~][C~9~H~9~N~4~O~4~]~2~ · 4H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","441","442","","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101286","7.365","0.004","14.479","0.004","8.433","0.002","90","","112.72","0.03","90","","829.5","0.6","173","","173","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H9 Br O3 -","- C8 H9 Br O3 -","- C32 H36 Br4 O12 -","4","1","","Crisp, G. T.; Turner, P. D.; Tiekink, E. R. T.","Crystal structure of 4-bromo-2,6-bis(hydroxymethyl)phenol, C~8~H~9~BrO~3~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","443","444","","","","","","","","","","","","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101287","10.044","0.001","10.955","0.002","11.45","0.002","69.161","0.009","70.761","0.005","72.9","0.01","1089.1","0.2","293","2","","","","","","","","","","5","P -1","-P 1","2","","","","- C23 H23 Cl N4 O3 -","- C23 H23 Cl N4 O3 -","- C46 H46 Cl2 N8 O6 -","2","1","","İngeç Şebnem Kandil; Soylu, Hυseyin; Engin, Kendi; Doğruer, Deniz S.; Şahin, M. Fethi","Crystal structure of 1-[2-[6-(4-methoxyphenyl)-3(2H)-pyridazinone- 2-yl]-acetyl]-4-(3-chlorophenyl)piperazine, C~23~H~23~ClN4O~3~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","433","434","","","","","","","","","","","","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101288","6.382","0.002","8.857","0.001","10.061","0.002","75.84","0.01","81.49","0.02","75.35","0.02","531.2","0.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","2,11-Bis(isopropylimino)-5,5,6,6,7,7,8,8-octafluorododeca-2,10-dien-4,9-dion","","","- C18 H24 F8 N2 O2 -","- C18 H24 F8 N2 O2 -","- C18 H24 F8 N2 O2 -","1","0.5","","Röschenthaler, Gerd-Volker; Przyborowski, Jan; Lork, Enno","Crystal structure of 2,11-bis(isopropylimino)-5,5,6,6,7,7,8,8-octafluorododeca- 2,10-dien-4,9-dione, C~18~H~24~F~8~N~2~O~2~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","449","450","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101289","11.496","0.001","7.208","0.001","19.394","0.001","90","","97.16","0.01","90","","1594.5","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H15 N O2 -","- C21 H15 N O2 -","- C84 H60 N4 O8 -","4","1","","Lex, Johann; Griesbeck, Axel G.; Kramer, Wolfgang","Crystal structure of (10bSR,11RS)-10b-hydroxy-11-phenyl-10b,11-dihydro- isoindolo[2,1a]indol-6-one, C~21~H~15~NO~2~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","451","452","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101290","7.096","0.001","11.671","0.001","19.277","0.002","90","","90","","90","","1596.5","0.3","300","2","300","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C17 H20 N2 O3 -","- C17 H20 N2 O3 -","- C68 H80 N8 O12 -","4","1","","Frackenpohl, J.; Röper, S.; Hoffmann, H. M. R.; Wartchow, R.","Crystal structure of (1S,2R,5R,6R)-2-methoxy-6-(16-nitrophenylethynyl)- 1-azabicyclo[3.2.2]nonane, C~17~H~20~N~2~O~3~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","437","438","","","","","","","","","","","","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101291","14.056","0.004","14.704","0.004","15.335","0.003","106.27","0.02","105.76","0.02","102.24","0.02","2782.1","1.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C46 H64 Cl4 Cu4 N4 O14 -","- C46 H64 Cl4 Cu4 N4 O14 -","- C92 H128 Cl8 Cu8 N8 O28 -","2","1","","Turpeinen, Urho; Klinga, Martti; Mutikainen, Ilpo; Hämäläinen, Reijo","Crystal structure of tetrakis[μ-(4-chlorobenzoato-O,O')-μ~3~- (2-dimethylaminoethanolato)copper(II)]) dimethanol, C~46~H~64~Cl~4~Cu~4~N~4~O~14~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","418","420","","","","","","","","0.0353","","","0.0809","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101292","10.0862","0.0006","11.3809","0.0007","14.9594","0.0008","73.849","0.006","82.902","0.007","67.437","0.007","1522.89","0.15","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H51 Ge N3 Si4 -","- C22 H51 Ge N3 Si4 -","- C44 H102 Ge2 N6 Si8 -","2","1","","Schäfer, Helmut; Saak, Wolfgang Saak; Weidenbruch, Manfred","Crystal structure of N-1-adamantylbis[bis(trimethylsilyl)amido]-germanimine, C~22~H~51~GeN~3~Si~4~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","453","454","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101293","9.814","0.003","10.667","0.003","15.655","0.004","90","","104.064","0.024","90","","1589.7","0.8","173","","173","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H20 N2 S4 Zn -","- C10 H20 N2 S4 Zn -","- C40 H80 N8 S16 Zn4 -","4","1","","Tiekink, E. R. T.","Redetermination of the crystal structure of dimeric bis(N,N- diethyldithiocarbamato)zinc, [Zn(S~2~CNEt~2~)~2~]~2~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","445","446","","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101294","8.962","0.005","15.222","0.008","27.536","0.01","90","","93.59","0.06","90","","3748.9","2.8","173","","173","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H44 In2 O6 P2 S8 -","- C20 H44 In2 O6 P2 S8 -","- C80 H176 In8 O24 P8 S32 -","4","1","","Pahari, D.; Jain, V. K.; Tiekink, E. R. T.","Crystal structure of bis(O,O-diisopropylphosphorodithioato-κS, κS')-bis[μ-[2-(mercapto-κS)ethoxy-κO]ethanethiolato (2-)κS:κS]-diindium, [(iPrO)~2~PS~2~In(SCH~2~CH~2~OCH~2~CH~2~S) ~2~InS~2~P(OiPr)~2~]","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","447","448","","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101295","8.36","0.001","15.794","0.001","23.949","0.001","90","","90","","90","","3162.2","0.7","298","","","","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C18 H15 Cl N2 O S -","- C18 H15 Cl N2 O S -","- C144 H120 Cl8 N16 O8 S8 -","8","1","","Hanoun, J.-P.; Boyer, G.; Galy, J.-P.","Crystal structure of 6-butyl-2-chlorothiazolo[5,4-a]acridin-11(6H)- one, C~18~H~15~ClN~2~OS","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","455","456","","","","","","","","","","","","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101296","13.146","0.002","16.377","0.002","16.853","0.002","90","","91.191","0.002","90","","3627.7","0.7","203","2","203","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H58 N3 O2 Si6 Sm -","- C20 H58 N3 O2 Si6 Sm -","- C80 H232 N12 O8 Si24 Sm4 -","4","1","","Rabe, Gerd W.; Yap, Glenn P. A.","Crystal structure of samarium tris[bis(dimethylsilyl)amide]-bis (tetrahydrofuran), Sm[N(SiHMe~2~)~2~]~3~(THF)~2~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","457","458","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101297","11.4595","0.0016","8.4396","0.0005","26.2962","0.0019","90","","90","","90","","2543.2","0.4","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","BrCH\δbC(TeBrClPh)(CH2OH)","","","- C9 H9 Br2 Cl O Te -","- C9 H9 Br2 Cl O Te -","- C72 H72 Br16 Cl8 O8 Te8 -","8","1","","Schulz Lang, Ernesto; Burrow, Robert A.; Braga, Antonio Luiz; Dorneles, Luciano","Crystal structure of (2E)-3-bromo-2-[bromo(chloro)phenyl-λ^4 ^-tellanyl]-2-propen-1-ol, BrCH=C(TeBrClPh)(CH~2~OH)","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","459","460","","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","130149","2020-10-21","18:00:00",""
"8101299","8.568","0.002","10.741","0.002","18.287","0.004","90","","90","","90","","1682.9","0.6","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- Ba2 Mn2 O9 Si2 -","- Ba2 Mn2 O9 Si2 -","- Ba16 Mn16 O72 Si16 -","8","1","","Kaiser, Joachim W.; Jeitschko, Wolfgang","Crystal structure of dibarium dimanganese disilicium nonaoxide Ba~2~Mn~2~Si~2~O~9~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","313","314","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101300","6.93387","0.00044","6.93387","0.00044","11.2823","0.00081","90","","90","","90","","542.44","0.06","295","2","295","2","","","","","","","","4","I 4/m c m","-I 4 2c","140","Sr2LaGaO5","","","- Ga La O5 Sr2 -","- Ga La O5 Sr2 -","- Ga4 La4 O20 Sr8 -","4","0.125","","Gesing, Thorsten M.; Uecker, Reinhard; Buhl, J.-C.","Crystal structure of distrontium lanthanum gallium pentaoxide, Sr~2~LaGaO~5~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","317","317","","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101301","12.537","0.002","12.537","0.002","3.973","0.0001","90","","90","","90","","624.46","0.14","293","2","293","2","","","","","","","","3","P 4/m b m","-P 4 2ab","127","Potassium niobate","","","- K6 Nb10.8 O30 -","- K6 Nb10.812 O30 -","- K6 Nb10.812 O30 -","1","0.0625","","Becker, Petra; Held, Peter","Crystal structure of potassium niobate, K~6~Nb~10.80~O~30~, a partially filled tetragonal tungsten bronze-type structure","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","319","320","","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101302","10.6566","0.0002","10.6566","0.0002","10.6566","0.0002","90","","90","","90","","1210.2","0.04","293","2","293","2","","","","","","","","2","P m -3 n","-P 4n 2 3","223","","","","- Ba8 Ge43 -","- Ba8 Ge42.928 -","- Ba8 Ge42.928 -","1","0.0208333","","Carrillo-Cabrera, Wilder; Curda, Jan; Peters, Karl; Paschen, Silke; Baenitz, Michael; Grin, Yuri; von Schnering, Hans Georg","Crystal structure of the defect clathrate-I, Ba~8~Ge~43~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","321","322","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101303","11.677","0.001","3.647","0.0004","13.911","0.001","90","","90","","90","","592.41","0.09","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","Calcium-strontium-cyanamide-nitride","","","- C Ca3.2 N4 Sr0.8 -","- C Ca3.2 N4 Sr0.799 -","- C4 Ca12.8 N16 Sr3.196 -","4","0.5","","Höhn, Peter; Niewa, Rainer; Kniep, Rüdiger","Crystal structure of tetra(calcium/strontium) cyanamide dinitride, Ca~4‒x~Sr~x~[CN~2~]N~2~ (x = 0.80)","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","323","326","","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101304","9.143","0.001","9.143","0.001","16.624","0.003","90","","90","","90","","1389.7","0.4","293","2","293","2","","","","","","","","2","P 42/n :2","-P 4bc","86","Samarium Selenide SmSe1.9","","","- Se1.9 Sm -","- Se1.9 Sm -","- Se38 Sm20 -","20","2.5","","Dashjav, E.; Doert, Th.; Böttcher, P.; Mattausch, Hj.; Oeckler, O.","Crystal structure of samarium selenide, SmSe~1.90~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","337","338","","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101305","10.873","0.001","11.993","0.001","17.937","0.002","90","","90","","90","","2339","0.4","293","2","293","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","Dibarium calcium tetranitridotungstate(VI)","","","- Ba2 Ca N4 W -","- Ba2 Ca N4 W -","- Ba32 Ca16 N64 W16 -","16","0.5","","Höhn, Peter; Kniep, Rüdiger","Crystal structure of dibarium calcium [tetranitridotungstate(VI)], Ba~2~Ca[WN~4~]","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","331","332","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101306","17.793","0.001","10.295","0.001","9.891","0.001","90","","97.75","0.02","90","","1795.3","0.3","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","Tristrontium tetranitridomolybdate(VI)","","","- Mo N4 Sr3 -","- Mo N4 Sr3 -","- Mo12 N48 Sr36 -","12","1.5","","Höhn, Peter; Kniep, Rüdiger","Crystal structure of tetra(calcium/strontium) cyanamide dinitride, Ca~4‒x~Sr~x~[CN~2~]N~2~ (x = 0.80)","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","323","326","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101307","18.473","0.002","18.473","0.002","10.427","0.001","90","","90","","120","","3081.5","0.6","293","2","293","2","","","","","","","","3","P 3 1 c","P 3 -2c","159","Tribarium tetranitridotungstate(VI)","","","- Ba3 N4 W -","- Ba3 N4 W -","- Ba54 N72 W18 -","18","3","","Höhn, Peter; Kniep, Rüdiger","Crystal structure of the high temperature phase of tribarium [tetranitridotungstate(VI)], HT-Ba~3~[WN~4~]","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","329","330","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101308","6.153","0.001","6.795","0.001","8.506","0.001","90","","90.39","0.01","90","","355.62","0.09","293","2","293","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","Pentacalcium tetranitridotungstate(VI) dioxide","","","- Ca5 N4 O2 W -","- Ca5 N4 O2 W -","- Ca10 N8 O4 W2 -","2","0.5","","Höhn, Peter; Kniep, Rüdiger","Crystal structure of pentacalcium [tetranitridotungstate(VI)] dioxide, Ca~5~[WN~4~]O~2~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","333","334","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101309","18.441","0.005","18.441","0.005","10.401","0.003","90","","90","","120","","3063.2","1.5","293","2","293","2","","","","","","","","3","P 3 1 c","P 3 -2c","159","Tribarium tetranitridomolybdate(VI)","","","- Ba3 Mo N4 -","- Ba3 Mo N4 -","- Ba54 Mo18 N72 -","18","3","","Höhn, Peter; Kniep, Rüdiger","Crystal structure of the high temperature phase of tribarium [tetranitridomolybdate(VI)], HT-Ba~3~[MoN~4~]","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","327","328","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101310","12.848","0.003","12.896","0.003","8.5187","0.0012","90","","91.024","0.003","90","","1411.2","0.4","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- B H4 N O8 P2 Zn -","- B H4 N O8 P2 Zn -","- B8 H32 N8 O64 P16 Zn8 -","8","1","","Kniep, Rüdiger; Schäfer, Gerd; Borrmann, Horst","Crystal structure of ammonium [monozinco-monoboro-diphosphate], NH~4~ [ZnBP~2~O~8~]","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","335","336","","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101311","13.4912","0.001","4.675","","14.9614","0.001","90","0.006","115.164","0.004","90","0.004","854.08","0.09","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","bismute selenite","","","- Bi2 O9 Se3 -","- Bi2 O9 Se3 -","- Bi8 O36 Se12 -","4","1","","Rademacher, O.; Göbel, H.; Oppermann, H.","Crystal structure of bismuth selenite, Bi~2~(SeO~3~)~3~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","339","340","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101312","10.935","0.002","10.935","0.002","9.191","0.002","90","","90","","120","","951.8","0.3","293","2","293","2","","","","","","","","3","P -3 c 1","-P 3 2""c","165","aluminium cyclononaphosphate","","","- Al3 O27 P9 -","- Al0.75 O6.75 P2.25 -","- Al6 O54 P18 -","8","0.666667","","Fratzky, Dietmar; Scheneider, Matthias; Meisel, Manfred","Crystal structure of aluminium cyclononaphosphate, Al~3~P~9~O~27~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","341","342","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101313","14.147","0.003","14.147","0.003","14.147","0.003","90","","90","","90","","2831.3","1","293","2","293","2","","","","","","","","3","P -4 3 n","P -4n 2 3","218","","","","- Cs4 Se4 Si -","- Cs4 Se4 Si -","- Cs32 Se32 Si8 -","8","0.333333","","Schlirf, Jens; Deiseroth, Hans Jörg; Nilges, Tom","Crystal structure of cesium ortho-selenosilicate, Cs~4~SiSe~4~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","343","344","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101314","9.972","0.001","9.972","","7.214","0.001","90","","90","","120","","621.4","","293","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Br O12 P3 Sr5 -","- Br O12 P3 Sr5 -","- Br2 O24 P6 Sr10 -","2","0.166667","","Alberius-Henning, Peter; Mattsson, Charlotte; Lidin,Sven","Crystal structure of pentastrontium tris(phosphate) bromide, Sr~5~ (PO~4~)~3~Br and of pentabarium tris(phosphate) bromide","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","345","346","","","","","","","","0.0424","","","0.0236","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101315","10.342","0.002","10.342","","7.673","0.002","90","","90","","120","","710.7","","293","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Ba5 Br O12 P3 -","- Ba5 Br O12 P3 -","- Ba10 Br2 O24 P6 -","2","0.166667","","Alberius-Henning, Peter; Mattson, Charlotte; Lidin, Sven","Crystal structure of pentastrontium tris(phosphate) bromide, Sr~5~(PO~4~)~3~Br and of pentabarium tris(phosphate) bromide","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","345","346","","","","","","","","0.0221","","","0.0154","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101316","23.1511","0.0004","8.6277","0.0001","8.6536","0.0002","90","","90","","90","","1728.48","0.05","170","2","170","2","","","","","","","","3","C m c a","-C 2ac 2","64","","","","- K4 Sn2 Te6 -","- K4 Sn2 Te6 -","- K16 Sn8 Te24 -","4","","","Evenson, IV, Carl R.; Dorhout, Peter K.","Crystal structure of tetrapotassium hexatellurodistannate, K~4~Sn~2~Te~6~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","318","318","","","","","","","","0.0302","","","0.065","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101317","6.594","0.001","6.547","0.002","14.316","0.003","90","","101.1","0.02","90","","606.5","0.2","208","2","293","2","","","","","","","","3","P 1 c 1","P -2yc","7","","","","- Br7 Ga Se -","- Br7 Ga Se -","- Br14 Ga2 Se2 -","2","1","","Schulz Lang, Ernesto; Burrow, Robert Alan; Diniz, Juraci","Crystal structure of tribromoselenium(IV) tetrabromogallate(III), [SeBr~3~][GaBr~4~]","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","351","351","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101318","15.1959","0.0009","8.2988","0.0007","9.219","0.0014","90","","90","","90","","1162.6","0.2","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- As6 K10 Sn2 -","- As6 K10 Sn2 -","- As12 K20 Sn4 -","2","0.5","","Eisenmann, Brigitte; Rössler, Ute","Crystal structure of decapotassium hexaarsenidodistannate(IV), K~10~[Sn~2~As~6~]","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","347","348","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101319","8.9675","0.0014","8.9675","0.0015","16.664","0.003","90","","90","","90","","1340.1","0.4","293","2","293","2","","","","","","","","4","I 4/m c m","-I 4 2c","140","","","","- Ba4 Bi3 K O -","- Ba4 Bi3 K O -","- Ba16 Bi12 K4 O4 -","4","0.125","","Eisenmann, Brigitte; Rössler, Ute","Crystal structure of potassium tetrabarium tribismutide oxide, KBa~4~Bi~3~O","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","349","350","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101320","8.5429","0.0007","12.2051","0.0008","9.3549","0.0008","90","","90.884","0.007","90","","975.29","0.13","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- H4 Hg3 I2 O12 -","- H4 Hg3 I2 O12 -","- H16 Hg12 I8 O48 -","4","1","","Mormann, Thomas J.; Jeitschko, Wolfgang","Crystal structure of trimercury(II) dihydrogenhexaoxoiodate(VII), Hg~3~(H~2~IO~6~)~2~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","315","316","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101321","11.709","0.002","5.03","0.001","12.587","0.003","90","","91.27","0.03","90","","741.1","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C6 H4 N2 O6 -","- C6 H4 N2 O6 -","- C24 H16 N8 O24 -","4","1","","Kolev, Tsonko; Berkei, Michael; Hirsch, Claudia; Preut, Hans; Bleckmann, Paul; Radomirska, Valentina","Crystal structure of 4,6-dinitroresorcinol, C~6~H~4~N~2~O~6~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","483","484","","","","","","","","","","","","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101322","8.7643","0.0001","10.3305","0.0002","36.0581","0.0001","90","","90","","90","","3264.69","0.07","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C16 H14 N2 S3 -","- C16 H14 N2 S3 -","- C128 H112 N16 S24 -","8","1","","Tarafder, M. T. H.; Saravanan, N.; Crouse, K. A.; Yamin, Bohari M.; Raj, S. Shanmuga Sundara; Razak, I. A.; Fun, Hoong-Kun","Crystal structure of 2,5-di-S-benzyl(1-thia-3,4-diazacyclopenta-2, 5-diene), C~16~H~14~N~2~S~3~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","485","486","","","","","","","","","","","","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101323","5.6723","0.0001","30.5425","0.0006","7.9336","0.0002","90","","100.782","0.001","90","","1350.2","0.05","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C15 H12 N2 S2 -","- C15 H12 N2 S2 -","- C60 H48 N8 S8 -","4","1","","Tarafder, M. T. H.; Azahari, K.; Crouse, K. A.; Yamin, B. M.; Sundara Raj, S. Shanmuga; Ibrahim, A. R.; Fun, Hoong-Kun","Crystal structure of 2-S-benzyl-5-phenyl-1-(1-thia-3,4-diazacyclopenta- 2,4-diene), C~15~H~12~N~2~S~2~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","487","488","","","","","","","","","","","","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101324","16.0515","0.0016","11.5227","0.0011","8.2362","0.0008","90","","90","","90","","1523.3","0.3","296","2","296","2","","","","","","","","3","P b c n","-P 2n 2ab","60","","","","- C18 H12 S3 -","- C18 H3 S3 -","- C72 H12 S12 -","4","0.5","","Choi, Moon-Gun; Chang, Hong-Young; Guzei, Ilia A.","Crystal structure of 1,3,5-tris(thien-2-yl)benzene, C~18~H~12~S~3~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","491","492","","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","130149","2020-10-21","18:00:00",""
"8101325","11.9539","0.0004","14.0875","0.0003","18.2336","0.0007","77.005","0.002","85.833","0.001","65.372","0.002","2718.98","0.15","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","","","- C52 H64 O12 S4 -","- C52 H25 O12 S4 -","- C104 H50 O24 S8 -","2","1","","Thuéry, Pierre; Nierlich, Martine; Hall, Annegret K.; Harrowfield, Jack M.; Asfari, Zouhair; Vicens, Jacques","Crystal structure of tetra[(methoxycarbonyl)methoxy]-p-tert-butylthiacalix [4]arene, C~52~H~64~O~12~S~4~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","493","495","","","","","","","","0.0722","","","0.1877","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101326","5.822","0.001","6.375","0.002","29.932","0.007","90","","90","","90","","1110.9","0.5","193","2","193","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C10 H20 O4 -","- C10 H20 O4 -","- C40 H80 O16 -","4","1","","Wattenbach, Carsten; Sippel, Heike; Müller, Ulrich; Frauenrath, Herbert","Crystal structure of (2S*,4R*,5R*)-2-tert-butyl-5-hydroxy-4-methoxy- 5-methyl-1,3-dioxane, C~10~H~20~O~4~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","503","504","","","","","","","","","","","","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101327","9.804","0.002","9.898","0.002","12.358","0.002","90","","90","","90","","1199.2","0.4","298","2","298","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C10 H20 O4 -","- C10 H20 O4 -","- C40 H80 O16 -","4","1","","Wattenbach, Carsten; Sippel, Heike; Müller, Ulrich; Frauenrath, Herbert","Crystal structure of (2R*,4R*,5R*)-2-tert-butyl-5-hydroxy-4-methoxy- 5-methyl-1,3-dioxane, C~10~H~20~O~4~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","505","506","","","","","","","","","","","","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101328","5.986","0.001","24.551","0.001","11.574","0.001","90","","100.5","0.01","90","","1672.5","0.3","297","2","297","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C16 H21 Cl O5 -","- C16 H21 Cl O5 -","- C64 H84 Cl4 O20 -","4","2","","Wattenbach, Carsten; Sippel, Heike; Müller, Ulrich; Frauenrath, Herbert","Crystal structure of (2S,4S,5S)-3-chlorobenzoic acid 2-tert-butyl- 5-hydroxy-5-methyl-1,3-dioxan-4-yl ester, C~16~H~21~ClO~5~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","507","508","","","","","","","","","","","","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101329","6.241","0.001","10.588","0.001","14.697","0.001","90","","93.95","0.01","90","","968.9","0.2","297","2","297","2","","","","","","","","3","P 1 21 1","P 2yb","4","(1S)-Camphanic acid (2S,4S)-2-tert-butyl-4-methyl-1,3-dioxolan-4-ylmethyl ester","","","- C19 H30 O6 -","- C19 H30 O6 -","- C38 H60 O12 -","2","1","","Wattenbach, Carsten; Sippel, Heike; Müller, Ulrich; Frauenrath, Herbert","Crystal structure of (1'S)-camphanic acid (2S,4S)-2-tert-butyl-4-methyl- 1,3-dioxolan-4-ylmethyl ester, C~19~H~30~O~6~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","509","510","","","","","","","","","","","","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101330","6.319","0.002","10.43","0.002","14.389","0.002","90","","94.5","0.03","90","","945.4","0.4","193","2","193","2","","","","","","","","3","P 1 21 1","P 2yb","4","(1S)-Camphanic acid (2S,4S)-2-tert-butyl-4-methyl-1,3-dioxolan-4-ylmethyl ester and (1S)-camphanic acid (2R,4S)-2-tert-butyl-4-methyl-1,3-dioxolan-4-ylmethyl ester","","","- C19 H30 O6 -","- C19 H20 O6 -","- C38 H40 O12 -","2","1","","Wattenbach, Carsten; Rabe, Susanne; Müller, Ulrich; Frauenrath, Herbert","Crystal structure of (1'S)-camphanic acid (2S,4S)- and (2R,4S)-2-tert- butyl-4-methyl-1,3-dioxolan-4-ylmethyl ester mixed crystal, C~19~H~30~O~6~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","511","512","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101331","9.5173","0.0009","12.0593","0.0012","15.752","0.002","79.322","0.009","79.55","0.008","79.152","0.006","1724.6","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C31 H36 Cl Mn N5 O9 -","- C31 H36 Cl Mn N5 O9 -","- C62 H72 Cl2 Mn2 N10 O18 -","2","1","","Zhou, Xin-Hong; Yu, Wen-Tao; Wang, Ze-Xin; Fu, You-Jun","Crystal structure of bis(5,5'-dimethyl-2,2'-dipyridyl)-(p-aminobenzoato)- aquamanganese(II) perchlorate dihydrate, [(C~12~H~12~N~2~)~2~(NH~2~C~6~H~4~COO) (H~2~O)Mn]ClO~4~ · 2H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","496","498","","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","130149","2020-10-21","18:00:00",""
"8101332","13.8035","0.001","13.8035","0.001","9.2678","0.0015","90","","90","","90","","1765.9","0.3","566","2","","","","","","","","","","6","P 42/n","","","","","","- C4 H16 Cd Cl2 N8 S4 -","- C4 H16 Cd0.5 Cl2 N8 S4 -","- C16 H64 Cd2 Cl8 N32 S16 -","4","","","Jiang, Xue Ning; Yu, Wen Tao; Yuan, Duo Rong; Xu, Dong; Lv, Meng Kai; Wang, Xin Qiang; Guo, Shi Yi; Jiang, Min Hua","Redetermination of the crystal structure of dichlorotetrakisthioureacadmium, C~4~H~16~CdCl~2~N~8~S~4~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","499","500","","","","","","","","","","","","","","","","","","","","","","has coordinates","102820","2020-10-21","18:00:00",""
"8101333","6.1338","0.0019","13.6642","0.0015","16.565","0.031","90","","90","","90","","1388.4","0.4","298","2","298","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C13 H20 O6 -","- C13 H20 O6 -","- C52 H80 O24 -","4","1","","Kelling, Alexandra; Schilde, Uwe; Sefkow, Michael","Crystal structure of (3aR,4'R,7R,7aS)-tetrahydro-7-hydroxy-2,2,2', 2'-tetramethylspiro[1,3-benzodioxole-5(4H),4'-[1,3]dioxolan]-5'-one, C~13~H~20~O~6~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","513","514","","","","","","","","","","","","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101334","7.0003","0.0012","11.863","0.002","13.031","0.002","104.69","0.017","93.526","0.018","90.837","0.019","1044.3","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H20 Cr N7 O12 -","- C14 H20 Cr N7 O12 -","- C28 H40 Cr2 N14 O24 -","2","1","","Hueso-Ureña, Francisco; Moreno-Carretero, Miguel N.; Peñas-Chamorro, Antonio L.; Debaerdemaeker, Tony; Esteve, Vicente; Amigó, José M.","Crystal structure of mer-triaqua-[6-amino-5-formyl-1,3-dimethyluracilate benzoylhydrazone-N,N',O] chromium(II) nitrate, C~14~H~20~CrN~7~O~12~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","519","520","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101335","8.187","0.003","21.053","0.006","10.673","0.005","90","","106.66","0.03","90","","1762","1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C19 H15 Cl Cu N2 O4 -","- C19 H15 Cl Cu N2 O4 -","- C76 H60 Cl4 Cu4 N8 O16 -","4","1","","Lemoine, Pascale; Tomas, Alain; Nguyen-Huy, Dung; Viossat, Bernard","Crystal structure of aquachloro(salicylato)(1,10-phenanthroline)-copper (II), C~19~H~15~ClCuN~2~O~4~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","521","522","","","","","","","","0.0518","","","0.1293","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101336","8.081","0.001","9.689","0.001","19.338","0.002","90","","90","","90","","1514.1","0.3","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C12 H14 Mn N2 O7 S -","- C12 H14 Mn N2 O7 S -","- C48 H56 Mn4 N8 O28 S4 -","4","1","","Zheng, Yue-Qing; Lin, Jian-Li; Kong, Zu-Ping","Crystal structure of triaqua-(1,10-phenanthroline-N,N')sulfatomanganese (II), Mn(C~12~H~8~N~2~)(H~2~O)~3~SO~4~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","531","532","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101337","8.151","0.001","9.52","0.001","11.845","0.001","96.7","0.01","104.45","0.01","102.38","0.01","855.18","0.16","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H42 Cu2 N4 O16 -","- C28 H42 Cu2 N4 O16 -","- C28 H42 Cu2 N4 O16 -","1","0.5","","Zheng, Yue-Qing; Sun, Jie; Lin, Jian-Li","Crystal structure of diaqua-di-μ-hydroxo-bis-(1,10-phenanthroline- N,N')- dicopper(II) succinate octahydrate, [Cu~2~(C~12~H~8~N~2~)~2~ (H~2~O)~2~(OH)~2~](C~4~H~4~O~4~) · 8H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","533","534","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101338","13.933","0.002","4.782","0.001","9.281","0.002","90","","90.62","0.01","90","","618.3","0.2","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C5 H6 O4 Zn -","- C5 H6 O4 Zn -","- C20 H24 O16 Zn4 -","4","1","","Zheng, Yue-Qing; Lin, Jian-Li; Zhang, Hong-Liang","Crystal structure of zinc glutarate, Zn(C~5~H~6~O~4~)","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","535","536","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101339","5.717","0.0005","25.181","0.002","7.4923","0.0007","90","","90","","90","","1078.61","0.16","293","2","293","2","","","","","","","","6","P b c m","-P 2c 2b","57","","","","- C5 H15 Br K N O4 -","- C5 H15.04 Br K N O4.04 -","- C20 H60.16 Br4 K4 N4 O16.16 -","4","0.5","","Andrade, L. C. R.; Costa, M. M. R.; Pinto, Filipa; Paixão, J. A.; Almeida, A.; Chaves, M. R.; Klöpperpieper, A.","Crystal structure of betaine potassium bromide dihydrate, C~5~H~11~NO~2~ · KBr · 2H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","537","538","","","","","","","","","","","","","","","","","","","","","","has coordinates","132283","2020-10-21","18:00:00",""
"8101340","15.944","0.002","26.895","0.004","13.359","0.002","90","","100.45","0.05","90","","5633.5","1.4","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","phtalimido-spirophosphoran","","","- C62 H60 N2 P2 -","- C31 H30 N0.5 O7.5 P -","- C248 H240 N4 O60 P8 -","8","2","","Neuman, Alain; Leroux, Yves; El Manouni, Driss; Prangé, Thierry","Crystal structure of 9-benzoyl-5-methoxy-7-phenyl-7-phthalimido-2, 2,3,3-tetramethyl-1,4,6-trioxa-5-phospha(V)spiro[4.4]non-8-en, C~62~H~60~N~2~O~14~P~2~ and of dimethyl 3-(4,4,4',4',5,5,5',5'-octamethyl-1,1',3,3'-tetraoxa-2-phospha(V)-spiro[4.4] nonanyl)-2(N,N-dimethyl)succinate), C~20~H~38~NO~8~P, two tetraoxaspiro-phosphorane(V) intermediates","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","539","543","","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","176466","2020-10-21","18:00:00",""
"8101341","15.915","0.002","15.829","0.002","9.955","0.002","90","0.03","95.86","0.03","90","0.03","2494.7","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","dimethylamino-spirophosphoran","","","- C20 H38 N O8 P -","- C20 H38 N O8 P -","- C80 H152 N4 O32 P4 -","4","1","","Neuman, Alain; Leroux, Yves; El Manouni, Driss; Prangé, Thierry","Crystal structure of 9-benzoyl-5-methoxy-7-phenyl-7-phthalimido-2, 2,3,3-tetramethyl-1,4,6-trioxa-5-phospha(V)spiro[4.4]non-8-en, C~62~H~60~N~2~O~14~P~2~ and of dimethyl 3-(4,4,4',4',5,5,5',5'-octamethyl-1,1',3,3'-tetraoxa- 2-phospha(V)-spiro[4.4]nonanyl)-2(N,N-dimethyl)succinate), C~20~H~38~NO~8~P, two tetraoxaspiro-phosphorane(V) intermediates","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","539","543","","","","","","","","","","","","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101342","16.162","0.003","16.234","0.003","18.301","0.004","75.82","0.03","79.79","0.03","71.16","0.03","4380.8","1.5","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C92 H120 O20 -","- C92 H120 O20 -","- C184 H240 O40 -","2","1","","Leverd, Pascal C.; Huc, Vincent; Palacin, Serge; Nierlich, Martine","Crystal structure of octa(p-hydroxy)octakis(propyloxy)calix[8]arene‒ acetone (1/4), C~80~H~96~O~16~ · 4CH~3~COCH~3~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","549","552","","","","","","","","","","","","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101343","6.0591","0.0003","15.2931","0.0009","20.501","0.001","98.598","0.002","97.471","0.003","96.224","0.003","1846.5","0.2","173","","173","","","","","","","","","3","P -1","-P 1","2","","","","- C22 H24 O3 -","- C22 H24 O3 -","- C88 H96 O12 -","4","2","","Avery, T. D.; Fallon, G. D.; Taylor, D. K.; Tiekink, E. R. T.","Crystal structure of tert-butyl 2-(2-oxo-2-phenylethyl)-3-phenyl-cyclopropane carboxylate, C~22~H~24~O~3~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","544","546","","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101344","5.13","0.001","18.879","0.003","14.454","0.003","90","","93.5","0.01","90","","1397.2","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H14 N2 O4 S -","- C14 H14 N2 O4 S -","- C56 H56 N8 O16 S4 -","4","1","","Heynderickx, Arnault; Lokshin, Vladimir; Samat, André; Guglielmetti, Robert; Pèpe, Gérard","Crystal structure of 2-(4-nitro-2-ethylsulfonylbenzyl)pyridine, C~14~H~14~N~2~O~4~S","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","553","554","","","","","","","","0.0426","","","0.0865","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101345","21.993","0.005","13.639","0.004","16.042","0.005","90","","107.95","0.02","90","","4577","2","296.2","","296.2","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","S-[4-(2,6-Dimethylphenylselenide)-3,5-dimethyl-phenyl]-dibenzothiophenium bis(triflate) hydrate'","","","- C21 H18.78 F3 O4.39 S2 Se0.5 -","- C42 H32 F6 O8.78 S4 Se0.5 -","- C168 H128 F24 O35.12 S16 Se2 -","4","0.5","","Horn, E.; Zhang, S.-Z.; Nakahodo, T.; Sato, Soichi; Furukawa, Naomichi","Crystal structure of S-[4-(2,6-dimethylphenylselenide)-3,5-dimethyl- phenyl]-dibenzothiophenium bis(triflate) hydrate, [C~20~H~16~SSe~0.5~] ~2~ · (CF~3~O~3~S)~2~ · 2.78H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","555","556","","","","","","","","0.0663","","","0.0719","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101346","8.6733","0.0001","16.936","0.0001","23.7983","0.0001","90","0.01","90","0.01","90","0.01","3495.76","0.08","293","","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C19 H18 I N O -","- C19 H18 I N O -","- C152 H144 I8 N8 O8 -","8","1","","Kakou-Yao, R.; Uncuta, C.; Aycard, J.P.","Crystal structure of N-(4-methyl-6-phenyl-2H-pyran-2-ylidene)-N-methyl benzenaminium iodide, C~19~H~18~INO","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","563","564","","","","","","","","","","","","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101347","11.4205","0.0017","28.422","0.005","21.796","0.004","90","","96.6","0.004","90","","7027.9","1.9","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C36 H108 N6 O3 Si12 Yb3 -","- C32 H100 N6 O2 Si12 Yb3 -","- C128 H400 N24 O8 Si48 Yb12 -","4","1","","Rabe, Gerd W.; Rheingold, A. L.; Incarvito, C. D.","Crystal structure of ytterbium-bis[bis(μ-dimethylsilylamido) ytterbium-dimethylsilylamide(tetrahydrofuran)]‒tetrahydrofuran (1/1), C~32~H~100~N~6~O~2~Si~12~Yb~3~ · C~4~H~8~O","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","560","562","","","","","","","","","","","","","","","","","","","","","","has coordinates","200436","2020-10-21","18:00:00",""
"8101348","9.1974","0.0003","11.7178","0.0005","12.8801","0.0006","95.278","0.002","90.593","0.002","101.721","0.002","1352.8","0.6","298","","","","","","","","","","","6","P -1","-P 1","2","","","","- C25 H34 Cl N3 O7 Zn -","- C25 H34 Cl N3 O7 Zn -","- C50 H68 Cl2 N6 O14 Zn2 -","2","1","","Kaizer, József; Kupán, Ádám; Pap, József; Speier, Gábor; Réglier, Marius; Michel, Giorgi","Crystal structure of [3,3'-iminobis(N,N-dimethylpropylamine)] (flavonolato) zinc(II) perchlorate, [Zn(fla)(idpaH)]ClO~4~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","571","572","","","","","","","","","","","","","","","","1.379","1.379","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101349","34.555","0.001","7.125","0.001","24.33","0.001","90","0.01","121","0.01","90","0.01","5134.35","0.02","293","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C25 H21 Cl3 I N O -","- C25 H20 Cl3 I N O -","- C200 H160 Cl24 I8 N8 O8 -","8","1","","Kakou-Yao, R.; Uncuta, C.; Aycard, J.P.","Crystal structure of N-(4,6-diphenyl-2H-pyran-2-ylidene)-N-methyl benzenaminium iodide‒chloroform, C~24~H~20~INO · CHCl~3~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","565","566","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101350","7.8307","0.0007","12.39","0.0011","15.4824","0.0019","90","","90","","90","","1502.1","0.3","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C14 H14 Cu N2 O6 -","- C14 H14 Cu N2 O6 -","- C56 H56 Cu4 N8 O24 -","4","0.5","","Krupicka, Erik; Grünert, Anke; Lentz, Axel","Crystal structure of polymeric diaquabis(pyridine)-μ~2~-squarato (1,3)copper(II), [Cu(C~4~O~4~)(C~5~H~5~N)~2~(H~2~O)~2~]","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","573","574","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101351","8.895","0.004","8.895","0.004","20.683","0.011","90","","90","","90","","1636.5","1.3","193","2","193","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C12 H20 S6 -","- C12 H20 S6 -","- C48 H80 S24 -","4","0.25","","Mahjoub, Ahmed; Zantour, Hédi","Crystal structure of 1,3,5,7-tetraethyl-2,4,6,8,9,10-hexathiaadamantane, C~4~S~6~(C~2~H~5~)~4~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","577","578","","","","","","","","0.0461","","","0.1016","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101352","11.886","0.004","10.672","0.004","12.198","0.009","90","","106.06","0.04","90","","1486.9","1.3","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C15 H17 N3 O2 -","- C15 H17 N3 O2 -","- C60 H68 N12 O8 -","4","1","","Matos Beja, A.; Paixão, J. A.; Ramos Silva, M.; Alte da Veiga, L.","Crystal structure of N,N'-diphenylguanidinium acetate, C~13~H~14~N~3~ ^+^C~2~H~3~O~2~^‒^","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","579","580","","","","","","","","","","","","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101353","6.872","0.001","7.975","0.001","10.477","0.001","70.46","0.01","84.9","0.02","66.26","0.01","494.63","0.11","293","2","293","2","","","","","","","","4","P -1","-P 1","2","Guanidinium urate monohydrate","","","- C6 H11 N7 O4 -","- C6 H11 N7 O4 -","- C12 H22 N14 O8 -","2","1","","Poje, Nevenka; Poje, Mirko; Vicković, Ivan","Crystal structure of guanidinium urate monohydrate, C~5~H~3~N~4~O~3~ (CH~6~N~3~) · H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","583","584","","","","","","","","","","","","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101354","7.155","0.002","17.35","0.01","13.902","0.005","90","","100.54","0.02","90","","1696","1","173","","173","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H19 B10 N O2 -","- C12 H19 B10 N O2 -","- C48 H76 B40 N4 O8 -","4","1","","Rendina, L. M.; Todd, J. A.; Tiekink, E. R. T.","Crystal structure of 1-(phthalimidoethyl)-1,2-dicarba-closo-dodecaborane, C~12~H~19~B~10~NO~2~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","547","548","","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101355","9.867","0.004","9.246","0.003","12.2","0.005","90","","110.93","0.03","90","","1039.6","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C5 H14 Cl N O7 -","- C2.5 H7 Cl0.5 N0.5 O3.5 -","- C20 H56 Cl4 N4 O28 -","8","2","","Matos Beja, A.; Paixão, J. A.; Ramos Silva, M.; Alte da Veiga, L.","Crystal structure of betainium perchlorate hydrate, [(CH~3~)~3~NCH~2~COOH] ClO~4~ · H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","581","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101356","16.775","0.003","9.539","0.002","23.524","0.005","90","","90","","90","","3764.2","1.3","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C21 H29 N O -","- C21 H29 N O -","- C168 H232 N8 O8 -","8","1","","Kaltia, Seppo; Matikainen, Jorma; Hase, Tapio; Mutikainen, Ilpo","Crystal structure of 5-(1-pentyl)-2,3,3aα,4,5,7aα-hexahydroindene- 4α-carboxanilide, C~21~H~29~NO","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","585","586","","","","","","","","0.0915","","","0.2029","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101357","15.703","0.002","16.65","0.002","10.085","0.002","90.4","0.01","104.29","0.01","112.5","0.01","2345.5","0.7","296.2","","296.2","","","","","","","","","6","P -1","-P 1","2","","","","- C34 H48 F6 O7 S4 Si4 -","- C34 H48 F6 O7 S4 Si4 -","- C68 H96 F12 O14 S8 Si8 -","2","1","","Horn, E.; Zhang, S.-Z.; Furukawa, N.","Crystal structure of S,S'-4,4'-diphenyl ether 2,5-bis(trimethylsilyl) thiophenium bis(triflate), C~32~H~48~OS~2~Si~4~(CF~3~SO~3~)~2~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","557","559","10.1515/ncrs-2000-0443","","","","","","","0.0789","","","0.0765","","","","","","","","","","","has coordinates","209540","2020-10-21","18:00:00",""
"8101358","6.5806","0.0018","7.3726","0.0017","16.681","0.003","90","","91.102","0.018","90","","809.1","0.3","298","2","298","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C15 H24 O8 -","- C15 H24 O8 -","- C30 H48 O16 -","2","1","","Kelling, Alexandra; Schilde, Uwe; Sefkow, Michael","Crystal structure of (1R,2R,4S,6R,8S)-2',2'-dimethoxy-8-hydroxyspiro [3,5,10-trioxa-tricyclo[6.2.1.0^2,6^]undecan-4,1'-cyclohexan]-9-one monohydrate, C~15~H~24~O~8~ and of (1R,2R,4R,6R,8S)-2',2'-dimethoxy- 8-hydroxyspiro[3,5,10-trioxa- tricyclo[6.2.1.0^2,6^]undecan-4,1'-cyclohexan]- 9-one, C~15~H~22~O~7~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","515","518","","","","","","","","","","","","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101359","12.2868","0.0008","8.2168","0.0005","14.8921","0.0009","90","","98.571","0.005","90","","1486.69","0.1","298","2","298","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C15 H22 O7 -","- C15 H22 O7 -","- C60 H88 O28 -","4","2","","Kelling, Alexandra; Schilde, Uwe; Sefkow, Michael","Crystal structure of (1R,2R,4S,6R,8S)-2',2'-dimethoxy-8-hydroxyspiro [3,5,10-trioxa-tricyclo[6.2.1.0^2,6^]undecan-4,1'-cyclohexan]-9-one monohydrate, C~15~H~24~O~8~ and of (1R,2R,4R,6R,8S)-2',2'-dimethoxy- 8-hydroxyspiro[3,5,10-trioxa- tricyclo[6.2.1.0^2,6^]undecan-4,1'-cyclohexan]- 9-one, C~15~H~22~O~7~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","515","518","","","","","","","","","","","","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101360","9.2255","0.0012","10.734","0.0018","15.0751","0.0012","77.972","0.008","72.634","0.008","74.154","0.011","1357.5","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C16 H8 Cl6 F6 N2 Nb2 O2 -","- C16 H8 Cl6 F6 N2 Nb2 O2 -","- C32 H16 Cl12 F12 N4 Nb4 O4 -","2","1","","Stumpf, Klaus; Blachnik, Roger; Reuter, Hans; Kastner, Guido","Crystal structure of tetrakis(trichloro(3-trifluoromethylbenzonitrile)- μ-oxoniobium(V)), [NbOCl~3~{(m-CF~3~)C~6~H~4~CN}]~4~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","587","588","","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","130149","2020-10-21","18:00:00",""
"8101361","9.944","0.002","10.179","0.002","11.893","0.002","88.9","","70.25","","72.96","","1079","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H15 Cl5 Nb P S -","- C18 H15 Cl5 Nb P S -","- C36 H30 Cl10 Nb2 P2 S2 -","2","1","","Stumpf, Klaus; Blachnik, Roger; Roth, Georg; Kastner, Guido","Crystal structure of pentachloro(triphenylphosphinesulfide)niobium (V), NbCl~5~(Ph~3~PS)","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","589","590","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101362","12.483","0.001","13.865","0.001","20.597","0.001","90.355","0.001","105.389","0.001","112.868","0.001","3142.8","0.4","291","1","291","1","","","","","","","","5","P -1","-P 1","2","","","","- C48 H83 O19.5 P3 Ti4 -","- C48 H83 O19.5 P3 Ti4 -","- C96 H166 O39 P6 Ti8 -","2","1","","Mehring, Michael; Schürmann, Markus; Mutin, P. Hubert; Viouxé, Andre","Crystal structure of (μ-oxo)-tris(μ-isopropoxy)-pentakis (isopropoxy)-tris(phenylphosphonato)-tetrahydrofuran-tetratitanium tetrahydrofuran solvate, [Ti~4~(μ~3~-O)(μ-O^i^Pr)~3~(O ^i^Pr)~5~(PhPO~3~)~3~(THF)] · 1/2 THF","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","591","594","","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","176466","2020-10-21","18:00:00",""
"8101363","7.764","0.001","17.758","0.002","7.869","0.001","90","","113.28","0.01","90","","996.6","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H16 B N O -","- C10 H16 B N O -","- C40 H64 B4 N4 O4 -","4","1","","Peters, Karl; Peters, Eva-Maria; Drinkuth, Stefan; Groetsch, Stefan; Christl, Manfred","Crystal structure of (1α,5β,8β,8aβ)-1-methyl- 1,2,3,5,8,8a-hexahydro-5,8- epoxychinolin(N-B)boran, C~9~H~10~NO(CH~3~) (BH~3~)","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","600","600","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101364","21.491","0.003","6.89","0.0008","7.8399","0.0008","90","","90","","90","","1160.9","0.2","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C12 H12 N2 O4 -","- C12 H12 N2 O4 -","- C48 H48 N8 O16 -","4","0.5","","Peters, Karl; Peters, Eva-Maria; Cohrs, Carsten; Reuchlein, Horst; Christl, Manfred","Crystal structure of 6,7-dihydro-5,7-methano-5H-cyclopenta[d]pyridazin- 1,4-dicarboxylic acid dimethyl ester, C~12~H~12~N~2~O~4~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","601","602","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101365","8.655","0.005","11.269","0.005","9.224","0.005","90","0.005","97.533","0.005","90","0.005","891.9","0.8","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C2 H7 F2.5 N O0.5 Ti0.5 -","- C4 H14 F5 N2 O Ti -","- C16 H56 F20 N8 O4 Ti4 -","4","1","","Dadachov, S. Mike; Tang, Liqiu; Zou, Xiaodong","Crystal structure of dipiperazine decafluorodititanate dihydrate, (C~4~H~12~N~2~)~2~[Ti~2~F~10~] · 2H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","605","606","","","","","","","","0.0317","","","0.0881","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101366","9.3672","0.0019","31.897","0.006","10.105","0.002","90","","106.43","0.03","90","","2895.9","1","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C29 H36 N2 O7 S -","- C29 H36 N2 O7 S -","- C116 H144 N8 O28 S4 -","4","2","","Ousmer, Malika; Braun, Norbert A.; Ciufolini, Marco A.; Perrin, Monique","Crystal structure of (1S,3S,6S,7S,8S,9R)-7-acetoxy-9-hydroxy-6-(4- methoxybenzyl)-3-[N-methyl-N-(4-methylphenyl)sulfonylamino]-5-azatricyclo [6.3.1.0^1.5^]dodecan-4-one, C~29~H~36~N~2~O~7~S","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","597","599","","","","","","","","","","","","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101367","16.8061","0.0003","13.0107","0.0002","21.4","0.0003","90","","113.118","0.001","90","","4303.55","0.12","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H76 Cl2 Ir2 P4 -","- C34 H76 Cl2 Ir2 P4 -","- C136 H304 Cl8 Ir8 P16 -","4","1","","Hofmann, Peter; Meier, Claudia; Maier, Alfons; Steck, Oliver; Sporys, Volker; Rominger, Frank","Crystal structure of di-μ~2~-chlorobis[bis(di-tert-butylphosphino)- methane]diiridium, C~34~H~76~Cl~2~Ir~2~P~4~ and of di-μ~2~-iodobis [bis(di-tert-butylphosphino)methane]diiridium, C~34~H~76~I~2~Ir~2~P~4~, two halide-bridged iridium dimers","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","609","614","","","","","","","","0.0529","","","0.1395","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101368","23.8048","0.0003","15.952","0.0003","24.1559","0.0005","90","","107.084","0.001","90","","8768.1","0.3","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H76 I2 Ir2 P4 -","- C34 H76 I2 Ir2 P4 -","- C272 H608 I16 Ir16 P32 -","8","2","","Hofmann, Peter; Meier, Claudia; Maier, Alfons; Steck, Oliver; Sporys, Volker; Rominger, Frank","Crystal structure of di-μ~2~-chlorobis[bis(di-tert-butylphosphino)- methane]diiridium, C~34~H~76~Cl~2~Ir~2~P~4~ and of di-μ~2~-iodobis [bis(di-tert-butylphosphino)methane]diiridium, C~34~H~76~I~2~Ir~2~P~4~, two halide-bridged iridium dimers","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","609","614","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101369","10.084","0.001","13.767","0.002","11.783","0.003","90","","113.15","0.01","90","","1504.1","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H21 N O3 -","- C17 H21 N O3 -","- C68 H84 N4 O12 -","4","1","","Dinesh, C. U.; Reißig, H.-U.; Rademacher, O.","Crystal structure of methyl 4aR*,4bR*,8aS*,9R*-1-cyano-4b-hydroxy- 2,4a,4b,5,6,7,8,8a,9,10-decahydrophenanthrene-9-carboxylate, C~17~H~21~NO~3~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","615","616","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101370","8.1248","0.0001","19.1264","0.0002","21.7702","0.0002","90","","90","","90","","3383.1","0.1","293","2","293","2","","","","","","","","6","P c a 21","P 2c -2ac","29","3-(p-Chlorophenyl)-5-methyl-2-(8-quinolinyl)-4-thiazolidinone","","","- C19 H16 Cl N2 O S -","- C19 H16 Cl N2 O S -","- C152 H128 Cl8 N16 O8 S8 -","8","2","","Öztürk, S.; Aygün, M.; Öcal, N.; Yolaçan, Ç.; Fun, H.-K.","Crystal structure of 3-(p-chlorophenyl)-5-methyl-2-(8-quinolinyl)- 4-thiazolidinone, C~19~H~16~ClN~2~OS","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","526","528","","","","","","","","","","","","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101371","17.2576","0.0016","17.2576","0.0016","4.2647","0.0007","90","","90","","90","","1270.1","0.3","293","2","293","2","","","","","","","","6","I -4","I -4","82","","","","- C8 H16 Cd N12 S8 Zn -","- C8 H16 Cd N12 S8 Zn -","- C16 H32 Cd2 N24 S16 Zn2 -","2","0.25","","Jiang, Xue Ning; Yu, Wen Tao; Xu, Dong; Yuan, Duo Rong; Lu, Meng Kai; Guo, Shi Yi; Meng, Fan Qing; Zhang, Guang Hui; Wang, Xin Qiang; Jiang, Min Hua","Crystal structure of crystal structure of tetrakis(thiourea)cadmium tetrakis(thiocyanato)zincate, [Cd(NH~2~CSNH~2~)~4~][Zn(SCN)~4~]","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","501","502","","","","","","","","0.0688","","","0.1782","","","","","","","","","","","has coordinates,has disorder","176466","2020-10-21","18:00:00",""
"8101372","10.197","0.001","11.819","0.004","14.786","0.003","99.95","0.01","93.57","0.01","105.07","0.01","1684","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C72 H84 Cu2 N4 O12 -","- C72 H84 Cu2 N4 O12 -","- C72 H84 Cu2 N4 O12 -","1","0.5","","Lemoine, Pascale; Mazurier, Alain; Billy, Isabelle; Nguyen-Huy, Dung; Viossat, Bernard","Crystal structure of bis[(μ-O,O'-diisopropylsalicylato)(2,2'-bipyridyl) copper(II)]‒bis(diisopropylsalicylic acid), C~72~H~84~Cu~2~N~4~O~12~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","523","525","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101373","10.363","0.001","25.415","0.001","12.941","0.001","90","0.01","154.651","0.006","90","0.01","1459.2","0.2","298","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C19 H18 O -","- C19 H18 O -","- C76 H72 O4 -","4","1","","Kakou-Yao, R.; Aycard, J.P.","Crystal structure of 1-(6-phenylcyclohex-3-enyl)-1-phenylmethanone, C~19~H~18~O","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","567","568","","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101374","7.104","0.001","28.784","0.001","5.444","0.001","90","0.01","106.21","0.01","90","0.01","1068.9","0.3","298","","","","","","","","","","","3","C 1 c 1","C -2yc","9","","","","- C13 H16 O -","- C13 H16 O -","- C52 H64 O4 -","4","1","","Kakou-Yao, R.; Aycard, J. P.","Crystal structure of (6-phenylcyclohex-3-enyl)methanol, C~13~H~16~O","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","569","570","","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101375","9.71","0.003","9.254","0.001","10.373","0.006","90","0.03","100.36","0.05","90","0.02","916.9","0.5","296.2","","296.2","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C5 H8 N3 O6 P -","- C5 H8 N3 O6 P -","- C20 H32 N12 O24 P4 -","4","1","","Akriche, Samah; Rzaigui, Mohamed","Crystal structure of 2-amino-3-nitro-pyridinium dihydrogenmonophosphate, C~5~H~8~N~3~O~6~P","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","617","618","","","","","","","","","","","","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101376","8.012","0.0016","21.785","0.004","12.449","0.003","90","","90.19","0.03","90","","2172.9","0.8","223","2","223","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","2,2'-bipyrimidine-bis(acetonitrile)-palladium(II) bis(tetrafluroborate)– acetontrile (1/1)","","","- C14 H15 B2 F8 N7 Pd -","- C14 H15 B2 F11 N7 Pd -","- C56 H60 B8 F44 N28 Pd4 -","4","1","","Magna, Lionel; Niccolai, Gerald P.; Chauvin, Yves; Basset, Jean-Marie; Perrin, Monique","Crystal structure of 2,2'-bipyrimidine-bis(acetonitrile)-palladium (II) bis(tetrafluroborate)–acetontrile (1/1), C~14~H~15~B~2~F~8~N~7~Pd","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","595","596","","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","288271","2023-12-12","22:25:27",""
"8101377","6.826","0.005","6.928","0.005","13.315","0.005","82.338","0.005","88.42","0.005","62.2","0.005","551.6","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C3 H8 F3 N O0.5 Ti0.5 -","- C6 H16 F6 N2 O Ti -","- C12 H32 F12 N4 O2 Ti2 -","2","1","","Dadachov, Mike S.; Tang, Liqiu; Zou, Xiaodong","Crystal structure of 1,4-diazabicyclo[2.2.2]octane hexafluorotitanium hydrate, (C~6~H~14~N~2~)[TiF~6~] · H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","607","608","","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101378","7.123","0.0002","15.139","0.0004","7.185","0.0002","90","","111.395","0.0014","90","","721.4","0.03","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Diaquacadmium succinate","","","- C4 H8 Cd O6 -","- C4 H8 Cd O6 -","- C16 H32 Cd4 O24 -","4","1","","Fleck, Michel; Tillmanns, Ekkehart; Bohaty, Ladislav","Crystal structure of diaquacadmium succinate, Cd(H~2~O)~2~C~4~H~4~O~4~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","619","620","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101379","5.94","0.001","8.214","0.0013","19.44","0.003","90","","92.18","0.014","90","","947.8","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H7 Cu N O5 -","- C9 H7 Cu N O5 -","- C36 H28 Cu4 N4 O20 -","4","1","","Krupicka, Erik; Lentz, Axel","Crystal structure of polymeric aqua-pyridine-μ~4~-squarato-copper (II), [Cu(C~5~H~5~N)(C~4~O~4~)(H~2~O)]","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","575","576","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101380","11.1647","0.0005","11.1647","0.0005","8.3352","0.0004","90","","90","","90","","1038.99","0.08","100","","100","2","","","","","","","","4","I -4 2 m","I -4 2","121","Caesium Tetraphenylborate","","","- C24 H20 B Cs -","- C24 H20 B Cs -","- C48 H40 B2 Cs2 -","2","0.125","","Bryan, Jeffrey C.","Crystal structure of caesium tetraphenylborate, (C~24~H~20~B)Cs","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","621","622","","","","","","","","","","","","","","","","","","","","","","has coordinates","277875","2022-09-15","11:59:41",""
"8101381","7.719","0.002","9.693","0.002","11.687","0.002","80.95","0.03","81.75","0.03","84.59","0.03","852.3","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C8 H36 Mo8 N4 O30 -","- C8 H36 Mo8 N4 O30 -","- C8 H36 Mo8 N4 O30 -","1","0.5","","Turpeinen, Urho; Klinga, Martti; Hämälänen, Reijo","Crystal structure of diammonium bis[dimethyl(2-hydroxyethyl)ammonium octamolybdate diwater, (C~4~H~12~NO)~2~(NH~4~)~2~[Mo~8~O~26~] · 2H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","623","624","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101382","7.252","0.003","10.391","0.002","20.662","0.002","82.53","","89.9","","89.71","","1543.8","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H15 Fe N O2 -","- C20 H15 Fe N O2 -","- C80 H60 Fe4 N4 O8 -","4","2","","Ponikwar, Walter; Bauer, Werner; Beck, Wolfgang","Crystal structure of 4-ferrocenylmethylene-2-phenyl-4H-oxazol-5-one, C~20~H~15~FeNO~2~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","625","626","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101383","4.698","0.001","12.653","0.001","14.808","0.002","90","","90","","90","","880.2","0.2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","cis-2-Azido-indan-1-ol","","","- C9 H9 N3 O -","- C9 H9 N3 O -","- C36 H36 N12 O4 -","4","1","","Steinwascher, Jörg; Lex, Johann; Griesbeck, Axel G.","Crystal structures of cis- and trans-2-azido-indan-1-ol, C~9~H~9~N~3~O","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","627","629","","","","","","","","","","","","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101384","12.763","0.002","4.774","0.001","29.048","0.005","90","","97.35","0.02","90","","1755.4","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","trans-2-Azido-indan-1-ol","","","- C9 H9 N3 O -","- C9 H9 N3 O -","- C72 H72 N24 O8 -","8","2","","Steinwascher, Jörg; Lex, Johann; Griesbeck, Axel G.","Crystal structures of cis- and trans-2-azido-indan-1-ol, C~9~H~9~N~3~O","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","627","629","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101385","7.2717","0.0007","17.152","0.002","10.0043","0.0007","90","","97.722","0.007","90","","1236.4","0.2","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C7 H6 Br6 -","- C7 H6 Br6 -","- C28 H24 Br24 -","4","1","","Akkurt, Mehmet; Χelik, İsmail; Tutar, Ahmet; Χakmak, Osman; İde, Semra","Crystal structure of 2,2-exo-3,5,5-exo-6-hexabromobicycloheptane, C~7~H~6~Br~6~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","529","530","","","","","","","","0.0859","","","0.2272","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101386","6.994","0.002","12.258","0.003","12.889","0.002","91.55","0.02","93.41","0.01","100.09","0.02","1085.2","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H20 Cl3 Co N4 O2 -","- C20 H20 Cl3 Co N4 O2 -","- C40 H40 Cl6 Co2 N8 O4 -","2","1","","Strenger, Irina; Rosu, Tudor; Negoiu, Maria","Refinement of the crystal structure of cis-bis(2,2'-bipyridyl)dichlorocobalt (III) chloride dihydrate, [C~20~H~16~N~4~CoCl~2~]Cl · 2H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","489","490","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101387","8.5362","0.001","8.5362","0.001","8.5362","0.001","90","","90","","90","","622","0.13","293","2","293","2","","","","","","","","5","F m -3 m","-F 4 2 3","225","","","","- Ba8 Bi0.88 O24 Pb5.04 Sb2.08 -","- Ba Bi0.1106 O3 Pb0.63 Sb0.2599 -","- Ba8 Bi0.8848 O24 Pb5.04 Sb2.0792 -","8","0.0416667","","Moretzki, Olaf; Doering, Thomas; Steins, Manfred; Wendschuh-Josties, Michael; Bente, Klaus","Crystal structure of barium antimony lead bismuth oxide, Ba(Pb~0.63~Sb~0.26~Bi~0.11~)O~3~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","461","462","","","","","","","","0.0332","","","0.1187","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101388","6.0391","0.0009","6.0391","0.0009","8.605","0.002","90","","90","","90","","313.84","0.09","293","2","293","2","","","","","","","","4","I 4/m c m","-I 4 2c","140","","","","- Ba4 Bi0.4 O12 Pb3.6 -","- Ba Bi0.1 O3 Pb0.9 -","- Ba4 Bi0.4 O12 Pb3.6 -","4","0.125","","Moretzki, Olaf; Doering, Thomas; Steins, Manfred; Wendschuh-Josties, Michael; Bente, Klaus","Crystal structure of barium lead bismuth oxide, Ba(Pb~0.9~Bi~0.1~) O~3~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","465","466","","","","","","","","0.0344","","","0.0805","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101389","8.544","0.004","8.544","0.004","8.544","0.004","90","","90","","90","","623.7","0.5","293","2","293","2","","","","","","","","5","F m -3 m","-F 4 2 3","225","","","","- Ba9.36 Bi0.8 O24 Pb1.92 Sb3.92 -","- Ba1.17 Bi0.10005 O3 Pb0.24 Sb0.4899 -","- Ba9.36 Bi0.8004 O24 Pb1.92 Sb3.9192 -","8","0.0416667","","Moretzki, Olaf; Doering, Thomas; Steins, Manfred; Wendschuh-Josties, Michael; Bente, Klaus","Crystal structure of barium antimony lead bismuth oxide, Ba(Ba~0.17~Sb~0.49~Pb~0.24~Bi~0.10~)O~3~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","463","464","","","","","","","","0.0474","","","0.1594","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101390","20.389","0.003","5.775","0.001","5.944","0.001","90","","90","","90","","699.9","0.2","293","2","293","2","","","","","","","","4","I b c a","-I 2b 2c","73","","","","- C Ag K O3 -","- C Ag K O3 -","- C8 Ag8 K8 O24 -","8","0.5","","Zheng, Yue-Qing; Zhou, Lin-Xia; Lin, Jian-Li; Zhang, Sun-Wei","Refinement of the crystal structure of potassium catena-carbonatoargentate (I), K[Ag(CO~3~)]","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","467","468","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101391","9.465","0.005","3.638","0.002","6.983","0.002","90","","100.55","0.05","90","","236.4","0.4","293","","295","","","","","","","","","3","P 1 21/m 1","-P 2yb","11","Zirconium_Chromium_Phosphide","","","- Cr10 P6 Zr2 -","- Cr5 P3 Zr -","- Cr10 P6 Zr2 -","2","0.5","","Le Sénéchal, Christophe; Députier, Stéphanie; Guérin, Roland","Crystal structure of zirconium chromium phosphide, ZrCr~5~P~3~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","469","470","","","","","","","","0.0266","","","0.028","","","","","","","","","","","has coordinates","191974","2020-10-21","18:00:00",""
"8101392","4.8502","0.0004","4.8502","0.0004","4.9853","0.0007","90","","90","","120","","101.564","0.019","293","2","293","2","","","","","","","","3","P -3 1 m","-P 3 2","162","","","","- As2 Hg O6 -","- As2 Hg O6 -","- As2 Hg O6 -","1","0.0833333","","Mormann, Thomas J.; Jeitschko, Wolfgang","Crystal structure of mercury(II) metaarsenate(V), HgAs~2~O~6~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","471","472","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101393","9.226","0.002","12.472","0.002","6.217","0.002","90","","105.982","0.01","90","","687.7","0.3","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- H12 Mg O14 Rb2 S2 -","- H12 Mg O14 Rb2 S2 -","- H24 Mg2 O28 Rb4 S4 -","2","0.5","","Euler, H.; Barbier, B.; Klumpp, S.; Kirfel, A.","Crystal structure of Tutton's salts, Rb~2~[M^II^(H~2~O)~6~](SO~4~) ~2~, M^II^ = Mg, Mn, Fe, Co, Ni, Zn","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","473","476","","","","","","","","0.0221","","","0.043","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101394","9.282","0.002","12.6","0.002","6.254","0.002","90","","105.94","0.02","90","","703.3","0.3","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- H12 Mn O14 Rb2 S2 -","- H12 Mn O14 Rb2 S2 -","- H24 Mn2 O28 Rb4 S4 -","2","0.5","","Euler, H.; Barbier, B.; Klumpp, S.; Kirfel, A.","Crystal structure of Tutton's salts, Rb~2~[M^II^(H~2~O)~6~](SO~4~) ~2~, M^II^ = Mg, Mn, Fe, Co, Ni, Zn","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","473","476","","","","","","","","0.018","","","0.0364","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101395","9.224","0.002","12.51","0.003","6.2551","0.001","90","","105.75","0.02","90","","694.7","0.3","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- Fe H12 O14 Rb2 S2 -","- Fe H12 O14 Rb2 S2 -","- Fe2 H24 O28 Rb4 S4 -","2","0.5","","Euler, H.; Barbier, B.; Klumpp, S.; Kirfel, A.","Crystal structure of Tutton's salts, Rb~2~[M^II^(H~2~O)~6~](SO~4~) ~2~, M^II^ = Mg, Mn, Fe, Co, Ni, Zn","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","473","476","","","","","","","","0.0215","","","0.0478","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101396","9.197","0.002","12.446","0.002","6.2364","0.001","90","","106.041","0.01","90","","686.1","0.2","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- Co H12 O14 Rb2 S2 -","- Co H12 O14 Rb2 S2 -","- Co2 H24 O28 Rb4 S4 -","2","0.5","","Euler, H.; Barbier, B.; Klumpp, S.; Kirfel, A.","Crystal structure of Tutton's salts, Rb~2~[M^II^(H~2~O)~6~](SO~4~) ~2~, M^II^ = Mg, Mn, Fe, Co, Ni, Zn","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","473","476","","","","","","","","0.0178","","","0.0374","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101397","9.131","","12.41","","6.221","","90","","106.06","","90","","677.5","","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- H12 Ni O14 Rb2 S2 -","- H12 Ni O14 Rb2 S2 -","- H24 Ni2 O28 Rb4 S4 -","2","0.5","","Euler, H.; Barbier, B.; Klumpp, S.; Kirfel, A.","Crystal structure of Tutton's salts, Rb~2~[M^II^(H~2~O)~6~](SO~4~) ~2~, M^II^ = Mg, Mn, Fe, Co, Ni, Zn","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","473","476","","","","","","","","0.0174","","","0.0404","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101398","9.179","0.003","12.441","0.004","6.239","0.002","90","","105.93","0.03","90","","685.1","0.4","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- H12 O14 Rb2 S2 Zn -","- H12 O14 Rb2 S2 Zn -","- H24 O28 Rb4 S4 Zn2 -","2","0.5","","Euler, H.; Barbier, B.; Klumpp, S.; Kirfel, A.","Crystal structure of Tutton's salts, Rb~2~[M^II^(H~2~O)~6~](SO~4~) ~2~, M^II^ = Mg, Mn, Fe, Co, Ni, Zn","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","473","476","","","","","","","","0.0175","","","0.0393","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101399","7.6865","0.0009","8.6679","0.0009","3.4742","0.0004","90","","90","","90","","231.47","0.04","300","2","300","2","","","","","","","","3","C m m m","-C 2 2","65","","","","- B6 Ho2 Ni3 -","- B6 Ho1.902 Ni3 -","- B12 Ho3.804 Ni6 -","2","0.125","","Geupel, Sandra; Zahn, Gernot; Paufler, Peter; Graw, Gerald","Refinement of the crystal structure of diholmium trinickel hexaboride, Ho~2~Ni~3~B~6~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","477","478","10.1515/ncrs-2000-0409","","","","","","","","","","","","","","","","","","","","","has coordinates","209540","2020-10-21","18:00:00",""
"8101400","3.5621","0.0005","3.5621","0.0005","7.5555","0.0019","90","","90","","90","","95.87","0.03","300","2","300","2","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","","","- C B Ho Ni -","- C B Ho Ni0.972 -","- C2 B2 Ho2 Ni1.944 -","2","0.125","","Geupel, Sandra; Zahn, Gernot; Paufler, Peter; Graw, Gerald","Refinement of the crystal structure of holmium nickel borocarbide, HoNiBC","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","479","480","10.1515/ncrs-2000-0410","","","","","","","","","","","","","","","","","","","","","has coordinates","209540","2020-10-21","18:00:00",""
"8101401","4.9696","0.0004","4.9696","0.0004","6.9419","0.0005","90","","90","","120","","148.475","0.019","300","2","300","2","","","","","","","","3","P 6/m m m","-P 6 2","191","","","","- B Ho Ni4 -","- B Ho Ni4 -","- B2 Ho2 Ni8 -","2","0.0833333","","Geupel, Sandra; Belger, Andre; Paufler, Peter; Graw, Gerald","Refinement of the crystal structure of holmium tetranickel boride, HoNi~4~B","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","481","482","10.1515/ncrs-2000-0411","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","209540","2020-10-21","18:00:00",""
"8101402","10.7518","0.0009","10.9501","0.0009","14.372","0.001","72.022","0.006","73.19","0.006","73.099","0.007","1502.5","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C36 H36 O5 -","- C36 H36 O5 -","- C72 H72 O10 -","2","1","","Peters, Karl; Peters, Eva-Maria; Pabst, Thomas; Bringmann, Gerhard","Crystal structure of 3,8-di-tert-butyl-4-methoxy-1-methyl-9,10- diphenylmethylidenedioxy)dibenzo[b,d]pyran-6-one, C~6~H[O~2~C(C~6~H~5~)~2~] (C~4~H~9~)COO(C~6~H)(CH~3~)(OCH~3~)(C~4~H~9~)","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","603","604","","","","","","","","","","","","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8103450","7.568","","7.568","","7.568","","90","","90","","90","","433.454","","","","","","","","","","","","","4","I m -3 m","-I 4 2 3","229","","Na Sr4 (B N2)3","","- B3 N6 Na Sr4 -","- B3 N6 Na Sr4 -","- B6 N12 Na2 Sr8 -","2","0.0208333","","von Schnering, H.G.; Carrillo-Cabrera, W.; Somer, M.; Peters, K.","Crystal structure of sodium tetrastrontium tris(nitridoborate)","Zeitschrift fuer Kristallographie - New Crystal Structures","2000","215","","209","209","","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8103583","7.8258","","7.8258","","5.0148","","90","","90","","90","","307.122","","","","","","","","","","","","","4","P -4 21 m","P -4 2ab","113","","Ca2 Co (Si2 O7)","","- Ca2 Co O7 Si2 -","- Ca2 Co O7 Si2 -","- Ca4 Co2 O14 Si4 -","2","0.25","","Riester, M.; Boehm, H.; Petricek, V.","The commensurately modulated structure of the lock-in phase of synthetic Co-akermanite, Ca2 Co Si2 O7","Zeitschrift fuer Kristallographie (149,1979-)","2000","215","","102","109","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103584","23.46","","23.46","","5.015","","90","","90","","90","","2760.11","","","","","","","","","","","","","4","P -4","P -4","81","","Ca2 Co (Si2 O7)","","- Ca2 Co O1.66667 Si2 -","- Ca2 Co O1.66667 Si2 -","- Ca36 Co18 O30 Si36 -","18","4.5","","Riester, M.; Boehm, H.; Petricek, V.","The commensurately modulated structure of the lock-in phase of synthetic Co-akermanite, Ca2 Co Si2 O7","Zeitschrift fuer Kristallographie (149,1979-)","2000","215","","102","109","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103607","3.81593","","3.81593","","3.81593","","90","","90","","90","","55.565","","","","","","","","","","","","","3","P m -3 m","-P 4 2 3","221","","La (Al O3)","","- Al La O3 -","- Al La O3 -","- Al La O3 -","1","0.0208333","","Lehnert, H.; Boysen, H.; Schneider, J.; Frey, F.; Hohlwein, D.; Radaelli, P.; Ehrenberg, H.","A powder diffraction study of the phase transition in La Al O3","Zeitschrift fuer Kristallographie (149,1979-)","2000","215","","536","541","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103608","14.5564","","14.5564","","14.5564","","90","","90","","90","","3084.34","","","","","","","","","","","","","2","P 41 3 2","P 4bd 2ab 3","213","","","","- Ba6 Ge25 -","- Ba6 Ge25 -","- Ba24 Ge100 -","4","0.166667","","Carrillo-Cabrera, W.; Curda, J.; von Schnering, H.G.; Paschen, S.; Grin', Yu.","Crystal structure of hexabarium pentacosagermanide, Ba6 Ge25","Zeitschrift fuer Kristallographie - New Crystal Structures","2000","215","","207","208","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"8103609","14.836","","14.836","","14.836","","90","","90","","90","","3265.51","","","","","","","","","","","","","3","F 41 3 2","F 4d 2 3","210","","Cu2.307 Te S0.314","","- Cu2.307 S0.314 Te -","- Cu2.30733 S0.314 Te -","- Cu110.752 S15.072 Te48 -","48","0.5","","Makovicky, E.; Karup-Moller, S.; Sotofte, I.","The crystal structure of Cu2.31 Te S0.32 - a condensed cluster compound","Zeitschrift fuer Kristallographie (149,1979-)","2000","215","","475","480","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103612","7.305","","6.0328","","13.7693","","90","","98.472","","90","","600.186","","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(Gd3 O2) (Re O6)","","- Gd3 O8 Re -","- Gd3 O8 Re -","- Gd12 O32 Re4 -","4","1","","Mujica, C.; Peters, E.M.; Peters, K.; von Schnering, H.G.","Crystal structure of trigadolinium(III) rhenium(VII) octaoxide, Gd3 Re O8","Zeitschrift fuer Kristallographie - New Crystal Structures","2000","215","","3","3","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103615","5.0655","","5.0655","","16.577","","90","","90","","120","","368.367","","","","","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","Na (N O3)","","- N Na O3 -","- N Na O3 -","- N6 Na6 O18 -","6","0.166667","","Gonschorek, G.; Miehe, G.; Weitzel, H.; Fuess, H.; Schmahl, W.W.","The crystal structures of Na N O3 at 100 K, 120 K, and 563 K","Zeitschrift fuer Kristallographie (149,1979-)","2000","215","","752","756","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103616","5.0889","","5.0889","","8.868","","90","","90","","120","","198.886","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Na (N O3)","","- N Na O3 -","- N Na O3 -","- N3 Na3 O9 -","3","0.0833333","","Gonschorek, G.; Weitzel, H.; Fuess, H.; Schmahl, W.W.; Miehe, G.","The crystal structures of Na N O3 at 100 K, 120 K, and 563 K","Zeitschrift fuer Kristallographie (149,1979-)","2000","215","","752","756","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103618","7.229","","7.899","","9.361","","73.91","","78.83","","70.29","","480.523","","","","","","","","","","","","","6","P -1","-P 1","2","","(Cd (Re O4)2) (C O (N H2)2)4","","- C4 H16 Cd N8 O12 Re2 -","- C4 Cd N8 O12 Re2 -","- C4 Cd N8 O12 Re2 -","1","0.5","","Petrova, R.; Bakardjieva, S.; Todorov, T.; Angelova, O.; Mihailova, B.","Crystal structures of Cd (Re O4)2 * 4(Urea), Cd (Re O4)2 * 6(Urea) and Ca (Re O4)2 * 5(Urea). Synthesis and characterization of urea adducts from the systems M (Re O4)2 - Urea - (H2 O), M = Ca, Sr, Ba, Pb and Cd","Zeitschrift fuer Kristallographie (149,1979-)","2000","215","","309","316","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103620","10.772","","7.625","","15.095","","90","","101.03","","90","","1216.95","","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(Cd (Re O4)2) (C O (N H2)2)6","","- C6 H24 Cd N12 O14 Re2 -","- C6 Cd N12 O14 Re2 -","- C12 Cd2 N24 O28 Re4 -","2","0.5","","Petrova, R.; Angelova, O.; Todorov, T.; Mihailova, B.; Bakardjieva, S.","Crystal structures of Cd (Re O4)2 * 4(Urea), Cd (Re O4)2 * 6(Urea) and Ca (Re O4)2 * 5(Urea). Synthesis and characterization of urea adducts from the systems M (Re O4)2 - Urea - (H2 O), M = Ca, Sr, Ba, Pb and Cd","Zeitschrift fuer Kristallographie (149,1979-)","2000","215","","309","316","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103621","8.745","","9.795","","13.931","","70.71","","89.47","","85.44","","1122.55","","","","","","","","","","","","","6","P -1","-P 1","2","","(Ca (Re O4)2) (C O (N H2)2)5","","- C5 H20 Ca N10 O13 Re2 -","- C5 Ca N10 O13 Re2 -","- C10 Ca2 N20 O26 Re4 -","2","1","","Petrova, R.; Todorov, T.; Angelova, O.; Mihailova, B.; Bakardjieva, S.","Crystal structures of Cd (Re O4)2 * 4(Urea), Cd (Re O4)2 * 6(Urea) and Ca (Re O4)2 * 5(Urea). Synthesis and characterization of urea adducts from the systems M (Re O4)2 - Urea - (H2 O), M = Ca, Sr, Ba, Pb and Cd","Zeitschrift fuer Kristallographie (149,1979-)","2000","215","","309","316","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103624","5.885","","5.885","","52.62","","90","","90","","90","","1822.4","","","","","","","","","","","","","3","I -4 2 d","I -4 2bw","122","","(Mo6.24 Rh4.76) Ge18","","- Ge18 Mo6.24 Rh4.76 -","- Ge18 Mo6.24 Rh4.76 -","- Ge72 Mo24.96 Rh19.04 -","4","0.25","","Rohrer, F.E.; Eriksson, L.; Lind, H.; Larsson, A.K.; Lidin, S.","On the question of commensurability - the Nowotny chimney-ladder structures revisited","Zeitschrift fuer Kristallographie (149,1979-)","2000","215","","650","660","","","","","","","","","","","","","","","","","","","","","","has coordinates","147568","2020-10-21","18:00:00",""
"8103625","5.922","","5.922","","62.88","","90","","90","","90","","2205.21","","","","","","","","","","","","","3","I -4 2 d","I -4 2bw","122","","(Mo11.75 Rh1.25) Ge22","","- Ge22 Mo11.75 Rh1.25 -","- Ge22 Mo11.752 Rh1.248 -","- Ge88 Mo47.008 Rh4.992 -","4","0.25","","Rohrer, F.E.; Larsson, A.K.; Eriksson, L.; Lind, H.; Lidin, S.","On the question of commensurability - the Nowotny chimney-ladder structures revisited","Zeitschrift fuer Kristallographie (149,1979-)","2000","215","","650","660","","","","","","","","","","","","","","","","","","","","","","has coordinates","147570","2020-10-21","18:00:00",""
"8103626","18.77","","3.612","","9.021","","90","","104.23","","90","","592.833","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","Rb0.75 Cr5 Se8","","- Cr5 Rb0.75 Se8 -","- Cr5 Rb0.75 Se8 -","- Cr10 Rb1.5 Se16 -","2","0.25","","Sassmannshausen, M.; Lutz, H.D.","Thermal motion of the univalent metal ions in (K Cr5 S8)-type chalcogenides, ternary chromium selenides Mx Cr5 Se8 (M = Rb, Cs)","Zeitschrift fuer Kristallographie (149,1979-)","2000","215","","683","687","","","","","","","","","","","","","","","","","","","","","","has coordinates","147648","2020-10-21","18:00:00",""
"8103627","18.853","","3.627","","9.109","","90","","104.27","","90","","603.653","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","Cs0.76 Cr5 Se8","","- Cr5 Cs0.76 Se8 -","- Cr5 Cs0.76 Se8 -","- Cr10 Cs1.52 Se16 -","2","0.25","","Sassmannshausen, M.; Lutz, H.D.","Thermal motion of the univalent metal ions in (K Cr5 S8)-type chalcogenides, ternary chromium selenides Mx Cr5 Se8 (M = Rb, Cs)","Zeitschrift fuer Kristallographie (149,1979-)","2000","215","","683","687","","","","","","","","","","","","","","","","","","","","","","has coordinates","147649","2020-10-21","18:00:00",""
"8103629","8.4114","","11.0702","","6.3766","","90","","90","","90","","593.763","","","","","","","","","","","","","3","P n a m","-P 2c 2n","62","","Cs2 (S O4)","","- Cs2 O4 S -","- Cs2 O4 S -","- Cs8 O16 S4 -","4","0.5","","Kahle, A.; Winkler, B.; Griewatsch, C.; Milman, V.","Experimental and theoretical high pressure study of beta(Cs2 S O4)","Zeitschrift fuer Kristallographie (149,1979-)","2000","215","","17","22","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103630","5.6749","","15.1427","","6.5091","","90","","118.491","","90","","491.607","","","","","","","","","","","","","4","I 1 2/c 1","-I 2yc","15","","Ca (S O4) (H2 O)2","","- Ca H4 O6 S -","- Ca H4 O6 S -","- Ca4 H16 O24 S4 -","4","0.5","","Schofield, P.F.; Stretton, I.C.; Knight, K.S.; Wilson, C.C.","Temperature related structural variation of the hydrous components in gypsum","Zeitschrift fuer Kristallographie (149,1979-)","2000","215","","707","710","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103631","11.346","","12.996","","19.585","","90","","90","","90","","2887.86","","","","","","","","","","","","","7","F 2 2 2","F 2 2","22","","Bi0.12 Al0.26 Y0.534 Ca3.128 Sr5.964 Cu16.537 O28.476","","- Al0.26 Bi0.12 Ca3.128 Cu16.537 O28.476 Sr5.964 Y0.534 -","- Al0.262 Bi0.122 Ca3.128 Cu16.537 O28.476 Sr5.964 Y0.534 -","- Al1.048 Bi0.488 Ca12.512 Cu66.148 O113.904 Sr23.856 Y2.136 -","4","0.25","","Shvanskaya, L.; Sokolova, E.; Leonyuk, L.; Maltsev, V.","The crystal chemistry of superconducting Sr3.66 Bi0.28 Ca6.02 Cu16.45 O28.63 and nonsuperconducting Sr5.97 Ca3.13 Y0.53 Al0.25 Bi0.12 Cu16.66 O28.64 compounds","Zeitschrift fuer Kristallographie (149,1979-)","2000","215","","368","372","","","","","","","","","","","","","","","","","","","","","","has coordinates","147850","2020-10-21","18:00:00",""
"8103632","11.319","","12.763","","19.491","","90","","90","","90","","2815.76","","","","","","","","","","","","","5","F 2 2 2","F 2 2","22","","Bi0.28 Sr3.66 Ca6.024 Cu16.447 O28.63","","- Bi0.28 Ca6.024 Cu16.447 O28.63 Sr3.66 -","- Bi0.278 Ca6.024 Cu16.447 O28.632 Sr3.662 -","- Bi1.112 Ca24.096 Cu65.788 O114.528 Sr14.648 -","4","0.25","","Shvanskaya, L.; Leonyuk, L.; Sokolova, E.; Maltsev, V.","The crystal chemistry of superconducting Sr3.66 Bi0.28 Ca6.02 Cu16.45 O28.63 and nonsuperconducting Sr5.97 Ca3.13 Y0.53 Al0.25 Bi0.12 Cu16.66 O28.64 compounds","Zeitschrift fuer Kristallographie (149,1979-)","2000","215","","368","372","","","","","","","","","","","","","","","","","","","","","","has coordinates","147852","2020-10-21","18:00:00",""
"8103634","4.054","","8.058","","8.079","","90.08","","90","","90","","263.918","","","","","","","","","","","","","2","P 21/b 1 1","-P 2xab","14","","Pr (S2)","","- Pr S2 -","- Pr S2 -","- Pr4 S8 -","4","1","","Tamazyan, R.; Arnold, H.; Kuz'micheva, G.M.; Molchanov, V.N.; Vasil'eva, I.G.","Contribution to the crystal symmetry of rare-earth chalcogenides. II. The crystal structure and twinning of rare-earth disulfide Pr S2","Zeitschrift fuer Kristallographie (149,1979-)","2000","215","","272","277","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103635","8.818","","8.818","","15.928","","90","","90","","90","","1238.52","","","","","","","","","","","","","2","P 42/n :2","-P 4bc","86","","Sm S1.9","","- S1.9 Sm -","- S1.9 Sm -","- S38 Sm20 -","20","2.5","","Tamazyan, R.; Kuz'micheva, G.M.; Arnold, H.; Molchanov, V.N.; Vasil'eva, I.G.","Contribution to the crystal chemistry of rare earth chalcogenides. III.The crystal structure and twinning of Sm S1.9","Zeitschrift fuer Kristallographie (149,1979-)","2000","215","","346","351","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103638","4.857","","13.5403","","7.7328","","90","","90.908","","90","","508.486","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Na Rb (Si2 O5)","","- Na O5 Rb Si2 -","- Na O5 Rb Si2 -","- Na4 O20 Rb4 Si8 -","4","1","","de Jong, B.H.W.S.; Super, H.T.J.; Nachtegaal, G.; Spek, A.L.; Frijhoff, R.M.","Mixed alkali systems: Dietzel's theorem, X-ray structure, hygroscopicity, and 29-Si MAS NMR of Na Rb Si2 O5 and Na Cs Si2 O5","Zeitschrift fuer Kristallographie (149,1979-)","2000","215","","347","405","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103639","17.0743","","4.9011","","13.3391","","90","","90","","90","","1116.25","","","","","","","","","","","","","4","P n a 21","P 2c -2n","33","","Na Cs (Si2 O5)","","- Cs Na O5 Si2 -","- Cs Na O5 Si2 -","- Cs8 Na8 O40 Si16 -","8","2","","de Jong, B.H.W.S.; Super, H.T.J.; Frijhoff, R.M.; Spek, A.L.; Nachtegaal, G.","Mixed alkali systems: Dietzel's theorem, X-ray structure, hygroscopicity, and 29-Si MAS NMR of Na Rb Si2 O5 and Na Cs Si2 O5","Zeitschrift fuer Kristallographie (149,1979-)","2000","215","","347","405","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103642","8.8109","","8.8109","","21.4572","","90","","90","","120","","1442.59","","","","","","","","","","","","","4","R 3 c :H","R 3 -2""c","161","","Cd3 (B7 O13) (O H)","","- B7 Cd3 H O14 -","- B7 Cd3 O14 -","- B42 Cd18 O84 -","6","0.333333","","Werthmann, U.; Glinnemann, J.; Gies, H.; Hahn, T.","Cd3 B7 O13 (O H) - a new synthetic hydroxy boracite","Zeitschrift fuer Kristallographie (149,1979-)","2000","215","","393","396","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103845","9.035","","9.035","","9.035","","90","","90","","90","","737.538","","","","","","","","","","","","","6","P -4 3 n","P -4n 2 3","218","","Na7.66 (Al6 Si6 O24) (H C O3) (C O3)0.58 (H2 O)4.02","","- C1.58 H9.04 Al6 Na7.66 O32.76 Si6 -","- C1.58 Al6 Na7.656 O32.76 Si6 -","- C1.58 Al6 Na7.656 O32.76 Si6 -","1","0.0416667","","Gesing, T.M.; Buhl, J.C.","Structure and spectroscopic properties of hydrogencarbonate containing alumosilicate sodalite and cancrinite","Zeitschrift fuer Kristallographie (149,1979-)","2000","215","","413","418","","","","","","","","","","","","","","","","","","","","","","has coordinates","161380","2020-10-21","18:00:00",""
"8103847","12.725","","12.725","","5.177","","90","","90","","120","","725.98","","","","","","","","","","","","","6","P 63","P 6c","173","","Na7.6 (Al6 Si6 O24) (H C O3)1.2 (C O3)0.2 (H2 O)2.28","","- C1.4 H5.76 Al6 Na7.6 O30.48 Si6 -","- C1.412 H1.41 Al6 Na7.622 O30.48 Si6 -","- C1.412 H1.41 Al6 Na7.622 O30.48 Si6 -","1","0.166667","","Gesing, T.M.; Buhl, J.C.","Structure and spectroscopic properties of hydrogencarbonate containing alumosilicate sodalite and cancrinite","Zeitschrift fuer Kristallographie (149,1979-)","2000","215","","413","418","","","","","","","","","","","","","","","","","","","","","","has coordinates","161384","2020-10-21","18:00:00",""
"9002253","4.7405","","10.2377","","13.6496","","100.843","","90","","90","","650.613","","","","","","","","","","","","","5","P 21/b 1 1","-P 2xab","14","","","Chondrodite","- F1.28 H0.66 Mg9 O16.72 Si4 -","- F1.28 H0.66 Mg9 O16.72 Si4 -","- F2.56 H1.32 Mg18 O33.44 Si8 -","2","0.5","","Ottolini, L.; Camara, F.; Bigi, S.","An investigation of matrix effects in the analysis of fluorine in humite-group minerals by EMPA, SIMS, and SREF Sample: Chum HV-41 n.2","American Mineralogist","2000","85","","89","102","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002254","4.7396","","10.2328","","13.6439","","100.843","","90","","90","","649.907","","","","","","","","","","","","","5","P 21/b 1 1","-P 2xab","14","","","Clinohumite","- F1.04 H0.92 Mg9 O16.96 Si4 -","- F1.04 H0.92 Mg9 O16.96 Si4 -","- F2.08 H1.84 Mg18 O33.92 Si8 -","2","0.5","","Ottolini, L.; Camara, F.; Bigi, S.","An investigation of matrix effects in the analysis of fluorine in humite-group minerals by EMPA, SIMS, and SREF Sample: Chum HV-41 n.3","American Mineralogist","2000","85","","89","102","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002255","4.723","","10.2584","","7.8504","","109.076","","90","","90","","359.468","","","","","","","","","","","","","5","P 21/b 1 1","-P 2xab","14","","","Chondrodite","- F1.24 H0.76 Mg5 O8.76 Si2 -","- F1.24 H0.76 Mg5 O8.76 Si2 -","- F2.48 H1.52 Mg10 O17.52 Si4 -","2","0.5","","Ottolini, L.; Camara, F.; Bigi, S.","An investigation of matrix effects in the analysis of fluorine in humite-group minerals by EMPA, SIMS, and SREF Sample: Chond HV-43 n.3","American Mineralogist","2000","85","","89","102","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002256","4.7226","","10.2564","","7.849","","109.076","","90","","90","","359.304","","","","","","","","","","","","","5","P 21/b 1 1","-P 2xab","14","","","Chondrodite","- F1.24 H0.76 Mg5 O8.76 Si2 -","- F1.24 H0.76 Mg5 O8.76 Si2 -","- F2.48 H1.52 Mg10 O17.52 Si4 -","2","0.5","","Ottolini, L.; Camara, F.; Bigi, S.","An investigation of matrix effects in the analysis of fluorine in humite-group minerals by EMPA, SIMS, and SREF Sample: Chond HV-43 n.4","American Mineralogist","2000","85","","89","102","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002257","8.8612","","8.8612","","3.1021","","90","","90","","120","","210.946","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","Fluoborite","- B F3 H3 Mg3 O3 -","- B F3 H3 Mg3 O3 -","- B2 F6 H6 Mg6 O6 -","2","0.166667","","Camara, F.; Ottolini, L.","New data on the crystal-chemistry of fluoborite by means of SREF, SIMS and EMP analysis Sample: Fbor 2V-43 n.2","American Mineralogist","2000","85","","103","107","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002258","8.8602","","8.8602","","3.1021","","90","","90","","120","","210.898","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","Fluoborite","- B F3 H3 Mg3 O3 -","- B F3 H3 Mg3 O3 -","- B2 F6 H6 Mg6 O6 -","2","0.166667","","Camara, F.; Ottolini, L.","New data on the crystal-chemistry of fluoborite by means of SREF, SIMS and EMP analysis Sample: Fbor HV-43 n.3","American Mineralogist","2000","85","","103","107","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002259","3.25919","","3.25919","","4.5765","","90","","90","","120","","42.1","","","","10","","","","","","","","","3","P -3 m 1","-P 3 2""","164","","","Fe(OH)2","- Fe H1.714 O2 -","- Fe H1.714 O2 -","- Fe H1.714 O2 -","1","0.0833333","","Parise, J. B.; Marshall, W. G.; Smith, R. I.; Lutz, H. D.; Moller, H.","The nuclear and magnetic structure of ""white rust""-Fe(OH0.86D0.14)2 Sample: T = 10 K","American Mineralogist","2000","85","","189","193","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002260","3.26238","","3.26238","","4.5822","","90","","90","","120","","42.235","","","","150","","","","","","","","","3","P -3 m 1","-P 3 2""","164","","","Fe(OH)2","- Fe H1.726 O2 -","- Fe H1.726 O2 -","- Fe H1.726 O2 -","1","0.0833333","","Parise, J. B.; Marshall, W. G.; Smith, R. I.; Lutz, H. D.; Moller, H.","The nuclear and magnetic structure of ""white rust""-Fe(OH0.86D0.14)2 Sample: T = 150 K","American Mineralogist","2000","85","","189","193","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002261","3.26515","","3.26515","","4.6013","","90","","90","","120","","42.483","","","","300","","","","","","","","","3","P -3 m 1","-P 3 2""","164","","","Fe(OH)2","- Fe H1.728 O2 -","- Fe H1.728 O2 -","- Fe H1.728 O2 -","1","0.0833333","","Parise, J. B.; Marshall, W. G.; Smith, R. I.; Lutz, H. D.; Moller, H.","The nuclear and magnetic structure of ""white rust""-Fe(OH0.86D0.14)2 Sample: T = 300 K","American Mineralogist","2000","85","","189","193","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002262","4.94","","6.81","","6.978","","101.12","","94.86","","110.07","","213.435","","","","","","","","","","","","","4","P -1","-P 1","2","","","Gearksutite","- Al Ca F4 O2 -","- Al Ca F4 O2 -","- Al2 Ca2 F8 O4 -","2","1","","Marchetti, F.; Perchiazzi, N.","The crystal structure of gearksutite, CaAlF4(OH).H2O","American Mineralogist","2000","85","","231","235","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:35",""
"9002263","9.776","","17.919","","5.292","","90","","104.05","","90","","899.299","","","","","","","","","","","","","10","C 1 2/m 1","-C 2y","12","","","Obertiite","- Al0.03 Ca2 Fe0.71 K0.18 Mg2.13 Mn0.37 Na2.66 O24 Si8 Ti0.86 -","- Al0.03 Ca2 Fe0.71 K0.18 Mg2.13 Mn0.37 Na2.66 O24 Si8 Ti0.86 -","- Al0.06 Ca4 Fe1.42 K0.36 Mg4.26 Mn0.74 Na5.32 O48 Si16 Ti1.72 -","2","0.25","","Hawthorne, F. C.; Cooper, M. A.; Grice, J. D.; Ottolini, L.","A new anhydrous amphibole from the Eifel region, Germany: Description and crystal structure of obertiite, NaNa2(Mg3FeTi)Si8O22O2 Note: M1A and M1 are interchanged in the bond length table","American Mineralogist","2000","85","","236","241","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:41:58",""
"9002264","5.316","","9.23","","10.197","","90","","100.06","","90","","492.641","","","","","","","","","","","","","8","C 1 2/m 1","-C 2y","12","","","Kinoshitalite","- Al2 Ba0.94 H2 K0.06 Mg2.744 Mn0.256 O12 Si2 -","- Al2 Ba0.94 H2 K0.06 Mg2.744 Mn0.256 O12 Si2 -","- Al4 Ba1.88 H4 K0.12 Mg5.488 Mn0.512 O24 Si4 -","2","0.25","","Gnos, E.; Armbruster, T.","Kinoshitalite, Ba(Mg)3(Al2Si2)O10(OH,F)2, a brittle mica from a manganese deposit in Oman: Paragenesis and crystal chemistry","American Mineralogist","2000","85","","242","250","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002265","12.3049","","7.1056","","28.2478","","90","","98.2416","","90","","2444.3","","","","","","","","","","","","","5","C 1 c 1","C -2yc","9","","","Parisite-(Ce)","- C3 Ca0.977 Ce2.023 F2 O9 -","- C3 Ca0.976667 Ce2.02333 F2 O9 -","- C36 Ca11.72 Ce24.28 F24 O108 -","12","3","","Ni, Y.; Post, J. E.; Hughes, J. M.","The crystal structure of parisite-(Ce), Ce2CaF(CO3)3 sample: from Muso Mine, Columbia","American Mineralogist","2000","85","","251","258","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002266","10.2925","","10.7052","","8.8027","","105.28","","96.712","","125.256","","718.083","","","","","","","","","","","","","6","P -1","-P 1","2","","","Aenigmatite","- Al0.08 H2 Mg5.92 Na2 O20 Si6 -","- Al0.08 H2 Mg5.92 Na2 O20 Si6 -","- Al0.16 H4 Mg11.84 Na4 O40 Si12 -","2","1","","Yang, H.; Konzett, J.","High-pressure synthesis of Na2Mg6Si6O18(OH)2 - a new hydrous silicate phase isostructural with aenigmatite","American Mineralogist","2000","85","","259","262","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002267","9.846","","18.042","","5.316","","90","","105.1","","90","","911.737","","","","","","","","","","","","","9","C 1 2/m 1","-C 2y","12","","","Pargasite","- Al2.65 Ca3.61 Fe1.35 H2 Mg3.27 Na1.33 O24 Si6 Ti0.45 -","- Al2.65 Ca3.61 Fe1.35 H2 Mg3.27 Na1.33 O24 Si6 Ti0.45 -","- Al5.3 Ca7.22 Fe2.7 H4 Mg6.54 Na2.66 O48 Si12 Ti0.9 -","2","0.25","","Oberti, R.; Vannucci, R.; Zanetti, A.; Tiepolo, M.; Brumm, R. C.","A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene DTi values in petrogenetic studies SAMPLE 1","American Mineralogist","2000","85","","407","419","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:43",""
"9002268","9.858","","18.031","","5.307","","90","","105.13","","90","","910.618","","","","","","","","","","","","","10","C 1 2/m 1","-C 2y","12","","","Pargasite","- Al2.78 Ca3.2 Fe2.26 H2 K0.5 Mg2.16 Na1.25 O24 Si5.92 Ti0.6 -","- Al2.78 Ca3.2 Fe2.26 H2 K0.5 Mg2.16 Na1.25 O24 Si5.92 Ti0.6 -","- Al5.56 Ca6.4 Fe4.52 H4 K Mg4.32 Na2.5 O48 Si11.84 Ti1.2 -","2","0.25","","Oberti, R.; Vannucci, R.; Zanetti, A.; Tiepolo, M.; Brumm, R. C.","A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene DTi values in petrogenetic studies SAMPLE 2","American Mineralogist","2000","85","","407","419","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:43",""
"9002269","9.85","","18.046","","5.316","","90","","105.1","","90","","912.309","","","","","","","","","","","","","11","C 1 2/m 1","-C 2y","12","","","Pargasite","- Al2.7 Ca3.2 F0.02 Fe1.95 H2 K0.38 Mg2.47 Na1.36 O23.98 Si6 Ti0.6 -","- Al2.7 Ca3.2 F0.02 Fe1.95 H2 K0.38 Mg2.47 Na1.36 O23.98 Si6 Ti0.6 -","- Al5.4 Ca6.4 F0.04 Fe3.9 H4 K0.76 Mg4.94 Na2.72 O47.96 Si12 Ti1.2 -","2","0.25","","Oberti, R.; Vannucci, R.; Zanetti, A.; Tiepolo, M.; Brumm, R. C.","A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene DTi values in petrogenetic studies SAMPLE 3","American Mineralogist","2000","85","","407","419","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:43",""
"9002270","9.838","","18.025","","5.308","","90","","105.01","","90","","909.152","","","","","","","","","","","","","11","C 1 2/m 1","-C 2y","12","","","Pargasite","- Al2.8 Ca2.96 F0.04 Fe1.76 H2 K0.23 Mg2.64 Na1.67 O23.96 Si6 Ti0.6 -","- Al2.8 Ca2.96 F0.04 Fe1.76 H2 K0.23 Mg2.64 Na1.67 O23.96 Si6 Ti0.6 -","- Al5.6 Ca5.92 F0.08 Fe3.52 H4 K0.46 Mg5.28 Na3.34 O47.92 Si12 Ti1.2 -","2","0.25","","Oberti, R.; Vannucci, R.; Zanetti, A.; Tiepolo, M.; Brumm, R. C.","A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene DTi values in petrogenetic studies Sample 4","American Mineralogist","2000","85","","407","419","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:43",""
"9002271","9.806","","18.026","","5.308","","90","","104.91","","90","","906.668","","","","","","","","","","","","","11","C 1 2/m 1","-C 2y","12","","","Pargasite","- Al2.68 Ca2.88 F0.02 Fe1.95 H2 K5 Mg2.77 Na1.87 O23.98 Si5.92 Ti0.6 -","- Al2.68 Ca2.88 F0.02 Fe1.95 H2 K5 Mg2.77 Na1.87 O23.98 Si5.92 Ti0.6 -","- Al5.36 Ca5.76 F0.04 Fe3.9 H4 K10 Mg5.54 Na3.74 O47.96 Si11.84 Ti1.2 -","2","0.25","","Oberti, R.; Vannucci, R.; Zanetti, A.; Tiepolo, M.; Brumm, R. C.","A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene DTi values in petrogenetic studies SAMPLE 5","American Mineralogist","2000","85","","407","419","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:43",""
"9002272","9.88","","18.095","","5.322","","90","","105.13","","90","","918.478","","","","","","","","","","","","","11","C 1 2/m 1","-C 2y","12","","","Pargasite","- Al2.8 Ca3.28 F0.12 Fe2.82 H2 K0.55 Mg5.45 Na1.28 O23.88 Si6 Ti0.45 -","- Al2.8 Ca3.28 F0.12 Fe2.82 H2 K0.55 Mg5.45 Na1.28 O23.88 Si6 Ti0.45 -","- Al5.6 Ca6.56 F0.24 Fe5.64 H4 K1.1 Mg10.9 Na2.56 O47.76 Si12 Ti0.9 -","2","0.25","","Oberti, R.; Vannucci, R.; Zanetti, A.; Tiepolo, M.; Brumm, R. C.","A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene DTi values in petrogenetic studies SAMPLE 6","American Mineralogist","2000","85","","407","419","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:43",""
"9002273","9.862","","18.003","","5.296","","90","","105.19","","90","","907.43","","","","","","","","","","","","","11","C 1 2/m 1","-C 2y","12","","","Pargasite","- Al2.45 Ca3.4 F2 Fe0.48 H2 K0.38 Mg4.19 Na1.36 O26 Si6 Ti0.4 -","- Al2.45 Ca3.4 F2 Fe0.48 H2 K0.38 Mg4.19 Na1.36 O26 Si6 Ti0.4 -","- Al4.9 Ca6.8 F4 Fe0.96 H4 K0.76 Mg8.38 Na2.72 O52 Si12 Ti0.8 -","2","0.25","","Oberti, R.; Vannucci, R.; Zanetti, A.; Tiepolo, M.; Brumm, R. C.","A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene DTi values in petrogenetic studies SAMPLE 7","American Mineralogist","2000","85","","407","419","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:43",""
"9002274","9.853","","18.06","","5.314","","90","","105.07","","90","","913.08","","","","","","","","","","","","","11","C 1 2/m 1","-C 2y","12","","","Pargasite","- Al2.73 Ca3.16 F0.04 Fe2.33 H2 K3.85 Mg2.11 Na1.5 O23.96 Si5.92 Ti0.55 -","- Al2.73 Ca3.16 F0.04 Fe2.33 H2 K3.85 Mg2.11 Na1.5 O23.96 Si5.92 Ti0.55 -","- Al5.46 Ca6.32 F0.08 Fe4.66 H4 K7.7 Mg4.22 Na3 O47.92 Si11.84 Ti1.1 -","2","0.25","","Oberti, R.; Vannucci, R.; Zanetti, A.; Tiepolo, M.; Brumm, R. C.","A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene DTi values in petrogenetic studies SAMPLE 8","American Mineralogist","2000","85","","407","419","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:43",""
"9002275","9.873","","18.06","","5.315","","90","","105.17","","90","","914.675","","","","","","","","","","","","","11","C 1 2/m 1","-C 2y","12","","","Pargasite","- Al2.55 Ca3.28 F0.04 Fe1.8 H2 K0.45 Mg2.36 Na1.36 O23.96 Si6 Ti0.65 -","- Al2.55 Ca3.28 F0.04 Fe1.8 H2 K0.45 Mg2.36 Na1.36 O23.96 Si6 Ti0.65 -","- Al5.1 Ca6.56 F0.08 Fe3.6 H4 K0.9 Mg4.72 Na2.72 O47.92 Si12 Ti1.3 -","2","0.25","","Oberti, R.; Vannucci, R.; Zanetti, A.; Tiepolo, M.; Brumm, R. C.","A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene DTi values in petrogenetic studies SAMPLE 9","American Mineralogist","2000","85","","407","419","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:44",""
"9002276","9.865","","18.059","","5.314","","90","","105.08","","90","","914.099","","","","","","","","","","","","","11","C 1 2/m 1","-C 2y","12","","","Pargasite","- Al2.65 Ca3.16 F0.04 Fe2.08 H2 K0.35 Mg2.44 Na1.44 O23.96 Si6 Ti0.55 -","- Al2.65 Ca3.16 F0.04 Fe2.08 H2 K0.35 Mg2.44 Na1.44 O23.96 Si6 Ti0.55 -","- Al5.3 Ca6.32 F0.08 Fe4.16 H4 K0.7 Mg4.88 Na2.88 O47.92 Si12 Ti1.1 -","2","0.25","","Oberti, R.; Vannucci, R.; Zanetti, A.; Tiepolo, M.; Brumm, R. C.","A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene DTi values in petrogenetic studies SAMPLE 10","American Mineralogist","2000","85","","407","419","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:44",""
"9002277","9.856","","18.057","","5.316","","90","","105.07","","90","","913.55","","","","","","","","","","","","","11","C 1 2/m 1","-C 2y","12","","","Pargasite","- Al2.73 Ca3.12 F0.04 Fe1.97 H2 K0.45 Mg2.49 Na1.32 O23.96 Si5.92 Ti0.65 -","- Al2.73 Ca3.12 F0.04 Fe1.97 H2 K0.45 Mg2.49 Na1.32 O23.96 Si5.92 Ti0.65 -","- Al5.46 Ca6.24 F0.08 Fe3.94 H4 K0.9 Mg4.98 Na2.64 O47.92 Si11.84 Ti1.3 -","2","0.25","","Oberti, R.; Vannucci, R.; Zanetti, A.; Tiepolo, M.; Brumm, R. C.","A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene DTi values in petrogenetic studies SAMPLE 11","American Mineralogist","2000","85","","407","419","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:44",""
"9002278","9.862","","18.063","","5.319","","90","","105.06","","90","","914.969","","","","","","","","","","","","","11","C 1 2/m 1","-C 2y","12","","","Pargasite","- Al2.73 Ca3.16 F0.04 Fe2.75 H2 K0.42 Mg5.85 Na1.49 O23.96 Si5.92 Ti0.35 -","- Al2.73 Ca3.16 F0.04 Fe2.75 H2 K0.42 Mg5.85 Na1.49 O23.96 Si5.92 Ti0.35 -","- Al5.46 Ca6.32 F0.08 Fe5.5 H4 K0.84 Mg11.7 Na2.98 O47.92 Si11.84 Ti0.7 -","2","0.25","","Oberti, R.; Vannucci, R.; Zanetti, A.; Tiepolo, M.; Brumm, R. C.","A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene DTi values in petrogenetic studies SAMPLE 12","American Mineralogist","2000","85","","407","419","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:44",""
"9002279","9.857","","18.037","","5.31","","90","","105.09","","90","","911.515","","","","","","","","","","","","","11","C 1 2/m 1","-C 2y","12","","","Pargasite","- Al2.81 Ca3.16 F0.04 Fe2.44 H2 K0.43 Mg6.1 Na1.43 O23.96 Si5.84 Ti0.45 -","- Al2.81 Ca3.16 F0.04 Fe2.44 H2 K0.43 Mg6.1 Na1.43 O23.96 Si5.84 Ti0.45 -","- Al5.62 Ca6.32 F0.08 Fe4.88 H4 K0.86 Mg12.2 Na2.86 O47.92 Si11.68 Ti0.9 -","2","0.25","","Oberti, R.; Vannucci, R.; Zanetti, A.; Tiepolo, M.; Brumm, R. C.","A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene DTi values in petrogenetic studies SAMPLE 13","American Mineralogist","2000","85","","407","419","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:44",""
"9002280","9.898","","18.112","","5.324","","90","","105.18","","90","","921.145","","","","","","","","","","","","","11","C 1 2/m 1","-C 2y","12","","","Pargasite","- Al2.55 Ca3.36 F0.04 Fe2.65 H2 K0.55 Mg5.55 Na1.39 O23.96 Si6 Ti0.65 -","- Al2.55 Ca3.36 F0.04 Fe2.65 H2 K0.55 Mg5.55 Na1.39 O23.96 Si6 Ti0.65 -","- Al5.1 Ca6.72 F0.08 Fe5.3 H4 K1.1 Mg11.1 Na2.78 O47.92 Si12 Ti1.3 -","2","0.25","","Oberti, R.; Vannucci, R.; Zanetti, A.; Tiepolo, M.; Brumm, R. C.","A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene DTi values in petrogenetic studies SAMPLE 14","American Mineralogist","2000","85","","407","419","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:44",""
"9002281","9.862","","18.067","","5.316","","90","","105.11","","90","","914.441","","","","","","","","","","","","","11","C 1 2/m 1","-C 2y","12","","","Pargasite","- Al2.61 Ca3.28 F1.04 Fe2.28 H2 K0.5 Mg6.1 Na1.41 O21.88 Si5.84 Ti0.65 -","- Al2.61 Ca3.28 F1.04 Fe2.28 H2 K0.5 Mg6.1 Na1.41 O21.88 Si5.84 Ti0.65 -","- Al5.22 Ca6.56 F2.08 Fe4.56 H4 K Mg12.2 Na2.82 O43.76 Si11.68 Ti1.3 -","2","0.25","","Oberti, R.; Vannucci, R.; Zanetti, A.; Tiepolo, M.; Brumm, R. C.","A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene DTi values in petrogenetic studies SAMPLE 15","American Mineralogist","2000","85","","407","419","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:44",""
"9002282","9.871","","18.028","","5.307","","90","","105.24","","90","","911.192","","","","","","","","","","","","","10","C 1 2/m 1","-C 2y","12","","","Pargasite","- Al2.48 Ca3.44 Fe1.06 H2 K0.47 Mg3.2 Na1.4 O24 Si5.92 Ti0.7 -","- Al2.48 Ca3.44 Fe1.06 H2 K0.47 Mg3.2 Na1.4 O24 Si5.92 Ti0.7 -","- Al4.96 Ca6.88 Fe2.12 H4 K0.94 Mg6.4 Na2.8 O48 Si11.84 Ti1.4 -","2","0.25","","Oberti, R.; Vannucci, R.; Zanetti, A.; Tiepolo, M.; Brumm, R. C.","A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene DTi values in petrogenetic studies SAMPLE 16","American Mineralogist","2000","85","","407","419","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:44",""
"9002283","9.888","","18.023","","5.308","","90","","105.31","","90","","912.376","","","","","","","","","","","","","10","C 1 2/m 1","-C 2y","12","","","Pargasite","- Al2.53 Ca3.44 Fe0.52 H2 K0.35 Mg3.7 Na1.56 O24 Si5.92 Ti0.65 -","- Al2.53 Ca3.44 Fe0.52 H2 K0.35 Mg3.7 Na1.56 O24 Si5.92 Ti0.65 -","- Al5.06 Ca6.88 Fe1.04 H4 K0.7 Mg7.4 Na3.12 O48 Si11.84 Ti1.3 -","2","0.25","","Oberti, R.; Vannucci, R.; Zanetti, A.; Tiepolo, M.; Brumm, R. C.","A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene DTi values in petrogenetic studies SAMPLE 17","American Mineralogist","2000","85","","407","419","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:44",""
"9002284","9.903","","18","","5.304","","90","","105.44","","90","","911.337","","","","","","","","","","","","","10","C 1 2/m 1","-C 2y","12","","","Pargasite","- Al2.66 Ca1.8 F0.02 H2 K0.33 Mg3.97 Na1.41 O23.98 Si5.84 Ti0.65 -","- Al2.66 Ca1.8 F0.02 H2 K0.33 Mg3.97 Na1.41 O23.98 Si5.84 Ti0.65 -","- Al5.32 Ca3.6 F0.04 H4 K0.66 Mg7.94 Na2.82 O47.96 Si11.68 Ti1.3 -","2","0.25","","Oberti, R.; Vannucci, R.; Zanetti, A.; Tiepolo, M.; Brumm, R. C.","A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene DTi values in petrogenetic studies SAMPLE 18","American Mineralogist","2000","85","","407","419","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:44",""
"9002285","9.906","","18.015","","5.296","","90","","105.35","","90","","911.391","","","","","","","","","","","","","10","C 1 2/m 1","-C 2y","12","","","Pargasite","- Al2.29 Ca1.74 F0.02 H2 K0.3 Mg4.14 Na1.47 O23.98 Si6.16 Ti0.55 -","- Al2.29 Ca1.74 F0.02 H2 K0.3 Mg4.14 Na1.47 O23.98 Si6.16 Ti0.55 -","- Al4.58 Ca3.48 F0.04 H4 K0.6 Mg8.28 Na2.94 O47.96 Si12.32 Ti1.1 -","2","0.25","","Oberti, R.; Vannucci, R.; Zanetti, A.; Tiepolo, M.; Brumm, R. C.","A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene DTi values in petrogenetic studies SAMPLE 19","American Mineralogist","2000","85","","407","419","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:44",""
"9002286","9.919","","18.08","","5.313","","90","","105.26","","90","","919.215","","","","","","","","","","","","","10","C 1 2/m 1","-C 2y","12","","","Pargasite","- Al2.4 Ca3.56 Fe1.64 H2 K0.56 Mg2.91 Na1.14 O24 Si6 Ti0.45 -","- Al2.4 Ca3.56 Fe1.64 H2 K0.56 Mg2.91 Na1.14 O24 Si6 Ti0.45 -","- Al4.8 Ca7.12 Fe3.28 H4 K1.12 Mg5.82 Na2.28 O48 Si12 Ti0.9 -","2","0.25","","Oberti, R.; Vannucci, R.; Zanetti, A.; Tiepolo, M.; Brumm, R. C.","A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene DTi values in petrogenetic studies SAMPLE 20","American Mineralogist","2000","85","","407","419","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:44",""
"9002287","9.869","","18.049","","5.31","","90","","105.16","","90","","912.931","","","","","","","","","","","","","10","C 1 2/m 1","-C 2y","12","","","Pargasite","- Al2.58 Ca3.36 Fe3.41 H2 K0.3 Mg0.48 Na1.56 O24 Si5.92 Ti0.55 -","- Al2.58 Ca3.36 Fe3.41 H2 K0.3 Mg0.48 Na1.56 O24 Si5.92 Ti0.55 -","- Al5.16 Ca6.72 Fe6.82 H4 K0.6 Mg0.96 Na3.12 O48 Si11.84 Ti1.1 -","2","0.25","","Oberti, R.; Vannucci, R.; Zanetti, A.; Tiepolo, M.; Brumm, R. C.","A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene DTi values in petrogenetic studies SAMPLE 21","American Mineralogist","2000","85","","407","419","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:44",""
"9002288","10.032","","18.032","","5.284","","90","","104.85","","90","","923.934","","","","","","","","","","","","","10","C 1 2/m 1","-C 2y","12","","","Pargasite","- Al0.16 Ca1.08 Fe0.45 H2 K1.23 Mg4.45 Na1.07 O24 Si7.68 Ti0.26 -","- Al0.16 Ca1.08 Fe0.45 H2 K1.23 Mg4.45 Na1.07 O24 Si7.68 Ti0.26 -","- Al0.32 Ca2.16 Fe0.9 H4 K2.46 Mg8.9 Na2.14 O48 Si15.36 Ti0.52 -","2","0.25","","Oberti, R.; Vannucci, R.; Zanetti, A.; Tiepolo, M.; Brumm, R. C.","A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene DTi values in petrogenetic studies SAMPLE 22","American Mineralogist","2000","85","","407","419","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:44",""
"9002289","10.029","","18.061","","5.296","","90","","104.78","","90","","927.544","","","","","","","","","","","","","10","C 1 2/m 1","-C 2y","12","","","Richterite","- Al0.16 Ca0.92 Fe0.7 H2 K1.29 Mg4.05 Na1.17 O24 Si7.6 Ti0.49 -","- Al0.16 Ca0.92 Fe0.7 H2 K1.29 Mg4.05 Na1.17 O24 Si7.6 Ti0.49 -","- Al0.32 Ca1.84 Fe1.4 H4 K2.58 Mg8.1 Na2.34 O48 Si15.2 Ti0.98 -","2","0.25","","Oberti, R.; Vannucci, R.; Zanetti, A.; Tiepolo, M.; Brumm, R. C.","A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene DTi values in petrogenetic studies SAMPLE 23","American Mineralogist","2000","85","","407","419","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:44",""
"9002290","10.022","","18.075","","5.3","","90","","104.77","","90","","928.359","","","","","","","","","","","","","10","C 1 2/m 1","-C 2y","12","","","Richterite","- Al0.32 Ca0.9 Fe H1.2 K1.29 Mg3.4 Na1.22 O24 Si7.44 Ti0.84 -","- Al0.32 Ca0.9 Fe H1.2 K1.29 Mg3.4 Na1.22 O24 Si7.44 Ti0.84 -","- Al0.64 Ca1.8 Fe2 H2.4 K2.58 Mg6.8 Na2.44 O48 Si14.88 Ti1.68 -","2","0.25","","Oberti, R.; Vannucci, R.; Zanetti, A.; Tiepolo, M.; Brumm, R. C.","A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene DTi values in petrogenetic studies SAMPLE 24","American Mineralogist","2000","85","","407","419","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:35",""
"9002291","9.987","","18.061","","5.298","","90","","104.81","","90","","923.881","","","","","","","","","","","","","11","C 1 2/m 1","-C 2y","12","","","Richterite","- Al0.24 Ca0.94 F0.04 Fe0.6 H0.96 K1.32 Mg3.75 Na1.15 O23.96 Si7.52 Ti0.89 -","- Al0.24 Ca0.94 F0.04 Fe0.6 H0.96 K1.32 Mg3.75 Na1.15 O23.96 Si7.52 Ti0.89 -","- Al0.48 Ca1.88 F0.08 Fe1.2 H1.92 K2.64 Mg7.5 Na2.3 O47.92 Si15.04 Ti1.78 -","2","0.25","","Oberti, R.; Vannucci, R.; Zanetti, A.; Tiepolo, M.; Brumm, R. C.","A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene DTi values in petrogenetic studies SAMPLE 25","American Mineralogist","2000","85","","407","419","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:35",""
"9002292","9.987","","18.065","","5.298","","90","","104.82","","90","","924.043","","","","","","","","","","","","","11","C 1 2/m 1","-C 2y","12","","","Richterite","- Al0.24 Ca0.96 F0.04 Fe0.6 H0.98 K1.29 Mg3.75 Na1.16 O23.96 Si7.52 Ti0.89 -","- Al0.24 Ca0.96 F0.04 Fe0.6 H0.98 K1.29 Mg3.75 Na1.16 O23.96 Si7.52 Ti0.89 -","- Al0.48 Ca1.92 F0.08 Fe1.2 H1.96 K2.58 Mg7.5 Na2.32 O47.92 Si15.04 Ti1.78 -","2","0.25","","Oberti, R.; Vannucci, R.; Zanetti, A.; Tiepolo, M.; Brumm, R. C.","A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene DTi values in petrogenetic studies SAMPLE 26","American Mineralogist","2000","85","","407","419","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:35",""
"9002293","10.041","","18.081","","5.3","","90","","104.79","","90","","930.342","","","","","","","","","","","","","10","C 1 2/m 1","-C 2y","12","","","Richterite","- Al0.16 Ca0.92 Fe H2 K1.32 Mg3.65 Na1.2 O24 Si7.6 Ti0.59 -","- Al0.16 Ca0.92 Fe H2 K1.32 Mg3.65 Na1.2 O24 Si7.6 Ti0.59 -","- Al0.32 Ca1.84 Fe2 H4 K2.64 Mg7.3 Na2.4 O48 Si15.2 Ti1.18 -","2","0.25","","Oberti, R.; Vannucci, R.; Zanetti, A.; Tiepolo, M.; Brumm, R. C.","A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene DTi values in petrogenetic studies SAMPLE 27","American Mineralogist","2000","85","","407","419","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:44",""
"9002294","10.046","","18.065","","5.297","","90","","104.82","","90","","929.326","","","","","","","","","","","","","10","C 1 2/m 1","-C 2y","12","","","Richterite","- Al0.16 Ca Fe0.9 H2 K1.26 Mg3.85 Na1.12 O24 Si7.68 Ti0.41 -","- Al0.16 Ca Fe0.9 H2 K1.26 Mg3.85 Na1.12 O24 Si7.68 Ti0.41 -","- Al0.32 Ca2 Fe1.8 H4 K2.52 Mg7.7 Na2.24 O48 Si15.36 Ti0.82 -","2","0.25","","Oberti, R.; Vannucci, R.; Zanetti, A.; Tiepolo, M.; Brumm, R. C.","A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene DTi values in petrogenetic studies SAMPLE 28","American Mineralogist","2000","85","","407","419","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:44",""
"9002295","10.039","","18.068","","5.298","","90","","104.81","","90","","929.051","","","","","","","","","","","","","10","C 1 2/m 1","-C 2y","12","","","Richterite","- Al0.24 Ca Fe5 H2 K1.29 Mg4.05 Na1.09 O24 Si7.52 Ti0.69 -","- Al0.24 Ca Fe5 H2 K1.29 Mg4.05 Na1.09 O24 Si7.52 Ti0.69 -","- Al0.48 Ca2 Fe10 H4 K2.58 Mg8.1 Na2.18 O48 Si15.04 Ti1.38 -","2","0.25","","Oberti, R.; Vannucci, R.; Zanetti, A.; Tiepolo, M.; Brumm, R. C.","A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene DTi values in petrogenetic studies SAMPLE 29","American Mineralogist","2000","85","","407","419","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:44",""
"9002296","10.031","","18.096","","5.299","","90","","104.72","","90","","930.31","","","","","","","","","","","","","11","C 1 2/m 1","-C 2y","12","","","Richterite","- Al0.08 Ca0.84 F0.02 Fe1.55 H1.18 K1.29 Mg2.9 Na1.28 O23.98 Si7.76 Ti0.71 -","- Al0.08 Ca0.84 F0.02 Fe1.55 H1.18 K1.29 Mg2.9 Na1.28 O23.98 Si7.76 Ti0.71 -","- Al0.16 Ca1.68 F0.04 Fe3.1 H2.36 K2.58 Mg5.8 Na2.56 O47.96 Si15.52 Ti1.42 -","2","0.25","","Oberti, R.; Vannucci, R.; Zanetti, A.; Tiepolo, M.; Brumm, R. C.","A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene DTi values in petrogenetic studies SAMPLE 30","American Mineralogist","2000","85","","407","419","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:35",""
"9002297","10.011","","18.06","","5.297","","90","","104.77","","90","","926.046","","","","","","","","","","","","","11","C 1 2/m 1","-C 2y","12","","","Richterite","- Al0.16 Ca0.86 F0.04 Fe2.65 H2 K1.32 Mg3.8 Na1.23 O23.96 Si7.68 Ti0.71 -","- Al0.16 Ca0.86 F0.04 Fe2.65 H2 K1.32 Mg3.8 Na1.23 O23.96 Si7.68 Ti0.71 -","- Al0.32 Ca1.72 F0.08 Fe5.3 H4 K2.64 Mg7.6 Na2.46 O47.92 Si15.36 Ti1.42 -","2","0.25","","Oberti, R.; Vannucci, R.; Zanetti, A.; Tiepolo, M.; Brumm, R. C.","A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene DTi values in petrogenetic studies SAMPLE 31","American Mineralogist","2000","85","","407","419","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:44",""
"9002298","10.051","","18.068","","5.295","","90","","104.79","","90","","929.721","","","","","","","","","","","","","10","C 1 2/m 1","-C 2y","12","","","Richterite","- Al0.16 Ca0.94 Fe H2 K1.3 Mg3.8 Na1.15 O24 Si7.68 Ti0.36 -","- Al0.16 Ca0.94 Fe H2 K1.3 Mg3.8 Na1.15 O24 Si7.68 Ti0.36 -","- Al0.32 Ca1.88 Fe2 H4 K2.6 Mg7.6 Na2.3 O48 Si15.36 Ti0.72 -","2","0.25","","Oberti, R.; Vannucci, R.; Zanetti, A.; Tiepolo, M.; Brumm, R. C.","A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene DTi values in petrogenetic studies SAMPLE 32","American Mineralogist","2000","85","","407","419","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:44",""
"9002299","9.922","","18.047","","5.297","","90","","104.37","","90","","918.818","","","","","","","","","","","","","11","C 1 2/m 1","-C 2y","12","","","Richterite","- Al0.32 Ca0.84 F0.02 Fe0.5 H2 K0.42 Mg4.13 Na2.13 O23.98 Si7.44 Ti0.69 -","- Al0.32 Ca0.84 F0.02 Fe0.5 H2 K0.42 Mg4.13 Na2.13 O23.98 Si7.44 Ti0.69 -","- Al0.64 Ca1.68 F0.04 Fe H4 K0.84 Mg8.26 Na4.26 O47.96 Si14.88 Ti1.38 -","2","0.25","","Oberti, R.; Vannucci, R.; Zanetti, A.; Tiepolo, M.; Brumm, R. C.","A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene DTi values in petrogenetic studies SAMPLE 33","American Mineralogist","2000","85","","407","419","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:44",""
"9002300","9.908","","18.062","","5.307","","90","","104.36","","90","","920.059","","","","","","","","","","","","","11","C 1 2/m 1","-C 2y","12","","","Richterite","- Al0.24 Ca0.68 F0.04 Fe0.7 H0.88 K0.64 Mg3.4 Na2.1 O23.96 Si7.52 Ti1.14 -","- Al0.24 Ca0.68 F0.04 Fe0.7 H0.88 K0.64 Mg3.4 Na2.1 O23.96 Si7.52 Ti1.14 -","- Al0.48 Ca1.36 F0.08 Fe1.4 H1.76 K1.28 Mg6.8 Na4.2 O47.92 Si15.04 Ti2.28 -","2","0.25","","Oberti, R.; Vannucci, R.; Zanetti, A.; Tiepolo, M.; Brumm, R. C.","A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene DTi values in petrogenetic studies SAMPLE 34","American Mineralogist","2000","85","","407","419","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:35",""
"9002301","5.352","","9.268","","10.255","","90","","100.27","","90","","500.522","","","","","","","","","","","","","10","C 1 2/m 1","-C 2y","12","","","Biotite","- Al1.62 F0.04 Fe1.5 H1.8 K0.96 Mg0.76 Na0.04 O11.96 Si2.72 Ti0.22 -","- Al1.62 F0.04 Fe1.5 H1.8 K0.96 Mg0.76 Na0.04 O11.96 Si2.72 Ti0.22 -","- Al3.24 F0.08 Fe3 H3.6 K1.92 Mg1.52 Na0.08 O23.92 Si5.44 Ti0.44 -","2","0.25","","Brigatti, M. F.; Frigieri, P.; Ghezzo c; Poppi, L.","Crystal chemistry of Al-rich biotites coexisting with muscovites in peraluminous granites Sample: A4","American Mineralogist","2000","85","","436","448","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:35",""
"9002302","5.339","","9.232","","10.208","","90","","100.3","","90","","495.041","","","","","","","","","","","","","12","C 1 2/m 1","-C 2y","12","","","Biotite","- Al1.9 Ba0.01 Ca0.03 F0.32 Fe1.38 H1.56 K0.96 Mg0.73 Na0.02 O11.68 Si2.68 Ti0.14 -","- Al1.9 Ba0.01 Ca0.03 F0.32 Fe1.38 H1.56 K0.96 Mg0.73 Na0.02 O11.68 Si2.68 Ti0.14 -","- Al3.8 Ba0.02 Ca0.06 F0.64 Fe2.76 H3.12 K1.92 Mg1.46 Na0.04 O23.36 Si5.36 Ti0.28 -","2","0.25","","Brigatti, M. F.; Frigieri, P.; Ghezzo c; Poppi, L.","Crystal chemistry of Al-rich biotites coexisting with muscovites in peraluminous granites Sample: GFS15a","American Mineralogist","2000","85","","436","448","","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:09",""
"9002303","5.344","","9.256","","10.237","","90","","100.27","","90","","498.251","","","","","","","","","","","","","11","C 1 2/m 1","-C 2y","12","","","Biotite","- Al1.78 Cl0.04 F0.16 Fe1.48 H1.56 K0.98 Mg0.7 Na0.02 O11.8 Si2.72 Ti0.16 -","- Al1.78 Cl0.04 F0.16 Fe1.48 H1.56 K0.98 Mg0.7 Na0.02 O11.8 Si2.72 Ti0.16 -","- Al3.56 Cl0.08 F0.32 Fe2.96 H3.12 K1.96 Mg1.4 Na0.04 O23.6 Si5.44 Ti0.32 -","2","0.25","","Brigatti, M. F.; Frigieri, P.; Ghezzo c; Poppi, L.","Crystal chemistry of Al-rich biotites coexisting with muscovites in peraluminous granites Sample: H87","American Mineralogist","2000","85","","436","448","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:35",""
"9002304","5.328","","9.222","","10.197","","90","","100.26","","90","","493.016","","","","","","","","","","","","","9","C 1 2/m 1","-C 2y","12","","","Biotite","- Al1.96 Fe1.36 H1.56 K0.98 Mg0.72 Na0.02 O12 Si2.68 Ti0.16 -","- Al1.96 Fe1.36 H1.56 K0.98 Mg0.72 Na0.02 O12 Si2.68 Ti0.16 -","- Al3.92 Fe2.72 H3.12 K1.96 Mg1.44 Na0.04 O24 Si5.36 Ti0.32 -","2","0.25","","Brigatti, M. F.; Frigieri, P.; Ghezzo c; Poppi, L.","Crystal chemistry of Al-rich biotites coexisting with muscovites in peraluminous granites Sample: CC1","American Mineralogist","2000","85","","436","448","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:35",""
"9002305","5.347","","9.257","","10.211","","90","","100.27","","90","","497.318","","","","","","","","","","","","","11","C 1 2/m 1","-C 2y","12","","","Biotite","- Al1.84 Ba0.02 Ca0.02 Fe1.54 H1.6 K0.96 Mg0.7 Na0.03 O12 Si2.64 Ti0.2 -","- Al1.84 Ba0.02 Ca0.02 Fe1.54 H1.6 K0.96 Mg0.7 Na0.03 O12 Si2.64 Ti0.2 -","- Al3.68 Ba0.04 Ca0.04 Fe3.08 H3.2 K1.92 Mg1.4 Na0.06 O24 Si5.28 Ti0.4 -","2","0.25","","Brigatti, M. F.; Frigieri, P.; Ghezzo c; Poppi, L.","Crystal chemistry of Al-rich biotites coexisting with muscovites in peraluminous granites Sample: C3-31","American Mineralogist","2000","85","","436","448","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:35",""
"9002306","5.336","","9.239","","10.2","","90","","100.29","","90","","494.765","","","","","","","","","","","","","9","C 1 2/m 1","-C 2y","12","","","Biotite","- Al1.9 Fe1.44 H1.54 K0.95 Mg0.84 Na0.05 O12 Si2.64 Ti0.16 -","- Al1.9 Fe1.44 H1.54 K0.95 Mg0.84 Na0.05 O12 Si2.64 Ti0.16 -","- Al3.8 Fe2.88 H3.08 K1.9 Mg1.68 Na0.1 O24 Si5.28 Ti0.32 -","2","0.25","","Brigatti, M. F.; Frigieri, P.; Ghezzo c; Poppi, L.","Crystal chemistry of Al-rich biotites coexisting with muscovites in peraluminous granites Sample: B1","American Mineralogist","2000","85","","436","448","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:35",""
"9002307","5.335","","9.242","","20.181","","90","","95.2","","90","","990.951","","","","","","","","","","","","","9","C 1 2/c 1","-C 2yc","15","","","Biotite","- Al1.24 Fe1.4 H1.64 K0.98 Mg0.71 Na0.02 O12 Si1.36 Ti0.16 -","- Al1.24 Fe1.4 H1.64 K0.98 Mg0.71 Na0.02 O12 Si1.36 Ti0.16 -","- Al4.96 Fe5.6 H6.56 K3.92 Mg2.84 Na0.08 O48 Si5.44 Ti0.64 -","4","0.5","","Brigatti, M. F.; Frigieri, P.; Ghezzo c; Poppi, L.","Crystal chemistry of Al-rich biotites coexisting with muscovites in peraluminous granites Sample: C6c","American Mineralogist","2000","85","","436","448","","","","","","","","","","","","","","","","","","","","","","has coordinates","288347","2023-12-15","16:43:43",""
"9002308","5.3899","","9.3367","","10.3086","","90","","100.16","","90","","510.634","","","","","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","Annite","- Al Fe3 K0.956 O12 Si3 -","- Al Fe3 K0.956 O12 Si3 -","- Al2 Fe6 K1.912 O24 Si6 -","2","0.25","","Redhammer, G. J.; Beran, A.; Schneider, J.; Amthauer, G.; Lottermoser, W.","Spectroscopic and structural properties of synthetic micas on the annite-siderophyllite binary: Synthesis, crystal structure refinement, Mossbauer, and infrared spectroscopy Sample: A44","American Mineralogist","2000","85","","449","465","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002309","5.3944","","9.3454","","10.3284","","90","","100.22","","90","","512.423","","","","","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","Annite","- Al2.13 Fe1.94 K0.9 O12 Si2.84 -","- Al2.13 Fe1.94 K0.9 O12 Si2.84 -","- Al4.26 Fe3.88 K1.8 O24 Si5.68 -","2","0.25","","Redhammer, G. J.; Beran, A.; Schneider, J.; Amthauer, G.; Lottermoser, W.","Spectroscopic and structural properties of synthetic micas on the annite-siderophyllite binary: Synthesis, crystal structure refinement, Mossbauer, and infrared spectroscopy Sample: sd12no.10","American Mineralogist","2000","85","","449","465","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002310","5.3812","","9.3234","","10.2934","","90","","100.22","","90","","508.237","","","","","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","Annite","- Al1.64 Fe2.68 K0.96 O12 Si2.64 -","- Al1.64 Fe2.68 K0.96 O12 Si2.64 -","- Al3.28 Fe5.36 K1.92 O24 Si5.28 -","2","0.25","","Redhammer, G. J.; Beran, A.; Schneider, J.; Amthauer, G.; Lottermoser, W.","Spectroscopic and structural properties of synthetic micas on the annite-siderophyllite binary: Synthesis, crystal structure refinement, Mossbauer, and infrared spectroscopy Sample: sd37no.10","American Mineralogist","2000","85","","449","465","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002311","5.3732","","9.3097","","10.2807","","90","","100.24","","90","","506.079","","","","","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","Annite","- Al1.912 Fe2.568 K0.936 O12 Si2.592 -","- Al1.912 Fe2.568 K0.936 O12 Si2.592 -","- Al3.824 Fe5.136 K1.872 O24 Si5.184 -","2","0.25","","Redhammer, G. J.; Beran, A.; Schneider, J.; Amthauer, G.; Lottermoser, W.","Spectroscopic and structural properties of synthetic micas on the annite-siderophyllite binary: Synthesis, crystal structure refinement, Mossbauer, and infrared spectroscopy Sample: sd50no.10","American Mineralogist","2000","85","","449","465","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002312","5.3635","","9.2929","","10.2837","","90","","100.28","","90","","504.337","","","","","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","Annite","- Al2.152 Fe2.428 K0.94 O12 Si2.432 -","- Al2.152 Fe2.428 K0.94 O12 Si2.432 -","- Al4.304 Fe4.856 K1.88 O24 Si4.864 -","2","0.25","","Redhammer, G. J.; Beran, A.; Schneider, J.; Amthauer, G.; Lottermoser, W.","Spectroscopic and structural properties of synthetic micas on the annite-siderophyllite binary: Synthesis, crystal structure refinement, Mossbauer, and infrared spectroscopy Sample: sd62no.10","American Mineralogist","2000","85","","449","465","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002313","5.3607","","9.2874","","10.2664","","90","","100.3","","90","","502.896","","","","","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","Annite","- Al3.156 Fe1.624 K0.928 O12 Si2.32 -","- Al3.156 Fe1.624 K0.928 O12 Si2.32 -","- Al6.312 Fe3.248 K1.856 O24 Si4.64 -","2","0.25","","Redhammer, G. J.; Beran, A.; Schneider, J.; Amthauer, G.; Lottermoser, W.","Spectroscopic and structural properties of synthetic micas on the annite-siderophyllite binary: Synthesis, crystal structure refinement, Mossbauer, and infrared spectroscopy Sample: sd75no.10","American Mineralogist","2000","85","","449","465","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002314","5.3582","","9.2819","","10.2688","","90","","100.39","","90","","502.337","","","","","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","Annite","- Al2.52 Fe2.312 K0.92 O12 Si2.28 -","- Al2.52 Fe2.312 K0.92 O12 Si2.28 -","- Al5.04 Fe4.624 K1.84 O24 Si4.56 -","2","0.25","","Redhammer, G. J.; Beran, A.; Schneider, J.; Amthauer, G.; Lottermoser, W.","Spectroscopic and structural properties of synthetic micas on the annite-siderophyllite binary: Synthesis, crystal structure refinement, Mossbauer, and infrared spectroscopy Sample: sd87no.10","American Mineralogist","2000","85","","449","465","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002315","5.377","","9.308","","10.283","","90","","100.22","","90","","506.489","","","","","","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","Annite","- Al3.448 Fe3 K0.99 Na0.01 O12 Si2.552 -","- Al3.448 Fe3 K0.99 Na0.01 O12 Si2.552 -","- Al6.896 Fe6 K1.98 Na0.02 O24 Si5.104 -","2","0.25","","Redhammer, G. J.; Beran, A.; Schneider, J.; Amthauer, G.; Lottermoser, W.","Spectroscopic and structural properties of synthetic micas on the annite-siderophyllite binary: Synthesis, crystal structure refinement, Mossbauer, and infrared spectroscopy Sample: G-117","American Mineralogist","2000","85","","449","465","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002316","8.3965","","8.3965","","8.3965","","90","","90","","90","","591.963","","","","","","","","0","","","","","2","F d -3 m :2","-F 4vw 2vw 3","227","","","Magnetite","- Fe3 O4 -","- Fe3 O4 -","- Fe24 O32 -","8","0.0416667","","Haavik, C.; Stolen, S.; Fjellvag, H.; Hanfland, M.; Hausermann, D.","Equation of state of magnetite and its high-pressure modification: Thermodynamics of the Fe-O system at high pressure Sample at P = 0","American Mineralogist","2000","85","","514","523","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002317","8.3837","","8.3837","","8.3837","","90","","90","","90","","589.26","","","","","","","","1400000","","","","","2","F d -3 m :2","-F 4vw 2vw 3","227","","","Magnetite","- Fe3 O4 -","- Fe3 O4 -","- Fe24 O32 -","8","0.0416667","","Haavik, C.; Stolen, S.; Fjellvag, H.; Hanfland, M.; Hausermann, D.","Equation of state of magnetite and its high-pressure modification: Thermodynamics of the Fe-O system at high pressure Sample at P = 1.4 GPa","American Mineralogist","2000","85","","514","523","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002318","8.3685","","8.3685","","8.3685","","90","","90","","90","","586.061","","","","","","","","2300000","","","","","2","F d -3 m :2","-F 4vw 2vw 3","227","","","Magnetite","- Fe3 O4 -","- Fe3 O4 -","- Fe24 O32 -","8","0.0416667","","Haavik, C.; Stolen, S.; Fjellvag, H.; Hanfland, M.; Hausermann, D.","Equation of state of magnetite and its high-pressure modification: Thermodynamics of the Fe-O system at high pressure Sample at P = 2.3 GPa","American Mineralogist","2000","85","","514","523","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002319","8.3517","","8.3517","","8.3517","","90","","90","","90","","582.539","","","","","","","","3400000","","","","","2","F d -3 m :2","-F 4vw 2vw 3","227","","","Magnetite","- Fe3 O4 -","- Fe3 O4 -","- Fe24 O32 -","8","0.0416667","","Haavik, C.; Stolen, S.; Fjellvag, H.; Hanfland, M.; Hausermann, D.","Equation of state of magnetite and its high-pressure modification: Thermodynamics of the Fe-O system at high pressure Sample at P = 3.4 GPa","American Mineralogist","2000","85","","514","523","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002320","8.3122","","8.3122","","8.3122","","90","","90","","90","","574.312","","","","","","","","6600000","","","","","2","F d -3 m :2","-F 4vw 2vw 3","227","","","Magnetite","- Fe3 O4 -","- Fe3 O4 -","- Fe24 O32 -","8","0.0416667","","Haavik, C.; Stolen, S.; Fjellvag, H.; Hanfland, M.; Hausermann, D.","Equation of state of magnetite and its high-pressure modification: Thermodynamics of the Fe-O system at high pressure Sample at P = 6.6 GPa","American Mineralogist","2000","85","","514","523","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002321","8.2966","","8.2966","","8.2966","","90","","90","","90","","571.085","","","","","","","","8300000","","","","","2","F d -3 m :2","-F 4vw 2vw 3","227","","","Magnetite","- Fe3 O4 -","- Fe3 O4 -","- Fe24 O32 -","8","0.0416667","","Haavik, C.; Stolen, S.; Fjellvag, H.; Hanfland, M.; Hausermann, D.","Equation of state of magnetite and its high-pressure modification: Thermodynamics of the Fe-O system at high pressure Sample at P = 8.3 GPa","American Mineralogist","2000","85","","514","523","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002322","8.2626","","8.2626","","8.2626","","90","","90","","90","","564.092","","","","","","","","11300000","","","","","2","F d -3 m :2","-F 4vw 2vw 3","227","","","Magnetite","- Fe3 O4 -","- Fe3 O4 -","- Fe24 O32 -","8","0.0416667","","Haavik, C.; Stolen, S.; Fjellvag, H.; Hanfland, M.; Hausermann, D.","Equation of state of magnetite and its high-pressure modification: Thermodynamics of the Fe-O system at high pressure Sample at P = 11.3 GPa","American Mineralogist","2000","85","","514","523","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002323","8.2547","","8.2547","","8.2547","","90","","90","","90","","562.476","","","","","","","","12500000","","","","","2","F d -3 m :2","-F 4vw 2vw 3","227","","","Magnetite","- Fe3 O4 -","- Fe3 O4 -","- Fe24 O32 -","8","0.0416667","","Haavik, C.; Stolen, S.; Fjellvag, H.; Hanfland, M.; Hausermann, D.","Equation of state of magnetite and its high-pressure modification: Thermodynamics of the Fe-O system at high pressure Sample at P = 12.5 GPa","American Mineralogist","2000","85","","514","523","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002324","8.2396","","8.2396","","8.2396","","90","","90","","90","","559.395","","","","","","","","13500000","","","","","2","F d -3 m :2","-F 4vw 2vw 3","227","","","Magnetite","- Fe3 O4 -","- Fe3 O4 -","- Fe24 O32 -","8","0.0416667","","Haavik, C.; Stolen, S.; Fjellvag, H.; Hanfland, M.; Hausermann, D.","Equation of state of magnetite and its high-pressure modification: Thermodynamics of the Fe-O system at high pressure Sample at P = 13.5 GPa","American Mineralogist","2000","85","","514","523","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002325","8.2321","","8.2321","","8.2321","","90","","90","","90","","557.869","","","","","","","","15700000","","","","","2","F d -3 m :2","-F 4vw 2vw 3","227","","","Magnetite","- Fe3 O4 -","- Fe3 O4 -","- Fe24 O32 -","8","0.0416667","","Haavik, C.; Stolen, S.; Fjellvag, H.; Hanfland, M.; Hausermann, D.","Equation of state of magnetite and its high-pressure modification: Thermodynamics of the Fe-O system at high pressure Sample at P = 15.7 GPa","American Mineralogist","2000","85","","514","523","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002326","8.214","","8.214","","8.214","","90","","90","","90","","554.197","","","","","","","","17500000","","","","","2","F d -3 m :2","-F 4vw 2vw 3","227","","","Magnetite","- Fe3 O4 -","- Fe3 O4 -","- Fe24 O32 -","8","0.0416667","","Haavik, C.; Stolen, S.; Fjellvag, H.; Hanfland, M.; Hausermann, D.","Equation of state of magnetite and its high-pressure modification: Thermodynamics of the Fe-O system at high pressure Sample at P = 17.5 GPa","American Mineralogist","2000","85","","514","523","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002327","8.1891","","8.1891","","8.1891","","90","","90","","90","","549.172","","","","","","","","19400000","","","","","2","F d -3 m :2","-F 4vw 2vw 3","227","","","Magnetite","- Fe3 O4 -","- Fe3 O4 -","- Fe24 O32 -","8","0.0416667","","Haavik, C.; Stolen, S.; Fjellvag, H.; Hanfland, M.; Hausermann, D.","Equation of state of magnetite and its high-pressure modification: Thermodynamics of the Fe-O system at high pressure Sample at P = 19.4 GPa","American Mineralogist","2000","85","","514","523","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002328","8.171","","8.171","","8.171","","90","","90","","90","","545.539","","","","","","","","21800000","","","","","2","F d -3 m :2","-F 4vw 2vw 3","227","","","Magnetite","- Fe3 O4 -","- Fe3 O4 -","- Fe24 O32 -","8","0.0416667","","Haavik, C.; Stolen, S.; Fjellvag, H.; Hanfland, M.; Hausermann, D.","Equation of state of magnetite and its high-pressure modification: Thermodynamics of the Fe-O system at high pressure Sample at P = 21.8 GPa","American Mineralogist","2000","85","","514","523","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002329","8.1509","","8.1509","","8.1509","","90","","90","","90","","541.523","","","","","","","","24200000","","","","","2","F d -3 m :2","-F 4vw 2vw 3","227","","","Magnetite","- Fe3 O4 -","- Fe3 O4 -","- Fe24 O32 -","8","0.0416667","","Haavik, C.; Stolen, S.; Fjellvag, H.; Hanfland, M.; Hausermann, D.","Equation of state of magnetite and its high-pressure modification: Thermodynamics of the Fe-O system at high pressure Sample at P = 24.2 GPa","American Mineralogist","2000","85","","514","523","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002330","8.1177","","8.1177","","8.1177","","90","","90","","90","","534.933","","","","","","","","26900000","","","","","2","F d -3 m :2","-F 4vw 2vw 3","227","","","Magnetite","- Fe3 O4 -","- Fe3 O4 -","- Fe24 O32 -","8","0.0416667","","Haavik, C.; Stolen, S.; Fjellvag, H.; Hanfland, M.; Hausermann, D.","Equation of state of magnetite and its high-pressure modification: Thermodynamics of the Fe-O system at high pressure Sample at P = 26.9 GPa","American Mineralogist","2000","85","","514","523","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002331","8.0636","","8.0636","","8.0636","","90","","90","","90","","524.309","","","","","","","","30300000","","","","","2","F d -3 m :2","-F 4vw 2vw 3","227","","","Magnetite","- Fe3 O4 -","- Fe3 O4 -","- Fe24 O32 -","8","0.0416667","","Haavik, C.; Stolen, S.; Fjellvag, H.; Hanfland, M.; Hausermann, D.","Equation of state of magnetite and its high-pressure modification: Thermodynamics of the Fe-O system at high pressure Sample at P = 30.3 GPa","American Mineralogist","2000","85","","514","523","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002332","9.273","","9.239","","2.746","","90","","90","","90","","235.259","","","","","","","","","","","","","2","B b m m","-B 2 2b","63","","","Magnetite-h","- Fe3 O4 -","- Fe3 O4 -","- Fe12 O16 -","4","0.25","","Haavik, C.; Stolen, S.; Fjellvag, H.; Hanfland, M.; Hausermann, D.","Equation of state of magnetite and its high-pressure modification: Thermodynamics of the Fe-O system at high pressure Sample at 40 GPa, CaTi2O4 structure type","American Mineralogist","2000","85","","514","523","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002333","11.4573","","11.4573","","11.4573","","90","","90","","90","","1504","","","","","","","","","","","","","4","I a -3 d","-I 4bd 2c 3","230","","","Pyrope","- Al2 Mg3 O12 Si3 -","- Al2 Mg3 O12 Si3 -","- Al16 Mg24 O96 Si24 -","8","0.0833333","","Merli, M.; Ungaretti, L.; Oberti, R.","Leverage analysis and structure refinement of minerals Sample: from Dora Maira 3","American Mineralogist","2000","85","","532","542","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002334","9.8359","","18.045","","5.2752","","90","","104.75","","90","","905.434","","","","","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","Tremolite","- Ca2 H2 Mg5 O24 Si8 -","- Ca2 H2 Mg5 O24 Si8 -","- Ca4 H4 Mg10 O48 Si16 -","2","0.25","","Merli, M.; Ungaretti, L.; Oberti, R.","Leverage analysis and structure refinement of minerals Sample: from Val Tremola 9527","American Mineralogist","2000","85","","532","542","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002335","15.487","","15.487","","11.764","","90","","90","","90","","2821.56","","","","","","","","","","","","","8","P 4 n c","P 4 -2n","104","","","Vesuvianite","- Al12 Ca18.76 H9 Mg0.148 Mn0.852 Na0.24 O78 Si18 -","- Al12 Ca18.76 H9 Mg0.148 Mn0.852 Na0.24 O78 Si18 -","- Al24 Ca37.52 H18 Mg0.296 Mn1.704 Na0.48 O156 Si36 -","2","0.25","","Armbruster, T.; Gnos, E.","P4/n and P4nc long-ranged ordering in low-temperature vesuvianites Sample: from N'chwaning II mine, RSA","American Mineralogist","2000","85","","563","569","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002336","15.531","","15.531","","11.817","","90","","90","","90","","2850.4","","","","","","","","","","","","","7","P 4/n :2","-P 4a","85","","","Vesuvianite","- Al5 Ca9.88 Fe H4 Mg O39 Si9 -","- Al5 Ca9.88 Fe H4 Mg O39 Si9 -","- Al20 Ca39.52 Fe4 H16 Mg4 O156 Si36 -","4","0.5","","Armbruster, T.; Gnos, E.","P4/n and P4nc long-ranged ordering in low-temperature vesuvianites Sample: from Asbestos Quebec, Canada","American Mineralogist","2000","85","","563","569","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002337","15.571","","15.571","","11.789","","90","","90","","90","","2858.31","","","","","","","","","","","","","6","P 4/n :2","-P 4a","85","","","Vesuvianite","- Al4.74 B0.24 Ca9.5 Mn1.76 O39.2 Si8.67 -","- Al4.74 B0.24 Ca9.5 Mn1.76 O39.2 Si8.67 -","- Al18.96 B0.96 Ca38 Mn7.04 O156.8 Si34.68 -","4","0.5","","Armbruster, T.; Gnos, E.","Tetrahedral vacancies and cation ordering in low-temperature Mn-bearing vesuvianites: Indication of a hydrogarnet-like substitution Sample: NC14-2","American Mineralogist","2000","85","","570","577","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:41:58",""
"9002338","9.536","","17.797","","5.278","","90","","102.54","","90","","874.373","","","","","","","","","","","","","11","C 1 2/m 1","-C 2y","12","","","Sodic-ferripedrizite","- Al0.2 Ca0.04 F0.84 Fe1.98 H1.16 K0.03 Li2.24 Mg1.76 Na1.3 O23.16 Si8 -","- Al0.2 Ca0.04 F0.84 Fe1.98 H1.16 K0.03 Li2.24 Mg1.76 Na1.3 O23.16 Si8 -","- Al0.4 Ca0.08 F1.68 Fe3.96 H2.32 K0.06 Li4.48 Mg3.52 Na2.6 O46.32 Si16 -","2","0.25","","Oberti, R.; Caballero, J. M.; Ottolini, L.; Lopez-Andres S; Herreros, V.","Sodic-ferripedrizite, a new monoclinic amphibole bridging the magnesium-iron-manganese-lithium and the sodium-calcium groups Note: site occupancy unknown Sample: crystal P(1)","American Mineralogist","2000","85","","578","585","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:44",""
"9002339","9.534","","17.785","","5.278","","90","","102.52","","90","","873.668","","","","","","","","","","","","","11","C 1 2/m 1","-C 2y","12","","","Sodic-ferripedrizite","- Al0.2 Ca0.04 F0.94 Fe1.98 H1.06 K0.03 Li2.48 Mg1.76 Na1.32 O23.06 Si8 -","- Al0.2 Ca0.04 F0.94 Fe1.98 H1.06 K0.03 Li2.48 Mg1.76 Na1.32 O23.06 Si8 -","- Al0.4 Ca0.08 F1.88 Fe3.96 H2.12 K0.06 Li4.96 Mg3.52 Na2.64 O46.12 Si16 -","2","0.25","","Oberti, R.; Caballero, J. M.; Ottolini, L.; Lopez-Andres S; Herreros, V.","Sodic-ferripedrizite, a new monoclinic amphibole bridging the magnesium-iron-manganese-lithium and the sodium-calcium groups Note: site occupancy unknown Sample: crystal P(2)","American Mineralogist","2000","85","","578","585","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:44",""
"9002340","4.612","","4.612","","9.374","","90","","90","","120","","172.677","","","","","","","","","","","","","6","P -6 2 m","P -6 -2","189","","","Peprossiite-(Ce)","- Al2 B3.868 Ca0.102 O10.667 Pr0.818 Si0.132 -","- Al2.00001 B3.868 Ca0.102 O10.6667 Pr0.818 Si0.132 -","- Al2.00001 B3.868 Ca0.102 O10.6667 Pr0.818 Si0.132 -","1","0.0833333","","Callegari, A.; Caucia, F.; Mazzi, F.; Oberti, R.; Ottolini, L.; Ungaretti, L.","The crystal structure of peprossiite-(Ce), and anhydrous REE and Al mica-like borate with square-pyramidal coordination for Al Sample: Pep1","American Mineralogist","2000","85","","586","593","","","","","","","","","","","","","","","","","","","","","","has coordinates","285044","2023-07-06","18:10:12",""
"9002341","4.596","","4.596","","9.309","","90","","90","","120","","170.292","","","","","","","","","","","","","5","P -6 2 m","P -6 -2","189","","","Peprossiite-(Ce)","- Al2 B4 La0.785 O10.667 Th0.215 -","- Al2.00001 B4 La0.785 O10.6667 Th0.215 -","- Al2.00001 B4 La0.785 O10.6667 Th0.215 -","1","0.0833333","","Callegari, A.; Caucia, F.; Mazzi, F.; Oberti, R.; Ottolini, L.; Ungaretti, L.","The crystal structure of peprossiite-(Ce), and anhydrous REE and Al mica-like borate with square-pyramidal coordination for Al Sample: Pep2","American Mineralogist","2000","85","","586","593","","","","","","","","","","","","","","","","","","","","","","has coordinates","285044","2023-07-06","18:10:12",""
"9002342","16.119","","16.119","","9.868","","90","","90","","120","","2220.42","","","","","","","","","","","","","4","P 3","P 3","143","","","Brandholzite","- H24 Mg O18 Sb2 -","- H24 Mg O18 Sb2 -","- H144 Mg6 O108 Sb12 -","6","2","","Friedrich, A.; Wildner, M.; Tillmanns, E.; Merz, P. L.","Crystal chemistry of the new mineral brandholzite, Mg(H2O)6[Sb(OH)6]2, and of the synthetic analogues M(H2O)6[Sb(OH)6]2 (Me=Mg,Co)","American Mineralogist","2000","85","","593","599","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002343","16.105","","16.105","","9.851","","90","","90","","120","","2212.75","","","","","","","","","","","","","3","P 3","P 3","143","","","","- Co O18 Sb2 -","- Co H24 O18 Sb2 -","- Co6 H144 O108 Sb12 -","6","2","","Friedrich, A.; Wildner, M.; Tillmanns, E.; Merz, P. L.","Crystal chemistry of the new mineral brandholzite, Mg(H2O)6[Sb(OH)6]2, and of the synthetic analogues M(H2O)6[Sb(OH)6]2 (Me=Mg,Co)","American Mineralogist","2000","85","","593","599","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002344","10.145","","10.145","","4.9925","","90","","90","","120","","444.993","","","","","","","","","","","","","8","P -3 1 m","-P 3 2","162","","","Quetzalcoatlite","- Ag0.24 Cl0.84 Cu3 H6 O18 Pb0.3 Te2 Zn6 -","- Ag0.24 Cl0.84 Cu3 H6 O18 Pb0.3 Te2 Zn6 -","- Ag0.24 Cl0.84 Cu3 H6 O18 Pb0.3 Te2 Zn6 -","1","0.0833333","","Burns, P. C.; Pluth, J. J.; Smith, J. V.; Eng, P.; Steele, I. M.; Housley, R. M.","Quetzalcoatlite: New octahedral-tetrahedral structure from 2x2x40 micron crystal at the Advanced Photon Source-GSE-CARS Facility","American Mineralogist","2000","85","","604","607","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:36",""
"9002345","8.83","","8.83","","2.779","","90","","90","","120","","187.647","","","","","","","","","","","synthesized at 24 GPa","","8","P 63/m","-P 6c","176","","","","- Al1.305 Ca0.02 Fe0.3 K0.28 Mg1.295 Na0.16 O6 Si1.05 -","- Al1.305 Ca0.02 Fe0.3 K0.28 Mg1.295 Na0.16 O6 Si1.05 -","- Al2.61 Ca0.04 Fe0.6 K0.56 Mg2.59 Na0.32 O12 Si2.1 -","2","0.166667","","Gasparik, T.; Tripathi, A.; Parise, J. B.","Structure of a new Al-rich phase, [K,Na].9[Mg,Fe]2[Mg,Fe,Al,Si]6O12, synthesized at 24 GPa","American Mineralogist","2000","85","","613","618","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002346","7.7185","","6.9064","","6.7624","","90.492","","94.085","","102.775","","350.557","","","","","","","","","","","","","5","P -1","-P 1","2","","","Serandite","- H Mn1.933 Na O9 Si3 -","- H Mn1.933 Na O9 Si3 -","- H2 Mn3.866 Na2 O18 Si6 -","2","1","","Jacobsen, S. D.; Smyth, J. R.; Swope, R. J.; Sheldon, R. I.","Two proton positions in the very strong hydrogen bond of serandite, NaMn2[Si3O8(OH)] Sample: X-ray","American Mineralogist","2000","85","","745","752","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002347","7.7163","","6.9116","","6.7368","","90.465","","94.037","","102.844","","349.324","","","","","","","","","","","","","5","P -1","-P 1","2","","","Serandite","- H Mn1.924 Na O9 Si3 -","- H Mn1.924 Na O9 Si3 -","- H2 Mn3.848 Na2 O18 Si6 -","2","1","","Jacobsen, S. D.; Smyth, J. R.; Swope, R. J.; Sheldon, R. I.","Two proton positions in the very strong hydrogen bond of serandite, NaMn2[Si3O8(OH)] Sample: neutron","American Mineralogist","2000","85","","745","752","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002348","3.1264","","3.1264","","4.7315","","90","","90","","120","","40.051","","","","","","","","600000","","","","","3","P -3 m 1","-P 3 2""","164","","","Brucite","- H2 Mg O2 -","- Mg O2 -","- Mg O2 -","1","0.0833333","","Nagai, T.; Hattori, T.; Yamanaka, T.","Compression mechanism of brucite: An investigation by the structural refinement under pressure Sample: P = .6 GPa","American Mineralogist","2000","85","","760","764","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002349","3.109","","3.109","","4.6573","","90","","90","","120","","38.986","","","","","","","","2500000","","","","","3","P -3 m 1","-P 3 2""","164","","","Brucite","- H2 Mg O2 -","- Mg O2 -","- Mg O2 -","1","0.0833333","","Nagai, T.; Hattori, T.; Yamanaka, T.","Compression mechanism of brucite: An investigation by the structural refinement under pressure Sample: P = 2.5 GPa","American Mineralogist","2000","85","","760","764","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002350","3.0763","","3.0763","","4.549","","90","","90","","120","","37.282","","","","","","","","6200000","","","","","3","P -3 m 1","-P 3 2""","164","","","Brucite","- H2 Mg O2 -","- Mg O2 -","- Mg O2 -","1","0.0833333","","Nagai, T.; Hattori, T.; Yamanaka, T.","Compression mechanism of brucite: An investigation by the structural refinement under pressure Sample: P = 6.2 GPa","American Mineralogist","2000","85","","760","764","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002351","3.0533","","3.0533","","4.475","","90","","90","","120","","36.13","","","","","","","","8900000","","","","","3","P -3 m 1","-P 3 2""","164","","","Brucite","- H2 Mg O2 -","- Mg O2 -","- Mg O2 -","1","0.0833333","","Nagai, T.; Hattori, T.; Yamanaka, T.","Compression mechanism of brucite: An investigation by the structural refinement under pressure Sample: P = 8.9 GPa","American Mineralogist","2000","85","","760","764","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002352","3.0114","","3.0114","","4.353","","90","","90","","120","","34.187","","","","","","","","12500000","","","","","3","P -3 m 1","-P 3 2""","164","","","Brucite","- H2 Mg O2 -","- Mg O2 -","- Mg O2 -","1","0.0833333","","Nagai, T.; Hattori, T.; Yamanaka, T.","Compression mechanism of brucite: An investigation by the structural refinement under pressure Sample: P = 12.5 GPa","American Mineralogist","2000","85","","760","764","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002353","3.0003","","3.0003","","4.325","","90","","90","","120","","33.717","","","","","","","","16000000","","","","","3","P -3 m 1","-P 3 2""","164","","","Brucite","- H2 Mg O2 -","- Mg O2 -","- Mg O2 -","1","0.0833333","","Nagai, T.; Hattori, T.; Yamanaka, T.","Compression mechanism of brucite: An investigation by the structural refinement under pressure Sample: P = 16.0 GPa","American Mineralogist","2000","85","","760","764","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002354","2.9838","","2.9838","","4.294","","90","","90","","120","","33.108","","","","","","","","18000000","","","","","3","P -3 m 1","-P 3 2""","164","","","Brucite","- H2 Mg O2 -","- Mg O2 -","- Mg O2 -","1","0.0833333","","Nagai, T.; Hattori, T.; Yamanaka, T.","Compression mechanism of brucite: An investigation by the structural refinement under pressure Sample: P = 18.0 GPa","American Mineralogist","2000","85","","760","764","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002355","5.6978","","11.462","","8.2571","","90","","90","","90","","539.256","","","","","","","","0","","","","","3","I m m a","-I 2b 2","74","","","Wadsleyite","- Mg2 O4 Si -","- Mg2 O4 Si -","- Mg16 O32 Si8 -","8","0.5","","Hazen, R. M.; Weinberger, M. B.; Yang, H.; Prewitt, C. T.","Comparative high-pressure crystal chemistry of wadsleyite, beta-(Mg_1-xFe_x)2SiO4, with x=0 and 0.25 Sample: P = 0.00 GPa, X = .00","American Mineralogist","2000","85","","770","777","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002356","5.6731","","11.4114","","8.2067","","90","","90","","90","","531.285","","","","","","","","2720000","","","","","3","I m m a","-I 2b 2","74","","","Wadsleyite","- Mg2 O4 Si -","- Mg2 O4 Si -","- Mg16 O32 Si8 -","8","0.5","","Hazen, R. M.; Weinberger, M. B.; Yang, H.; Prewitt, C. T.","Comparative high-pressure crystal chemistry of wadsleyite, beta-(Mg_1-xFe_x)2SiO4, with x=0 and 0.25 Sample: P = 2.72 GPa, X = .00","American Mineralogist","2000","85","","770","777","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002357","5.6515","","11.3688","","8.163","","90","","90","","90","","524.479","","","","","","","","5230000","","","","","3","I m m a","-I 2b 2","74","","","Wadsleyite","- Mg2 O4 Si -","- Mg2 O4 Si -","- Mg16 O32 Si8 -","8","0.5","","Hazen, R. M.; Weinberger, M. B.; Yang, H.; Prewitt, C. T.","Comparative high-pressure crystal chemistry of wadsleyite, beta-(Mg_1-xFe_x)2SiO4, with x=0 and 0.25 Sample: P = 5.23 GPa, X = .00","American Mineralogist","2000","85","","770","777","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002358","5.639","","11.3432","","8.1389","","90","","90","","90","","520.599","","","","","","","","6800000","","","","","3","I m m a","-I 2b 2","74","","","Wadsleyite","- Mg2 O4 Si -","- Mg2 O4 Si -","- Mg16 O32 Si8 -","8","0.5","","Hazen, R. M.; Weinberger, M. B.; Yang, H.; Prewitt, C. T.","Comparative high-pressure crystal chemistry of wadsleyite, beta-(Mg_1-xFe_x)2SiO4, with x=0 and 0.25 Sample: P = 6.80 GPa, X = .00","American Mineralogist","2000","85","","770","777","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002359","5.6261","","11.3158","","8.1132","","90","","90","","90","","516.517","","","","","","","","8490000","","","","","3","I m m a","-I 2b 2","74","","","Wadsleyite","- Mg2 O4 Si -","- Mg2 O4 Si -","- Mg16 O32 Si8 -","8","0.5","","Hazen, R. M.; Weinberger, M. B.; Yang, H.; Prewitt, C. T.","Comparative high-pressure crystal chemistry of wadsleyite, beta-(Mg_1-xFe_x)2SiO4, with x=0 and 0.25 Sample: P = 8.49 GPa, X = .00","American Mineralogist","2000","85","","770","777","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002360","5.6137","","11.2918","","8.0895","","90","","90","","90","","512.784","","","","","","","","10120000","","","","","3","I m m a","-I 2b 2","74","","","Wadsleyite","- Mg2 O4 Si -","- Mg2 O4 Si -","- Mg16 O32 Si8 -","8","0.5","","Hazen, R. M.; Weinberger, M. B.; Yang, H.; Prewitt, C. T.","Comparative high-pressure crystal chemistry of wadsleyite, beta-(Mg_1-xFe_x)2SiO4, with x=0 and 0.25 Sample: P = 10.12 GPa, X = .00","American Mineralogist","2000","85","","770","777","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002361","5.7194","","11.5114","","8.3021","","90","","90","","90","","546.596","","","","","","","","0","","","","","4","I m m a","-I 2b 2","74","","","Wadsleyite","- Fe0.5 Mg1.5 O4 Si -","- Fe0.5 Mg1.5 O4 Si -","- Fe4 Mg12 O32 Si8 -","8","0.5","","Hazen, R. M.; Weinberger, M. B.; Yang, H.; Prewitt, C. T.","Comparative high-pressure crystal chemistry of wadsleyite, beta-(Mg_1-xFe_x)2SiO4, with x=0 and 0.25 Sample: P = .00 GPa, X = .25","American Mineralogist","2000","85","","770","777","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002362","5.6951","","11.4628","","8.2515","","90","","90","","90","","538.673","","","","","","","","2720000","","","","","4","I m m a","-I 2b 2","74","","","Wadsleyite","- Fe0.5 Mg1.5 O4 Si -","- Fe0.5 Mg1.5 O4 Si -","- Fe4 Mg12 O32 Si8 -","8","0.5","","Hazen, R. M.; Weinberger, M. B.; Yang, H.; Prewitt, C. T.","Comparative high-pressure crystal chemistry of wadsleyite, beta-(Mg_1-xFe_x)2SiO4, with x=0 and 0.25 Sample: P = 2.72 GPa, X = .25","American Mineralogist","2000","85","","770","777","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002363","5.6737","","11.4201","","8.2082","","90","","90","","90","","531.844","","","","","","","","5230000","","","","","4","I m m a","-I 2b 2","74","","","Wadsleyite","- Fe0.5 Mg1.5 O4 Si -","- Fe0.5 Mg1.5 O4 Si -","- Fe4 Mg12 O32 Si8 -","8","0.5","","Hazen, R. M.; Weinberger, M. B.; Yang, H.; Prewitt, C. T.","Comparative high-pressure crystal chemistry of wadsleyite, beta-(Mg_1-xFe_x)2SiO4, with x=0 and 0.25 Sample: P = 5.23 GPa, X = .25","American Mineralogist","2000","85","","770","777","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002364","5.6605","","11.394","","8.1828","","90","","90","","90","","527.756","","","","","","","","6800000","","","","","4","I m m a","-I 2b 2","74","","","Wadsleyite","- Fe0.5 Mg1.5 O4 Si -","- Fe0.5 Mg1.5 O4 Si -","- Fe4 Mg12 O32 Si8 -","8","0.5","","Hazen, R. M.; Weinberger, M. B.; Yang, H.; Prewitt, C. T.","Comparative high-pressure crystal chemistry of wadsleyite, beta-(Mg_1-xFe_x)2SiO4, with x=0 and 0.25 Sample: P = 6.80 GPa, X = .25","American Mineralogist","2000","85","","770","777","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002365","5.6485","","11.3707","","8.1594","","90","","90","","90","","524.057","","","","","","","","8490000","","","","","4","I m m a","-I 2b 2","74","","","Wadsleyite","- Fe0.5 Mg1.5 O4 Si -","- Fe0.5 Mg1.5 O4 Si -","- Fe4 Mg12 O32 Si8 -","8","0.5","","Hazen, R. M.; Weinberger, M. B.; Yang, H.; Prewitt, C. T.","Comparative high-pressure crystal chemistry of wadsleyite, beta-(Mg_1-xFe_x)2SiO4, with x=0 and 0.25 Sample: P = 8.49 GPa, X = .25","American Mineralogist","2000","85","","770","777","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002366","5.6365","","11.3464","","8.1358","","90","","90","","90","","520.317","","","","","","","","10120000","","","","","4","I m m a","-I 2b 2","74","","","Wadsleyite","- Fe0.712 Mg3.288 O8 Si2 -","- Fe0.712 Mg3.288 O8 Si2 -","- Fe2.848 Mg13.152 O32 Si8 -","4","0.25","","Hazen, R. M.; Weinberger, M. B.; Yang, H.; Prewitt, C. T.","Comparative high-pressure crystal chemistry of wadsleyite, beta-(Mg_1-xFe_x)2SiO4, with x=0 and 0.25 Sample: P = 10.12 GPa, X = .25","American Mineralogist","2000","85","","770","777","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002367","5.849","","11.8557","","8.3772","","90","","90","","90","","580.908","","","","","","","","0","","","","","3","I m m a","-I 2b 2","74","","","Wadsleyite","- Fe2.33 O4 Si0.67 -","- Fe2.33 O4 Si0.67 -","- Fe18.64 O32 Si5.36 -","8","0.5","","Hazen, R. M.; Yang, H.; Prewitt, C. T.","High-pressure crystal chemistry of Fe3±wadsleyite, beta-Fe2.33Si0.67O4 Pressure = 0.00 GPa","American Mineralogist","2000","85","","778","783","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002368","5.8286","","11.8205","","8.3481","","90","","90","","90","","575.159","","","","","","","","1950000","","","","","3","I m m a","-I 2b 2","74","","","Wadsleyite","- Fe2.33 O4 Si0.67 -","- Fe2.33 O4 Si0.67 -","- Fe18.64 O32 Si5.36 -","8","0.5","","Hazen, R. M.; Yang, H.; Prewitt, C. T.","High-pressure crystal chemistry of Fe3±wadsleyite, beta-Fe2.33Si0.67O4 Pressure = 1.95 GPa","American Mineralogist","2000","85","","778","783","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002369","5.8076","","11.7804","","8.3147","","90","","90","","90","","568.857","","","","","","","","3800000","","","","","3","I m m a","-I 2b 2","74","","","Wadsleyite","- Fe2.33 O4 Si0.67 -","- Fe2.33 O4 Si0.67 -","- Fe18.64 O32 Si5.36 -","8","0.5","","Hazen, R. M.; Yang, H.; Prewitt, C. T.","High-pressure crystal chemistry of Fe3±wadsleyite, beta-Fe2.33Si0.67O4 Pressure = 3.80 GPa","American Mineralogist","2000","85","","778","783","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002370","5.7889","","11.7496","","8.2898","","90","","90","","90","","563.849","","","","","","","","5450000","","","","","3","I m m a","-I 2b 2","74","","","Wadsleyite","- Fe2.33 O4 Si0.67 -","- Fe2.33 O4 Si0.67 -","- Fe18.64 O32 Si5.36 -","8","0.5","","Hazen, R. M.; Yang, H.; Prewitt, C. T.","High-pressure crystal chemistry of Fe3±wadsleyite, beta-Fe2.33Si0.67O4 Pressure = 5.45 GPa","American Mineralogist","2000","85","","778","783","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002371","5.7721","","11.7214","","8.2658","","90","","90","","90","","559.24","","","","","","","","7350000","","","","","3","I m m a","-I 2b 2","74","","","Wadsleyite","- Fe2.33 O4 Si0.67 -","- Fe2.33 O4 Si0.67 -","- Fe18.64 O32 Si5.36 -","8","0.5","","Hazen, R. M.; Yang, H.; Prewitt, C. T.","High-pressure crystal chemistry of Fe3±wadsleyite, beta-Fe2.33Si0.67O4 Pressure = 7.35 GPa","American Mineralogist","2000","85","","778","783","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002372","5.7557","","11.6949","","8.2433","","90","","90","","90","","554.876","","","","","","","","8950000","","","","","3","I m m a","-I 2b 2","74","","","Wadsleyite","- Fe2.33 O4 Si0.67 -","- Fe2.33 O4 Si0.67 -","- Fe18.64 O32 Si5.36 -","8","0.5","","Hazen, R. M.; Yang, H.; Prewitt, C. T.","High-pressure crystal chemistry of Fe3±wadsleyite, beta-Fe2.33Si0.67O4 Pressure = 8.95 GPa","American Mineralogist","2000","85","","778","783","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002373","7.943","","7.943","","4.93","","90","","90","","120","","269.368","","","","","","","","","","","","","5","P 3 2 1","P 3 2""","150","","","","- Al2.001 Ca3 O14 Si2.498 Ti1.501 -","- Al2.001 Ca3 O14 Si2.498 Ti1.501 -","- Al2.001 Ca3 O14 Si2.498 Ti1.501 -","1","0.166667","","Scheuermann, P.; Kutoglu, A.; Schosnig, M.; Hoffer, E.","Structure and stability of the high-pressure phase, Ca3TiSi2(Al,Ti,Si)3O14","American Mineralogist","2000","85","","784","791","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002375","6.842","","10.383","","6.67","","101.265","","98.174","","86.378","","459.684","","","","","","","","","","","","","4","P -1","-P 1","2","","","Parsonsite","- O10 P2 Pb2 U -","- O10 P2 Pb2 U -","- O20 P4 Pb4 U2 -","2","1","","Burns, P. C.","A new uranyl phosphate chain in the structure of parsonsite","American Mineralogist","2000","85","","801","805","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002376","11.073","","13.067","","5.617","","90","","90","","90","","812.729","","","","","","","","","","","","","4","A m a m","-A 2 2a","63","","","Pinalite","- Cl2 O5 Pb3 W -","- Cl2 O5 Pb3 W -","- Cl8 O20 Pb12 W4 -","4","0.25","","Grice, J. D.; Dunn, P. J.","Crystal-structure determination of pinalite","American Mineralogist","2000","85","","806","809","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002377","12.627","","12.627","","12.595","","90","","90","","90","","2008.16","","","","","","","","","","","","Langban mines, Filipstad district, Varmland, Sweden","8","P 42/n n m :2","-P 4ac 2bc","134","","","Philolithite","- C4 H12 Cl4 Mg2.36 Mn4.64 O34 Pb12 S -","- C4 H12 Cl4 Mg2.36 Mn4.64 O34 Pb12 S -","- C8 H24 Cl8 Mg4.72 Mn9.28 O68 Pb24 S2 -","2","0.125","","Moore, P. B.; Kampf, A. R.; Sen Gupta, P. K.","The crystal structure of philolithite, a trellis-like open framework based on cubic closest-packing of anions","American Mineralogist","2000","85","","810","816","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:36",""
"9002378","10.4971","","10.4971","","11.19513","","90","","90","","120","","1068.31","","","","","","","","","","","","","4","P 62 2 2","P 62 2 (0 0 4)","180","","","","- Al Li O4 Si -","- Al Li O4 Si -","- Al12 Li12 O48 Si12 -","12","1","","Xu, H.; Heaney, P. J.; Beall, G. H.","Phase transitions induced by solid solution in stuffed derivatives of quartz: A powder synchrotron XRD study of the LiAlSiO4-SiO2 join Sample: x=0, ordered LiAlSiO4, beta eucryptite structure","American Mineralogist","2000","85","","971","979","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002379","10.4949","","10.4949","","10.965","","90","","90","","120","","1045.91","","","","","","","","","","","","","4","P 62 2 2","P 62 2 (0 0 4)","180","","","","- Al Li O4 Si -","- Al Li O4 Si -","- Al12 Li12 O48 Si12 -","12","1","","Xu, H.; Heaney, P. J.; Beall, G. H.","Phase transitions induced by solid solution in stuffed derivatives of quartz: A powder synchrotron XRD study of the LiAlSiO4-SiO2 join Sample: x=.2, Li.8Al.8Si1.2O4, beta eucryptite structure","American Mineralogist","2000","85","","971","979","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002380","5.2102","","5.2102","","5.4551","","90","","90","","120","","128.246","","","","","","","","","","","","","4","P 62 2 2","P 62 2 (0 0 4)","180","","","","- Al0.33 Li0.33 O2 Si0.67 -","- Al0.33 Li0.33 O2 Si0.67 -","- Al0.99 Li0.99 O6 Si2.01 -","3","0.25","","Xu, H.; Heaney, P. J.; Beall, G. H.","Phase transitions induced by solid solution in stuffed derivatives of quartz: A powder synchrotron XRD study of the LiAlSiO4-SiO2 join Sample: x=.33, Li.67Al.67Si1.33O4, beta quartz structure","American Mineralogist","2000","85","","971","979","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002381","5.1609","","5.1609","","5.4574","","90","","90","","120","","125.883","","","","","","","","","","","","","4","P 62 2 2","P 62 2 (0 0 4)","180","","","","- Al0.25 Li0.25 O2 Si0.75 -","- Al0.25 Li0.25 O2 Si0.75 -","- Al0.75 Li0.75 O6 Si2.25 -","3","0.25","","Xu, H.; Heaney, P. J.; Beall, G. H.","Phase transitions induced by solid solution in stuffed derivatives of quartz: A powder synchrotron XRD study of the LiAlSiO4-SiO2 join Sample: x=.50, Li.5Al.5Si1.5O4, beta quartz structure","American Mineralogist","2000","85","","971","979","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002382","5.0865","","5.0865","","5.4451","","90","","90","","120","","122.004","","","","","","","","","","","","","4","P 32 2 1","P 32 2""","154","","","","- Al0.155 Li0.155 O2 Si0.845 -","- Al0.155 Li0.155 O2 Si0.845 -","- Al0.465 Li0.465 O6 Si2.535 -","3","0.5","","Xu, H.; Heaney, P. J.; Beall, G. H.","Phase transitions induced by solid solution in stuffed derivatives of quartz: A powder synchrotron XRD study of the LiAlSiO4-SiO2 join Sample: x=.69, Li.31Al.31Si1.69O4, alpha quartz structure","American Mineralogist","2000","85","","971","979","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002383","4.9567","","4.9567","","5.4164","","90","","90","","120","","115.246","","","","","","","","","","","","","4","P 32 2 1","P 32 2""","154","","","","- Al0.05 Li0.05 O2 Si0.95 -","- Al0.05 Li0.05 O2 Si0.95 -","- Al0.15 Li0.15 O6 Si2.85 -","3","0.5","","Xu, H.; Heaney, P. J.; Beall, G. H.","Phase transitions induced by solid solution in stuffed derivatives of quartz: A powder synchrotron XRD study of the LiAlSiO4-SiO2 join Sample: x=.9, Li.1Al.1Si1.9O4, alpha quartz structure","American Mineralogist","2000","85","","971","979","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002384","12.3098","","12.3098","","12.3277","","90","","90","","90","","1868.03","","","","","","","","","","","","","4","I 41/a","","","","","","- Ca3 Ge3 Mn2 O12 -","- Ca3 Ge3 Mn2 O12 -","- Ca24 Ge24 Mn16 O96 -","8","","","Heinemann, S.; Miletich, R.","Structure and twinning of tetragonal Ca3Mn2Ge3O12 garnet","American Mineralogist","2000","85","","993","1000","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002385","6.8153","","6.8153","","18.669","","90","","90","","90","","867.144","","","","","","","","","","","","","4","I -4 2 d","I -4 2bw","122","TAPP tetragonal","","","- Fe3.21 Ge2.56 Mg2.08 O12 -","- Fe3.21 Ge2.56 Mg2.08 O12 -","- Fe12.84 Ge10.24 Mg8.32 O48 -","4","0.25","","Levy, D.; Barbier, J.","(Mg,Fe).85(Mg,Fe)4(Fe,Ge)3O12: A new tetragonal phase with its comparison with garnet","American Mineralogist","2000","85","","1053","1060","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002386","6.8217","","6.8217","","18.7818","","90","","90","","90","","874.022","","","","","","","","","","","","","5","I -4 2 d","I -4 2bw","122","TAPP tetragonal","","","- Ca0.33 Fe3.14 Ge2.52 Mg1.93 O12 -","- Ca0.33 Fe3.14 Ge2.52 Mg1.93 O12 -","- Ca1.32 Fe12.56 Ge10.08 Mg7.72 O48 -","4","0.25","","Levy, D.; Barbier, J.","(Mg,Fe).85(Mg,Fe)4(Fe,Ge)3O12: A new tetragonal phase with its comparison with garnet","American Mineralogist","2000","85","","1053","1060","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002387","6.829","","6.829","","18.994","","90","","90","","90","","885.79","","","","","","","","","","","","","5","I -4 2 d","I -4 2bw","122","TAPP tetragonal","","","- Fe3.37 Ge2.076 Mg1.766 O12 Y0.684 -","- Fe3.37 Ge2.076 Mg1.766 O12 Y0.684 -","- Fe13.48 Ge8.304 Mg7.064 O48 Y2.736 -","4","0.25","","Levy, D.; Barbier, J.","(Mg,Fe).85(Mg,Fe)4(Fe,Ge)3O12: A new tetragonal phase with its comparison with garnet","American Mineralogist","2000","85","","1053","1060","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002388","12.232","","12.232","","12.232","","90","","90","","90","","1830.17","","","","","","","","","","","","","5","I a -3 d","-I 4bd 2c 3","230","TAPP tetragonal","","","- Fe0.973 Ge2.595 Mg2.349 O12 Y2.001 -","- Fe0.973 Ge2.595 Mg2.349 O12 Y2.001 -","- Fe7.784 Ge20.76 Mg18.792 O96 Y16.008 -","8","0.0833333","","Levy, D.; Barbier, J.","(Mg,Fe).85(Mg,Fe)4(Fe,Ge)3O12: A new tetragonal phase with its comparison with garnet","American Mineralogist","2000","85","","1053","1060","","","","","","","","","","","","","","","","","","","","","","has coordinates","285044","2023-07-06","18:10:12",""
"9002389","5.2281","","14.4686","","5.4004","","90","","90","","90","","408.504","","","","","","","","","","","","","3","I 2 m b","I -2b 2","46","","","","- Al2 Ca2 O5 -","- Al2 Ca2 O5 -","- Al8 Ca8 O20 -","4","0.5","","Kahlenberg, V.; Fischer, R. X.; Shaw, C. S. J.","Rietveld analysis of dicalcium aluminate (Ca2Al2O5) - A new high pressure phase with the Brownmillerite type structure","American Mineralogist","2000","85","","1061","1065","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002390","8.8221","","3.7728","","14.0076","","90","","90","","90","","466.229","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","","Suredaite","- Fe0.01 Pb0.92 S3 Sn1.07 -","- Fe0.01 Pb0.92 S3 Sn1.07 -","- Fe0.04 Pb3.68 S12 Sn4.28 -","4","0.5","","Paar, W. H.; Miletich, R.; Topa, D.; Criddle, A. J.; De Brodtkorb, M. K.; Amthauer, G.; Tippelt, G.","Suredaite, PbSnS3, a new mineral species, from the Pirquitas Ag-Sn deposit, NW-Argentina: Mineralogy and crystal structure","American Mineralogist","2000","85","","1066","1075","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002391","4.9829","","8.5188","","7.257","","90","","90","","90","","308.048","","","","","","","","","","","","","12","P m c n","-P 2n 2a","62","","","Kozoite-(Nd)","- C Ca0.02 Ce0.005 Dy0.005 Eu0.025 Gd0.04 La0.305 Nd0.425 O4 Pr0.09 Sm0.07 Y0.015 -","- C Ca0.02 Ce0.005 Dy0.005 Eu0.025 Gd0.04 La0.305 Nd0.425 O4 Pr0.09 Sm0.07 Y0.015 -","- C4 Ca0.08 Ce0.02 Dy0.02 Eu0.1 Gd0.16 La1.22 Nd1.7 O16 Pr0.36 Sm0.28 Y0.06 -","4","0.5","","Miyawaki, R.; Matsubara, S.; Yokoyama, K.; Takeuchi, K.; Nakai, I.; Terada, Y.","Kozoite-(Nd), Nd(CO3)(OH), a new mineral in an alkali olivine basalt from Hizen-cho, Saga Prefecture, Japan","American Mineralogist","2000","85","","1076","1081","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002392","8.0844","","8.0844","","8.0844","","90","","90","","90","","528.376","","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al1.98 Mg O4 -","- Al1.98 Mg1.024 O4 -","- Al15.84 Mg8.192 O32 -","8","0.0416667","","Andreozzi, G. B.; Princivalle, F.; Skogby, H.; Della Giusta, A.","Cation ordering and structural variations with temperature in MgAl2O4 spinel: An X-ray single crystal study Sample: SP3","American Mineralogist","2000","85","","1164","1171","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002393","8.0845","","8.0845","","8.0845","","90","","90","","90","","528.396","","","","","","","","","","quenched from T = 800 C for 1 day","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al1.978 Mg O4 -","- Al1.978 Mg1.026 O4 -","- Al15.824 Mg8.208 O32 -","8","0.0416667","","Andreozzi, G. B.; Princivalle, F.; Skogby, H.; Della Giusta, A.","Cation ordering and structural variations with temperature in MgAl2O4 spinel: An X-ray single crystal study Sample: quenched from T = 800 C for 1 day","American Mineralogist","2000","85","","1164","1171","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002394","8.0841","","8.0841","","8.0841","","90","","90","","90","","528.318","","","","","","","","","","quenched from T = 850 C for 1 day","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al1.972 Mg O4 -","- Al1.972 Mg1.032 O4 -","- Al15.776 Mg8.256 O32 -","8","0.0416667","","Andreozzi, G. B.; Princivalle, F.; Skogby, H.; Della Giusta, A.","Cation ordering and structural variations with temperature in MgAl2O4 spinel: An X-ray single crystal study Sample: quenched from T = 850 C for 1 day","American Mineralogist","2000","85","","1164","1171","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002395","8.084","","8.084","","8.084","","90","","90","","90","","528.298","","","","","","","","","","quenched from T = 900 C for 1 day","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al1.972 Mg O4 -","- Al1.972 Mg1.033 O4 -","- Al15.776 Mg8.264 O32 -","8","0.0416667","","Andreozzi, G. B.; Princivalle, F.; Skogby, H.; Della Giusta, A.","Cation ordering and structural variations with temperature in MgAl2O4 spinel: An X-ray single crystal study Sample: quenched from T = 900 C for 1 day","American Mineralogist","2000","85","","1164","1171","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002396","8.0838","","8.0838","","8.0838","","90","","90","","90","","528.259","","","","","","","","","","quenched from T = 950 C for 1 day","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al1.972 Mg O4 -","- Al1.972 Mg1.03 O4 -","- Al15.776 Mg8.24 O32 -","8","0.0416667","","Andreozzi, G. B.; Princivalle, F.; Skogby, H.; Della Giusta, A.","Cation ordering and structural variations with temperature in MgAl2O4 spinel: An X-ray single crystal study Sample: quenched from T = 950 C for 1 day","American Mineralogist","2000","85","","1164","1171","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002397","8.0835","","8.0835","","8.0835","","90","","90","","90","","528.2","","","","","","","","","","quenched from T = 1000 C for 1 day","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al1.972 Mg O4 -","- Al1.972 Mg1.034 O4 -","- Al15.776 Mg8.272 O32 -","8","0.0416667","","Andreozzi, G. B.; Princivalle, F.; Skogby, H.; Della Giusta, A.","Cation ordering and structural variations with temperature in MgAl2O4 spinel: An X-ray single crystal study Sample: quenched from T = 1000 C for 1 day","American Mineralogist","2000","85","","1164","1171","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002398","8.0829","","8.0829","","8.0829","","90","","90","","90","","528.082","","","","","","","","","","quenched from T = 1100 C for 1 day","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al1.962 Mg O4 -","- Al1.962 Mg1.042 O4 -","- Al15.696 Mg8.336 O32 -","8","0.0416667","","Andreozzi, G. B.; Princivalle, F.; Skogby, H.; Della Giusta, A.","Cation ordering and structural variations with temperature in MgAl2O4 spinel: An X-ray single crystal study Sample: quenched from T = 1100 C for 1 day","American Mineralogist","2000","85","","1164","1171","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002399","8.0837","","8.0837","","8.0837","","90","","90","","90","","528.239","","","","","","","","","","quenched from T = 950 C for 3 days","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al1.968 Mg O4 -","- Al1.968 Mg1.034 O4 -","- Al15.744 Mg8.272 O32 -","8","0.0416667","","Andreozzi, G. B.; Princivalle, F.; Skogby, H.; Della Giusta, A.","Cation ordering and structural variations with temperature in MgAl2O4 spinel: An X-ray single crystal study Sample: quenched from T = 950 C for 3 days","American Mineralogist","2000","85","","1164","1171","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002400","8.0846","","8.0846","","8.0846","","90","","90","","90","","528.416","","","","","","","","","","quenched from T = 800 C for 7 days","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al1.968 Mg O4 -","- Al1.968 Mg1.033 O4 -","- Al15.744 Mg8.264 O32 -","8","0.0416667","","Andreozzi, G. B.; Princivalle, F.; Skogby, H.; Della Giusta, A.","Cation ordering and structural variations with temperature in MgAl2O4 spinel: An X-ray single crystal study Sample: quenched from T = 800 C for 7 days","American Mineralogist","2000","85","","1164","1171","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:28",""
"9002401","8.0851","","8.0851","","8.0851","","90","","90","","90","","528.514","","","","","","","","","","quenched from T = 700 C for 90 days","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al1.984 Mg O4 -","- Al1.984 Mg1.021 O4 -","- Al15.872 Mg8.168 O32 -","8","0.0416667","","Andreozzi, G. B.; Princivalle, F.; Skogby, H.; Della Giusta, A.","Cation ordering and structural variations with temperature in MgAl2O4 spinel: An X-ray single crystal study Sample: quenched from T = 700 C for 90 days","American Mineralogist","2000","85","","1164","1171","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002402","8.0856","","8.0856","","8.0856","","90","","90","","90","","528.612","","","","","","","","","","quenched from T = 600 C for 45 days","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al1.98 Mg O4 -","- Al1.98 Mg1.025 O4 -","- Al15.84 Mg8.2 O32 -","8","0.0416667","","Andreozzi, G. B.; Princivalle, F.; Skogby, H.; Della Giusta, A.","Cation ordering and structural variations with temperature in MgAl2O4 spinel: An X-ray single crystal study Sample: quenched from T = 600 C for 45 days","American Mineralogist","2000","85","","1164","1171","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002403","8.0837","","8.0837","","8.0837","","90","","90","","90","","528.239","","","","","","","","","","quenched from T = 950 C for 1 day","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al1.916 Mg O4 -","- Al1.916 Mg1.003 O4 -","- Al15.328 Mg8.024 O32 -","8","0.0416667","","Andreozzi, G. B.; Princivalle, F.; Skogby, H.; Della Giusta, A.","Cation ordering and structural variations with temperature in MgAl2O4 spinel: An X-ray single crystal study Sample: Z(O)=0, quenched from T = 950 C for 1 day","American Mineralogist","2000","85","","1164","1171","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002404","8.0837","","8.0837","","8.0837","","90","","90","","90","","528.239","","","","","","","","","","quenched from T = 950 C for 1 day","","Sample: Z(O)=-2","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al1.984 Mg O4 -","- Al1.984 Mg1.035 O4 -","- Al15.872 Mg8.28 O32 -","8","0.0416667","","Andreozzi, G. B.; Princivalle, F.; Skogby, H.; Della Giusta, A.","Cation ordering and structural variations with temperature in MgAl2O4 spinel: An X-ray single crystal study Sample: Z(O)=-2, quenched from T = 950 C for 1 day","American Mineralogist","2000","85","","1164","1171","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002405","8.0837","","8.0837","","8.0837","","90","","90","","90","","528.239","","","","","","","","","","quenched from T = 950 C for 1 day","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al1.972 Mg O4 -","- Al1.972 Mg1.03 O4 -","- Al15.776 Mg8.24 O32 -","8","0.0416667","","Andreozzi, G. B.; Princivalle, F.; Skogby, H.; Della Giusta, A.","Cation ordering and structural variations with temperature in MgAl2O4 spinel: An X-ray single crystal study Sample: Z(O)=-1.6, neutral cations, quenched from T = 950 C for 1 day","American Mineralogist","2000","85","","1164","1171","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002406","8.0837","","8.0837","","8.0837","","90","","90","","90","","528.239","","","","","","","","","","quenched from T = 950 C for 1 day","","Sample: Z(O)=-1.6, ionized cations","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al1.978 Mg O4 -","- Al1.978 Mg1.033 O4 -","- Al15.824 Mg8.264 O32 -","8","0.0416667","","Andreozzi, G. B.; Princivalle, F.; Skogby, H.; Della Giusta, A.","Cation ordering and structural variations with temperature in MgAl2O4 spinel: An X-ray single crystal study Sample: Z(O)=-1.6, ionized cations, quenched from T = 950 C for 1 day","American Mineralogist","2000","85","","1164","1171","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002407","7.56712","","7.70909","","2.90211","","90","","90","","90","","169.296","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","","Mullite","- Al1.97 Cr0.25 O5.22 Si0.78 -","- Al1.97 Cr0.25 O5.22 Si0.78 -","- Al3.94 Cr0.5 O10.44 Si1.56 -","2","0.25","","Fischer, R. X.; Schneider, H.","Crystal structure of Cr-mullite Sample: fixed slit, monochromatic","American Mineralogist","2000","85","","1175","1179","","","","","","","","","","","","","","","","","","","","","","has coordinates","283857","2023-05-18","09:26:08",""
"9002408","17.072","","9.727","","9.351","","90","","90","","90","","1552.82","","","","","","","","","","","","","6","C c c m","-C 2 2c","66","","","Cordierite","- Al4 Fe0.14 Mg1.86 Na0.09 O18.58 Si5 -","- Al4 Fe0.14 Mg1.86 Na0.09 O18.58 Si5 -","- Al16 Fe0.56 Mg7.44 Na0.36 O74.32 Si20 -","4","0.25","","Geiger, C. A.; Armbruster, T.; Khomenko, V.; Quartieri, S.","Cordierite I: The coordination of Fe2+ Sample: DA-1","American Mineralogist","2000","85","","1255","1264","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:41:58",""
"9002409","17.069","","9.725","","9.347","","90","","90","","90","","1551.56","","","","","","","","","","","","","6","C c c m","-C 2 2c","66","","","Cordierite","- Al4 Fe0.164 Mg1.836 Na0.07 O18.59 Si5 -","- Al4 Fe0.164 Mg1.836 Na0.07 O18.59 Si5 -","- Al16 Fe0.656 Mg7.344 Na0.28 O74.36 Si20 -","4","0.25","","Geiger, C. A.; Armbruster, T.; Khomenko, V.; Quartieri, S.","Cordierite I: The coordination of Fe2+ Sample: 42/IA","American Mineralogist","2000","85","","1255","1264","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:41:58",""
"9002410","17.101","","9.736","","9.331","","90","","90","","90","","1553.57","","","","","","","","","","","","","5","C c c m","-C 2 2c","66","","","Cordierite","- C4 Al4 Mg2 O18 Si5 -","- C4 Al4 Mg2 O18 Si5 -","- C16 Al16 Mg8 O72 Si20 -","4","0.25","","Geiger, C. A.; Armbruster, T.; Khomenko, V.; Quartieri, S.","Cordierite I: The coordination of Fe2+ Sample: C005","American Mineralogist","2000","85","","1255","1264","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:41:58",""
"9002411","5.262","","9.085","","10.099","","90","","100.72","","90","","474.36","","","","","","","","","","","","","11","C 1 2 1","C 2y","5","","","Polylithionite","- Al1.504 F1.746 Fe0.455 H0.142 K0.906 Li1.423 Mn0.038 Na0.005 O10.254 Rb0.051 Si3.536 -","- Al1.504 F1.746 Fe0.455 H0.142 K0.906 Li1.423 Mn0.038 Na0.005 O10.254 Rb0.051 Si3.536 -","- Al3.008 F3.492 Fe0.91 H0.284 K1.812 Li2.846 Mn0.076 Na0.01 O20.508 Rb0.102 Si7.072 -","2","0.5","","Brigatti, M. F.; Lugli, C.; Poppi, L.; Foord, E. E.; Kile, D. E.","Crystal chemical variations in Li- and Fe-rich micas from Pikes Peak batholith (central Colorado) Sample: 114","American Mineralogist","2000","85","","1275","1286","","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:09",""
"9002412","5.27","","9.092","","10.08","","90","","100.7","","90","","474.584","","","","","","","","","","","","","12","C 1 2 1","C 2y","5","","","Polylithionite","- Al1.7 F1.626 Fe0.589 H0.206 K0.94 Li1.129 Mg0.007 Mn0.038 Na0.002 O10.374 Rb0.006 Si3.412 -","- Al1.7 F1.626 Fe0.589 H0.206 K0.94 Li1.129 Mg0.007 Mn0.038 Na0.002 O10.374 Rb0.006 Si3.412 -","- Al3.4 F3.252 Fe1.178 H0.412 K1.88 Li2.258 Mg0.014 Mn0.076 Na0.004 O20.748 Rb0.012 Si6.824 -","2","0.5","","Brigatti, M. F.; Lugli, C.; Poppi, L.; Foord, E. E.; Kile, D. E.","Crystal chemical variations in Li- and Fe-rich micas from Pikes Peak batholith (central Colorado) Sample: 55a","American Mineralogist","2000","85","","1275","1286","","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:09",""
"9002413","5.263","","9.085","","10.078","","90","","100.75","","90","","473.416","","","","","","","","","","","","","12","C 1 2 1","C 2y","5","","","Polylithionite","- Al1.649 F1.534 Fe0.608 H0.24 K0.956 Li1.222 Mg0.005 Mn0.045 Na0.011 O10.466 Rb0.023 Si3.412 -","- Al1.649 F1.534 Fe0.608 H0.24 K0.956 Li1.222 Mg0.005 Mn0.045 Na0.011 O10.466 Rb0.023 Si3.412 -","- Al3.298 F3.068 Fe1.216 H0.48 K1.912 Li2.444 Mg0.01 Mn0.09 Na0.022 O20.932 Rb0.046 Si6.824 -","2","0.5","","Brigatti, M. F.; Lugli, C.; Poppi, L.; Foord, E. E.; Kile, D. E.","Crystal chemical variations in Li- and Fe-rich micas from Pikes Peak batholith (central Colorado) Sample: 55b","American Mineralogist","2000","85","","1275","1286","","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:09",""
"9002414","5.29","","9.128","","10.093","","90","","100.8","","90","","478.729","","","","","","","","","","","","","12","C 1 2 1","C 2y","5","","","Polylithionite","- Al1.705 Ca0.006 F1.552 Fe0.795 H0.186 K0.968 Li1.08 Mg0.022 Mn0.062 Na0.016 O10.448 Si3.296 -","- Al1.705 Ca0.006 F1.552 Fe0.795 H0.186 K0.968 Li1.08 Mg0.022 Mn0.062 Na0.016 O10.448 Si3.296 -","- Al3.41 Ca0.012 F3.104 Fe1.59 H0.372 K1.936 Li2.16 Mg0.044 Mn0.124 Na0.032 O20.896 Si6.592 -","2","0.5","","Brigatti, M. F.; Lugli, C.; Poppi, L.; Foord, E. E.; Kile, D. E.","Crystal chemical variations in Li- and Fe-rich micas from Pikes Peak batholith (central Colorado) sample: 130(1)","American Mineralogist","2000","85","","1275","1286","","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:09",""
"9002415","5.275","","9.105","","10.084","","90","","100.7","","90","","475.902","","","","","","","","","","","","","12","C 1 2 1","C 2y","5","","","Polylithionite","- Al1.69 Ca0.006 F1.544 Fe0.484 H0.186 K0.964 Li1.093 Mg0.022 Mn0.062 Na0.016 O10.456 Si3.328 -","- Al1.69 Ca0.006 F1.544 Fe0.484 H0.186 K0.964 Li1.093 Mg0.022 Mn0.062 Na0.016 O10.456 Si3.328 -","- Al3.38 Ca0.012 F3.088 Fe0.968 H0.372 K1.928 Li2.186 Mg0.044 Mn0.124 Na0.032 O20.912 Si6.656 -","2","0.5","","Brigatti, M. F.; Lugli, C.; Poppi, L.; Foord, E. E.; Kile, D. E.","Crystal chemical variations in Li- and Fe-rich micas from Pikes Peak batholith (central Colorado) sample: 130(2)","American Mineralogist","2000","85","","1275","1286","","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:09",""
"9002416","5.279","","9.114","","10.077","","90","","100.79","","90","","476.261","","","","","","","","","","","","","11","C 1 2 1","C 2y","5","","","Polylithionite","- Al1.84 F1.738 Fe0.748 H0.244 K0.944 Li0.973 Mg0.011 Mn0.073 Na0.023 O10.262 Si3.208 -","- Al1.84 F1.738 Fe0.748 H0.244 K0.944 Li0.973 Mg0.011 Mn0.073 Na0.023 O10.262 Si3.208 -","- Al3.68 F3.476 Fe1.496 H0.488 K1.888 Li1.946 Mg0.022 Mn0.146 Na0.046 O20.524 Si6.416 -","2","0.5","","Brigatti, M. F.; Lugli, C.; Poppi, L.; Foord, E. E.; Kile, D. E.","Crystal chemical variations in Li- and Fe-rich micas from Pikes Peak batholith (central Colorado) Sample: 137","American Mineralogist","2000","85","","1275","1286","","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:09",""
"9002417","5.285","","9.122","","10.101","","90","","100.85","","90","","478.262","","","","","","","","","","","","","12","C 1 2 1","C 2y","5","","","Polylithionite","- Al1.732 Ca0.001 F1.606 Fe0.788 H0.244 K0.96 Li0.963 Mg0.009 Mn0.01 Na0.02 O10.394 Si3.304 -","- Al1.732 Ca0.001 F1.606 Fe0.788 H0.244 K0.96 Li0.963 Mg0.009 Mn0.01 Na0.02 O10.394 Si3.304 -","- Al3.464 Ca0.002 F3.212 Fe1.576 H0.488 K1.92 Li1.926 Mg0.018 Mn0.02 Na0.04 O20.788 Si6.608 -","2","0.5","","Brigatti, M. F.; Lugli, C.; Poppi, L.; Foord, E. E.; Kile, D. E.","Crystal chemical variations in Li- and Fe-rich micas from Pikes Peak batholith (central Colorado) Sample: 104","American Mineralogist","2000","85","","1275","1286","","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:09",""
"9002418","5.283","","9.123","","10.072","","90","","100.76","","90","","476.903","","","","","","","","","","","","","12","C 1 2 1","C 2y","5","","","Polylithionite","- Al1.72 F1.654 Fe0.731 H0.244 K0.94 Li0.591 Mg0.008 Mn0.063 Na0.02 O10.346 Rb0.004 Si3.308 -","- Al1.72 F1.654 Fe0.731 H0.244 K0.94 Li0.591 Mg0.008 Mn0.063 Na0.02 O10.346 Rb0.004 Si3.308 -","- Al3.44 F3.308 Fe1.462 H0.488 K1.88 Li1.182 Mg0.016 Mn0.126 Na0.04 O20.692 Rb0.008 Si6.616 -","2","0.5","","Brigatti, M. F.; Lugli, C.; Poppi, L.; Foord, E. E.; Kile, D. E.","Crystal chemical variations in Li- and Fe-rich micas from Pikes Peak batholith (central Colorado) Sample: 54b","American Mineralogist","2000","85","","1275","1286","","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:09",""
"9002419","5.288","","9.133","","10.088","","90","","100.81","","90","","478.557","","","","","","","","","","","","","13","C 1 2 1","C 2y","5","","","Polylithionite","- Al1.645 F1.92 Fe0.887 H0.08 K0.942 Li0.862 Mg0.009 Mn0.064 Na0.04 O10.08 Rb0.003 Si3.228 Ti0.01 -","- Al1.645 F1.92 Fe0.887 H0.08 K0.942 Li0.862 Mg0.009 Mn0.064 Na0.04 O10.08 Rb0.003 Si3.228 Ti0.01 -","- Al3.29 F3.84 Fe1.774 H0.16 K1.884 Li1.724 Mg0.018 Mn0.128 Na0.08 O20.16 Rb0.006 Si6.456 Ti0.02 -","2","0.5","","Brigatti, M. F.; Lugli, C.; Poppi, L.; Foord, E. E.; Kile, D. E.","Crystal chemical variations in Li- and Fe-rich micas from Pikes Peak batholith (central Colorado) Sample: 177","American Mineralogist","2000","85","","1275","1286","","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:09",""
"9002420","5.283","","9.118","","10.092","","90","","100.78","","90","","477.557","","","","","","","","","","","","","11","C 1 2 1","C 2y","5","","","Polylithionite","- Al1.838 F1.622 Fe0.868 H0.248 K0.958 Li0.853 Mg0.051 Mn0.058 Na0.014 O10.378 Si3.176 -","- Al1.838 F1.622 Fe0.868 H0.248 K0.958 Li0.853 Mg0.051 Mn0.058 Na0.014 O10.378 Si3.176 -","- Al3.676 F3.244 Fe1.736 H0.496 K1.916 Li1.706 Mg0.102 Mn0.116 Na0.028 O20.756 Si6.352 -","2","0.5","","Brigatti, M. F.; Lugli, C.; Poppi, L.; Foord, E. E.; Kile, D. E.","Crystal chemical variations in Li- and Fe-rich micas from Pikes Peak batholith (central Colorado) sample: 140(1)","American Mineralogist","2000","85","","1275","1286","","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:09",""
"9002421","5.297","","9.146","","10.102","","90","","100.81","","90","","480.72","","","","","","","","","","","","","11","C 1 2 1","C 2y","5","","","Siderophyllite","- Al1.743 F1.64 Fe0.879 H0.248 K0.954 Li0.849 Mg0.047 Mn0.06 Na0.014 O10.36 Si3.236 -","- Al1.743 F1.64 Fe0.879 H0.248 K0.954 Li0.849 Mg0.047 Mn0.06 Na0.014 O10.36 Si3.236 -","- Al3.486 F3.28 Fe1.758 H0.496 K1.908 Li1.698 Mg0.094 Mn0.12 Na0.028 O20.72 Si6.472 -","2","0.5","","Brigatti, M. F.; Lugli, C.; Poppi, L.; Foord, E. E.; Kile, D. E.","Crystal chemical variations in Li- and Fe-rich micas from Pikes Peak batholith (central Colorado) sample: 140(2)","American Mineralogist","2000","85","","1275","1286","","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:09",""
"9002422","5.295","","9.139","","10.077","","90","","100.83","","90","","478.951","","","","","","","","","","","","","11","C 1 2 1","C 2y","5","","","Siderophyllite","- Al1.795 F1.59 Fe0.828 H0.174 K0.82 Li0.764 Mn0.078 Na0.034 O10.41 Rb0.092 Si3.312 -","- Al1.795 F1.59 Fe0.828 H0.174 K0.82 Li0.764 Mn0.078 Na0.034 O10.41 Rb0.092 Si3.312 -","- Al3.59 F3.18 Fe1.656 H0.348 K1.64 Li1.528 Mn0.156 Na0.068 O20.82 Rb0.184 Si6.624 -","2","0.5","","Brigatti, M. F.; Lugli, C.; Poppi, L.; Foord, E. E.; Kile, D. E.","Crystal chemical variations in Li- and Fe-rich micas from Pikes Peak batholith (central Colorado) Sample: 24","American Mineralogist","2000","85","","1275","1286","","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:09",""
"9002423","5.339","","9.233","","10.135","","90","","100.73","","90","","490.869","","","","","","","","","","","","","12","C 1 2 1","C 2y","5","","","Siderophyllite","- Al1.753 F1.08 Fe1.48 H0.284 K0.986 Li0.416 Mg0.054 Mn0.078 Na0.014 O10.92 Si3.056 Ti0.108 -","- Al1.753 F1.08 Fe1.48 H0.284 K0.986 Li0.416 Mg0.054 Mn0.078 Na0.014 O10.92 Si3.056 Ti0.108 -","- Al3.506 F2.16 Fe2.96 H0.568 K1.972 Li0.832 Mg0.108 Mn0.156 Na0.028 O21.84 Si6.112 Ti0.216 -","2","0.5","","Brigatti, M. F.; Lugli, C.; Poppi, L.; Foord, E. E.; Kile, D. E.","Crystal chemical variations in Li- and Fe-rich micas from Pikes Peak batholith (central Colorado) Sample: 47","American Mineralogist","2000","85","","1275","1286","","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:09",""
"9002424","5.3","","9.144","","10.089","","90","","100.74","","90","","480.38","","","","","","","","","","","","","12","C 1 2 1","C 2y","5","","","Siderophyllite","- Al1.678 F1.294 Fe1.314 H0.154 K0.985 Li0.621 Mg0.022 Mn0.051 Na0.036 O10.706 Rb0.002 Si3.224 -","- Al1.678 F1.294 Fe1.314 H0.154 K0.985 Li0.621 Mg0.022 Mn0.051 Na0.036 O10.706 Rb0.002 Si3.224 -","- Al3.356 F2.588 Fe2.628 H0.308 K1.97 Li1.242 Mg0.044 Mn0.102 Na0.072 O21.412 Rb0.004 Si6.448 -","2","0.5","","Brigatti, M. F.; Lugli, C.; Poppi, L.; Foord, E. E.; Kile, D. E.","Crystal chemical variations in Li- and Fe-rich micas from Pikes Peak batholith (central Colorado) Sample: 103","American Mineralogist","2000","85","","1275","1286","","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:09",""
"9002425","5.4095","","9.4232","","8.2629","","90","","90","","90.01","","421.2","","","","","","","","","","","","","4","P 1 1 21/n","-P 2n","14","","","","- Al O4 Si Tl -","- Al O4 Si Tl -","- Al4 O16 Si4 Tl4 -","4","1","","Kyono, A.; Kimata, M.; Shimizu, M.","The crystal structure of TlAlSiO4: The role of inert pairs in exclusion of Tl from silicate minerals","American Mineralogist","2000","85","","1287","1293","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002426","14.094","","14.127","","24.106","","90","","90","","90","","4799.65","","","","","","","","","","","","","6","F 2 m m","F -2 2","42","","","Agrinierite","- Ca0.65 H14 K2 O27 Sr0.35 U6 -","- Ca0.65 H14 K2 O27 Sr0.35 U6 -","- Ca5.2 H112 K16 O216 Sr2.8 U48 -","8","0.5","","Cahill, C. L.; Burns, P. C.","The structure of agrinierite: a Sr-containing uranyl oxide hydrate mineral","American Mineralogist","2000","85","","1294","1297","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:36",""
"9002427","6.21","","7.398","","7.471","","90.1","","108.73","","107.47","","308.224","","","","","","","","","","","","","5","P -1","-P 1","2","","","Namibite","- Bi2 Cu H O7 V -","- Bi2 Cu H O7 V -","- Bi4 Cu2 H2 O14 V2 -","2","1","","Kolitsch, U.; Giester, G.","The crystal structure of namibite, Cu(BiO)2VO4(OH), and a revision of its symmetry","American Mineralogist","2000","85","","1298","1301","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:36",""
"9002428","8.814","","13.233","","11.056","","90","","101.184","","90","","1265.04","","","","","","","","","","","","Tip Top pegmatite, Custer County, South Dakota, USA","5","P 1 21/c 1","-P 2ybc","14","","","Pararobertsite","- Ca2 H6 Mn3 O17 P3 -","- Ca2 H6 Mn3 O17 P3 -","- Ca8 H24 Mn12 O68 P12 -","4","1","","Kampf, A. R.","The crystal structure of pararobertsite and its relationship to mitridatite","American Mineralogist","2000","85","","1302","1306","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002429","8.925","","6.143","","7.352","","90","","115.25","","90","","364.57","","","","","","","","","","","","Falotta, Graubunden, Switzerland","8","C 1 2/m 1","-C 2y","12","","","Cabalzarite","- Al0.816 As2 Ca Fe0.354 H3 Mg0.784 Mn0.046 O10 -","- Al0.816 As2 Ca Fe0.354 H3 Mg0.784 Mn0.046 O10 -","- Al1.632 As4 Ca2 Fe0.708 H6 Mg1.568 Mn0.092 O20 -","2","0.25","","Brugger, J.; Meisser, N.; Schenk, K.; Berlepsch, P.; Bonin, M.; Armbruster, T.; Nyfeler, D.; Schmidt, S.","Description and crystal structure of cabalzarite Ca(Mg,Al,Fe)2(AsO4)2(H2O,OH)2, a new mineral of the tsumcorite group","American Mineralogist","2000","85","","1307","1314","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:44",""
"9002430","8.9284","","6.1314","","7.3439","","90","","115.494","","90","","362.886","","","","","","","","","","","","Falotta, Graubunden, Switzerland","8","C 1 2/m 1","-C 2y","12","","","Cabalzarite","- Al0.84 As2 Ca Fe0.08 H3 Mg0.82 Mn0.26 O10 -","- Al0.84 As2 Ca Fe0.08 H3 Mg0.82 Mn0.26 O10 -","- Al1.68 As4 Ca2 Fe0.16 H6 Mg1.64 Mn0.52 O20 -","2","0.25","","Brugger, J.; Meisser, N.; Schenk, K.; Berlepsch, P.; Bonin, M.; Armbruster, T.; Nyfeler, D.; Schmidt, S.","Description and crystal structure of cabalzarite Ca(Mg,Al,Fe)2(AsO4)2(H2O,OH)2, a new mineral of the tsumcorite group","American Mineralogist","2000","85","","1307","1314","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002431","9.6499","","9.6499","","6.7725","","90","","90","","120","","546.167","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","","Chlorapatite","- Ca4.899 Cl2 La0.052 Na0.05 O12 P3 -","- Ca4.899 Cl2 La0.0519 Na0.05 O12 P3 -","- Ca9.798 Cl4 La0.1038 Na0.1 O24 P6 -","2","0.166667","","Fleet M E; Liu X; Pan Y","Rare-earth elements in chlorapatite [Ca10(PO4)6(Cl)2]: Uptake, site preference, and degradation of monoclinic structure Sample: La-ClAp","American Mineralogist","2000","85","","1437","1446","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002432","9.6474","","9.6474","","6.7747","","90","","90","","120","","546.061","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","","Chlorapatite","- Ca4.822 Cl2 Na0.087 Nd0.092 O12 P3 -","- Ca4.822 Cl2 Na0.087 Nd0.0917 O12 P3 -","- Ca9.644 Cl4 Na0.174 Nd0.1834 O24 P6 -","2","0.166667","","Fleet M E; Liu X; Pan Y","Rare-earth elements in chlorapatite [Ca10(PO4)6(Cl)2]: Uptake, site preference, and degradation of monoclinic structure Sample: Nd-ClAp","American Mineralogist","2000","85","","1437","1446","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002433","9.6487","","9.6487","","6.7652","","90","","90","","120","","545.442","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","","Chlorapatite","- Ca4.857 Cl2 Dy0.069 Na0.072 O12 P3 -","- Ca4.857 Cl2 Dy0.069 Na0.072 O12 P3 -","- Ca9.714 Cl4 Dy0.138 Na0.144 O24 P6 -","2","0.166667","","Fleet M E; Liu X; Pan Y","Rare-earth elements in chlorapatite [Ca10(PO4)6(Cl)2]: Uptake, site preference, and degradation of monoclinic structure Sample: Dy-ClAp","American Mineralogist","2000","85","","1437","1446","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002434","9.6501","","19.3002","","6.7724","","90","","90","","120","","1092.36","","","","","","","","","","","","","6","P 1 1 21/b","-P 2bc","14","","","Chlorapatite","- Ca4.899 Cl La0.052 Na0.05 O12 P3 -","- Ca4.899 Cl La0.0519 Na0.05 O12 P3 -","- Ca19.596 Cl4 La0.2076 Na0.2 O48 P12 -","4","1","","Fleet M E; Liu X; Pan Y","Rare-earth elements in chlorapatite [Ca10(PO4)6(Cl)2]: Uptake, site preference, and degradation of monoclinic structure Sample: La-ClAp","American Mineralogist","2000","85","","1437","1446","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002435","7.0572","","8.7108","","6.5534","","90","","113.786","","90","","368.643","","","","300","","","","210000","","","","","4","P 1 21/a 1","-P 2yab","14","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","1","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #001 at P = 0.21 GPa, T = 300 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002436","7.0512","","8.7141","","6.5521","","90","","113.735","","90","","368.54","","","","609","","","","870000","","","","","4","P 1 21/a 1","-P 2yab","14","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","1","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #002 at P = 0.87 GPa, T = 609 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002437","7.0494","","8.7102","","6.5484","","90","","113.742","","90","","368.054","","","","483","","","","710000","","","","","4","P 1 21/a 1","-P 2yab","14","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","1","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #003 at P = 0.71 GPa, T = 483 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002438","7.0442","","8.7132","","6.5476","","90","","113.705","","90","","367.968","","","","670","","","","1210000","","","","","4","P 1 21/a 1","-P 2yab","14","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","1","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #004 at P = 1.21 GPa, T = 670 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002439","7.0391","","8.71","","6.5433","","90","","113.686","","90","","367.379","","","","648","","","","1260000","","","","","4","P 1 21/a 1","-P 2yab","14","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","1","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #005 at P = 1.26 GPa, T = 648 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002440","7.0411","","8.7106","","6.5441","","90","","113.682","","90","","367.565","","","","628","","","","1230000","","","","","4","P 1 21/a 1","-P 2yab","14","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","1","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #006 at P = 1.23 GPa, T = 628 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002441","7.0246","","8.7037","","6.5329","","90","","113.619","","90","","365.962","","","","627","","","","1700000","","","","","4","A 1 2/a 1","-A 2ya","15","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","0.5","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #007 at P = 1.70 GPa, T = 627 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002442","7.0187","","8.6965","","6.5243","","90","","113.594","","90","","364.941","","","","518","","","","1690000","","","","","4","P 1 21/a 1","-P 2yab","14","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","1","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #008 at P = 1.69 GPa, T = 518 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002443","7.0186","","8.6983","","6.5272","","90","","113.617","","90","","365.109","","","","555","","","","1770000","","","","","4","P 1 21/a 1","-P 2yab","14","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","1","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #009 at P = 1.77 GPa, T = 555 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002444","7.0169","","8.6981","","6.5264","","90","","113.603","","90","","365.007","","","","581","","","","1840000","","","","","4","A 1 2/a 1","-A 2ya","15","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","0.5","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #010 at P = 1.84 GPa, T = 581 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002445","7.0158","","8.6986","","6.5257","","90","","113.592","","90","","364.962","","","","560","","","","1880000","","","","","4","A 1 2/a 1","-A 2ya","15","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","0.5","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #011 at P = 1.88 GPa, T = 560 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002446","6.9915","","8.6881","","6.5068","","90","","113.492","","90","","362.482","","","","666","","","","2870000","","","","","4","A 1 2/a 1","-A 2ya","15","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","0.5","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #012 at P = 2.87 GPa, T = 666 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002447","6.9754","","8.6723","","6.4885","","90","","113.443","","90","","360.108","","","","538","","","","3250000","","","","","4","A 1 2/a 1","-A 2ya","15","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","0.5","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #013 at P = 3.25 GPa, T = 538 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002448","6.9749","","8.6726","","6.4885","","90","","113.466","","90","","360.032","","","","490","","","","3190000","","","","","4","A 1 2/a 1","-A 2ya","15","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","0.5","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #014 at P = 3.19 GPa, T = 490 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002449","6.9736","","8.6716","","6.4889","","90","","113.487","","90","","359.889","","","","448","","","","3130000","","","","","4","A 1 2/a 1","-A 2ya","15","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","0.5","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #015 at P = 3.13 GPa, T = 448 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002450","6.9786","","8.6726","","6.491","","90","","113.491","","90","","360.294","","","","371","","","","2880000","","","","","4","A 1 2/a 1","-A 2ya","15","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","0.5","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #016 at P = 2.88 GPa, T = 371 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002451","6.982","","8.6748","","6.4924","","90","","113.498","","90","","360.619","","","","303","","","","2660000","","","","","4","P 1 21/a 1","-P 2yab","14","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","1","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #017 at P = 2.66 GPa, T = 303 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002452","6.9737","","8.676","","6.4902","","90","","113.434","","90","","360.293","","","","658","","","","3560000","","","","","4","A 1 2/a 1","-A 2ya","15","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","0.5","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #018 at P = 3.56 GPa, T = 658 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002453","6.9656","","8.6709","","6.4816","","90","","113.399","","90","","359.281","","","","659","","","","3970000","","","","","4","A 1 2/a 1","-A 2ya","15","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","0.5","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #019 at P = 3.97 GPa, T = 659 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002454","6.956","","8.6644","","6.4713","","90","","113.358","","90","","358.058","","","","618","","","","4290000","","","","","4","A 1 2/a 1","-A 2ya","15","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","0.5","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #020 at P = 4.29 GPa, T = 618 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002455","6.9529","","8.661","","6.4677","","90","","113.347","","90","","357.589","","","","568","","","","4260000","","","","","4","A 1 2/a 1","-A 2ya","15","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","0.5","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #021 at P = 4.26 GPa, T = 568 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002456","6.954","","8.6603","","6.4674","","90","","113.348","","90","","357.597","","","","525","","","","4110000","","","","","4","A 1 2/a 1","-A 2ya","15","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","0.5","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #022 at P = 4.11 GPa, T = 525 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002457","6.9527","","8.6576","","6.4666","","90","","113.349","","90","","357.372","","","","483","","","","4100000","","","","","4","A 1 2/a 1","-A 2ya","15","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","0.5","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #023 at P = 4.10 GPa, T = 483 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002458","6.9543","","8.6586","","6.4707","","90","","113.38","","90","","357.639","","","","399","","","","3860000","","","","","4","A 1 2/a 1","-A 2ya","15","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","0.5","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #024 at P = 3.86 GPa, T = 399 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002459","6.9559","","8.6586","","6.4672","","90","","113.376","","90","","357.538","","","","301","","","","3630000","","","","","4","A 1 2/a 1","-A 2ya","15","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","0.5","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #025 at P = 3.63 GPa, T = 301 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002460","6.9496","","8.6605","","6.4654","","90","","113.342","","90","","357.285","","","","658","","","","4670000","","","","","4","A 1 2/a 1","-A 2ya","15","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","0.5","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #026 at P = 4.67 GPa, T = 658 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002461","6.9413","","8.6549","","6.457","","90","","113.317","","90","","356.231","","","","609","","","","4930000","","","","","4","A 1 2/a 1","-A 2ya","15","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","0.5","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #027 at P = 4.93 GPa, T = 609 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002462","6.941","","8.6539","","6.4559","","90","","113.333","","90","","356.071","","","","568","","","","4880000","","","","","4","A 1 2/a 1","-A 2ya","15","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","0.5","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #028 at P = 4.88 GPa, T = 568 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002463","6.9409","","8.6532","","6.4551","","90","","113.331","","90","","355.998","","","","522","","","","4800000","","","","","4","A 1 2/a 1","-A 2ya","15","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","0.5","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #029 at P = 4.80 GPa, T = 522 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002464","6.9395","","8.6529","","6.455","","90","","113.338","","90","","355.89","","","","469","","","","4750000","","","","","4","A 1 2/a 1","-A 2ya","15","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","0.5","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #030 at P = 4.75 GPa, T = 469 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002465","6.9385","","8.6498","","6.4533","","90","","113.348","","90","","355.591","","","","396","","","","4610000","","","","","4","A 1 2/a 1","-A 2ya","15","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","0.5","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #031 at P = 4.61 GPa, T = 396 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002466","6.9399","","8.6524","","6.4547","","90","","113.352","","90","","355.836","","","","338","","","","4450000","","","","","4","A 1 2/a 1","-A 2ya","15","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","0.5","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #032 at P = 4.45 GPa, T = 338 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002467","6.9414","","8.6521","","6.4553","","90","","113.357","","90","","355.92","","","","301","","","","4360000","","","","","4","A 1 2/a 1","-A 2ya","15","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","0.5","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #033 at P = 4.36 GPa, T = 301 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002468","6.9443","","8.6582","","6.4621","","90","","113.327","","90","","356.776","","","","656","","","","4890000","","","","","4","A 1 2/a 1","-A 2ya","15","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","0.5","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #034 at P = 4.89 GPa, T = 656 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002469","6.9534","","8.6641","","6.473","","90","","113.361","","90","","357.998","","","","660","","","","4340000","","","","","4","A 1 2/a 1","-A 2ya","15","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","0.5","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #035 at P = 4.34 GPa, T = 660 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002470","6.9664","","8.6728","","6.4846","","90","","113.4","","90","","359.565","","","","662","","","","3790000","","","","","4","A 1 2/a 1","-A 2ya","15","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","0.5","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #036 at P = 3.79 GPa, T = 662 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002471","6.9915","","8.6881","","6.5068","","90","","113.492","","90","","362.482","","","","666","","","","2870000","","","","","4","A 1 2/a 1","-A 2ya","15","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","0.5","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #037 at P = 2.87 GPa, T = 666 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002472","6.9926","","8.6872","","6.5068","","90","","113.494","","90","","362.496","","","","619","","","","2740000","","","","","4","A 1 2/a 1","-A 2ya","15","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","0.5","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #038 at P = 2.74 GPa, T = 619 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002473","6.9915","","8.6849","","6.5051","","90","","113.497","","90","","362.24","","","","576","","","","2650000","","","","","4","A 1 2/a 1","-A 2ya","15","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","0.5","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #039 at P = 2.65 GPa, T = 576 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002474","6.9929","","8.685","","6.5059","","90","","113.508","","90","","362.331","","","","523","","","","2510000","","","","","4","A 1 2/a 1","-A 2ya","15","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","0.5","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #040 at P = 2.51 GPa, T = 523 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002475","6.995","","8.6858","","6.5068","","90","","113.516","","90","","362.502","","","","481","","","","2390000","","","","","4","A 1 2/a 1","-A 2ya","15","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","0.5","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #041 at P = 2.39 GPa, T = 481 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002476","6.9982","","8.6853","","6.5079","","90","","113.523","","90","","362.689","","","","440","","","","2250000","","","","","4","P 1 21/a 1","-P 2yab","14","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","1","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #042 at P = 2.25 GPa, T = 440 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002477","6.999","","8.686","","6.5073","","90","","113.521","","90","","362.731","","","","399","","","","2160000","","","","","4","P 1 21/a 1","-P 2yab","14","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","1","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #043 at P = 2.16 GPa, T = 399 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002478","6.9984","","8.6846","","6.5063","","90","","113.521","","90","","362.586","","","","354","","","","2050000","","","","","4","P 1 21/a 1","-P 2yab","14","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","1","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #044 at P = 2.05 GPa, T = 354 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002479","7.0014","","8.6869","","6.5081","","90","","113.533","","90","","362.905","","","","301","","","","1880000","","","","","4","P 1 21/a 1","-P 2yab","14","","","Titanite","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","1","","Kunz, M.; Arlt, T.; Stolz, J.","In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #045 at P = 1.88 GPa, T = 301 K","American Mineralogist","2000","85","","1465","1473","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002480","9.798","","9.14","","5.205","","90","","101.8","","90","","456.277","","","","","","","","0","","","","","3","C 1 2/c 1","-C 2yc","15","","","Clinopyroxene","- Fe Ge O3 -","- Fe Ge O3 -","- Fe8 Ge8 O24 -","8","1","","Hattori, T.; Nagai, T.; Yamanaka, T.; Werner, S.; Schulz, H.","Single-crystal X-ray diffraction study of FeGeO3 high-P clinopyroxene (C2/c) up to 8.2 GPa Sample at P = 0 GPa","American Mineralogist","2000","85","","1485","1491","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002481","9.746","","9.084","","5.177","","90","","101.52","","90","","449.1","","","","","","","","1500000","","","","","3","C 1 2/c 1","-C 2yc","15","","","Clinopyroxene","- Fe Ge O3 -","- Fe Ge O3 -","- Fe8 Ge8 O24 -","8","1","","Hattori, T.; Nagai, T.; Yamanaka, T.; Werner, S.; Schulz, H.","Single-crystal X-ray diffraction study of FeGeO3 high-P clinopyroxene (C2/c) up to 8.2 GPa Sample at P = 1.5 GPa","American Mineralogist","2000","85","","1485","1491","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002482","9.651","","8.988","","5.136","","90","","100.97","","90","","437.372","","","","","","","","4500000","","","","","3","C 1 2/c 1","-C 2yc","15","","","Clinopyroxene","- Fe Ge O3 -","- Fe Ge O3 -","- Fe8 Ge8 O24 -","8","1","","Hattori, T.; Nagai, T.; Yamanaka, T.; Werner, S.; Schulz, H.","Single-crystal X-ray diffraction study of FeGeO3 high-P clinopyroxene (C2/c) up to 8.2 GPa Sample at P = 4.5 GPa","American Mineralogist","2000","85","","1485","1491","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002483","9.6","","8.912","","5.108","","90","","100.67","","90","","429.46","","","","","","","","7400000","","","","","3","C 1 2/c 1","-C 2yc","15","","","Clinopyroxene","- Fe Ge O3 -","- Fe Ge O3 -","- Fe8 Ge8 O24 -","8","1","","Hattori, T.; Nagai, T.; Yamanaka, T.; Werner, S.; Schulz, H.","Single-crystal X-ray diffraction study of FeGeO3 high-P clinopyroxene (C2/c) up to 8.2 GPa Sample at P = 7.4 GPa","American Mineralogist","2000","85","","1485","1491","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002484","9.583","","8.883","","5.093","","90","","100.56","","90","","426.203","","","","","","","","8200000","","","","","3","C 1 2/c 1","-C 2yc","15","","","Clinopyroxene","- Fe Ge O3 -","- Fe Ge O3 -","- Fe8 Ge8 O24 -","8","1","","Hattori, T.; Nagai, T.; Yamanaka, T.; Werner, S.; Schulz, H.","Single-crystal X-ray diffraction study of FeGeO3 high-P clinopyroxene (C2/c) up to 8.2 GPa Sample at P = 8.2 GPa","American Mineralogist","2000","85","","1485","1491","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002485","9.287","","8.4","","4.85","","90","","100.025","","90","","372.576","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","Clinopyroxene","- Fe Ge O3 -","- Fe Ge O3 -","- Fe8 Ge8 O24 -","8","1","","Hattori, T.; Nagai, T.; Yamanaka, T.; Werner, S.; Schulz, H.","Single-crystal X-ray diffraction study of FeGeO3 high-P clinopyroxene (C2/c) up to 8.2 GPa Sample: Ideal pyroxene structure","American Mineralogist","2000","85","","1485","1491","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002486","5.3002","","17.761","","21.0887","","90","","90","","90","","1985.22","","","","","","","","","","","","","3","P c a n","-P 2n 2c","60","","","","- Al6 Ca4 O13 -","- Al6 Ca4 O13 -","- Al48 Ca32 O104 -","8","1","","Kahlenberg, V.; Fischer, R. X.; Shaw, C. S. J.","High-pressure Ca4Al6O13: An example of a calcium aluminate with three different types of coordination polyhedra for aluminum","American Mineralogist","2000","85","","1492","1496","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002487","8.4418","","8.4418","","8.4418","","90","","90","","90","","601.596","","","","300","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Franklinite","- Fe2.024 O4 Zn0.976 -","- Fe2.024 O4 Zn0.976 -","- Fe16.192 O32 Zn7.808 -","8","0.0416667","","Pavese, A.; Levy, D.; Hoser, A.","Cation distribution in synthetic zinc ferrite (Zn0.97Fe2.02O4) from in situ high temperature neutron powder diffraction Sample at T = 300 K","American Mineralogist","2000","85","","1497","1502","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002488","8.456","","8.456","","8.456","","90","","90","","90","","604.637","","","","500","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Franklinite","- Fe2.026 O4 Zn0.974 -","- Fe2.0262 O4 Zn0.9738 -","- Fe16.2096 O32 Zn7.7904 -","8","0.0416667","","Pavese, A.; Levy, D.; Hoser, A.","Cation distribution in synthetic zinc ferrite (Zn0.97Fe2.02O4) from in situ high temperature neutron powder diffraction Sample at T = 500 K","American Mineralogist","2000","85","","1497","1502","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002489","8.4713","","8.4713","","8.4713","","90","","90","","90","","607.925","","","","700","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Franklinite","- Fe2.022 O4 Zn0.978 -","- Fe2.0221 O4 Zn0.9779 -","- Fe16.1768 O32 Zn7.8232 -","8","0.0416667","","Pavese, A.; Levy, D.; Hoser, A.","Cation distribution in synthetic zinc ferrite (Zn0.97Fe2.02O4) from in situ high temperature neutron powder diffraction Sample at T = 700 K","American Mineralogist","2000","85","","1497","1502","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002490","8.4785","","8.4785","","8.4785","","90","","90","","90","","609.477","","","","800","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Franklinite","- Fe2.02 O4 Zn0.98 -","- Fe2.0201 O4 Zn0.9799 -","- Fe16.1608 O32 Zn7.8392 -","8","0.0416667","","Pavese, A.; Levy, D.; Hoser, A.","Cation distribution in synthetic zinc ferrite (Zn0.97Fe2.02O4) from in situ high temperature neutron powder diffraction Sample at T = 800 K","American Mineralogist","2000","85","","1497","1502","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002491","8.4827","","8.4827","","8.4827","","90","","90","","90","","610.383","","","","850","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Franklinite","- Fe2.02 O4 Zn0.98 -","- Fe2.02 O4 Zn0.98 -","- Fe16.16 O32 Zn7.84 -","8","0.0416667","","Pavese, A.; Levy, D.; Hoser, A.","Cation distribution in synthetic zinc ferrite (Zn0.97Fe2.02O4) from in situ high temperature neutron powder diffraction Sample at T = 850 K","American Mineralogist","2000","85","","1497","1502","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002492","8.487","","8.487","","8.487","","90","","90","","90","","611.312","","","","900","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Franklinite","- Fe2.02 O4 Zn0.98 -","- Fe2.0201 O4 Zn0.9799 -","- Fe16.1608 O32 Zn7.8392 -","8","0.0416667","","Pavese, A.; Levy, D.; Hoser, A.","Cation distribution in synthetic zinc ferrite (Zn0.97Fe2.02O4) from in situ high temperature neutron powder diffraction Sample at T = 900 K","American Mineralogist","2000","85","","1497","1502","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002493","8.4914","","8.4914","","8.4914","","90","","90","","90","","612.263","","","","950","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Franklinite","- Fe2.02 O4 Zn0.98 -","- Fe2.02 O4 Zn0.98 -","- Fe16.16 O32 Zn7.84 -","8","0.0416667","","Pavese, A.; Levy, D.; Hoser, A.","Cation distribution in synthetic zinc ferrite (Zn0.97Fe2.02O4) from in situ high temperature neutron powder diffraction Sample at T = 950 K","American Mineralogist","2000","85","","1497","1502","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002494","8.4956","","8.4956","","8.4956","","90","","90","","90","","613.172","","","","1000","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Franklinite","- Fe2.02 O4 Zn0.98 -","- Fe2.02 O4 Zn0.98 -","- Fe16.16 O32 Zn7.84 -","8","0.0416667","","Pavese, A.; Levy, D.; Hoser, A.","Cation distribution in synthetic zinc ferrite (Zn0.97Fe2.02O4) from in situ high temperature neutron powder diffraction Sample at T = 1000 K","American Mineralogist","2000","85","","1497","1502","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002495","8.5038","","8.5038","","8.5038","","90","","90","","90","","614.949","","","","1100","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Franklinite","- Fe2.02 O4 Zn0.978 -","- Fe2.0201 O4 Zn0.9779 -","- Fe16.1608 O32 Zn7.8232 -","8","0.0416667","","Pavese, A.; Levy, D.; Hoser, A.","Cation distribution in synthetic zinc ferrite (Zn0.97Fe2.02O4) from in situ high temperature neutron powder diffraction Sample at T = 1100 K","American Mineralogist","2000","85","","1497","1502","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002496","8.513","","8.513","","8.513","","90","","90","","90","","616.947","","","","1200","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Franklinite","- Fe2.023 O4 Zn0.977 -","- Fe2.0231 O4 Zn0.9769 -","- Fe16.1848 O32 Zn7.8152 -","8","0.0416667","","Pavese, A.; Levy, D.; Hoser, A.","Cation distribution in synthetic zinc ferrite (Zn0.97Fe2.02O4) from in situ high temperature neutron powder diffraction Sample at T = 1200 K","American Mineralogist","2000","85","","1497","1502","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002497","8.522","","8.522","","8.522","","90","","90","","90","","618.906","","","","1300","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Franklinite","- Fe2.02 O4 Zn0.98 -","- Fe2.02 O4 Zn0.9798 -","- Fe16.16 O32 Zn7.8384 -","8","0.0416667","","Pavese, A.; Levy, D.; Hoser, A.","Cation distribution in synthetic zinc ferrite (Zn0.97Fe2.02O4) from in situ high temperature neutron powder diffraction Sample at T = 1300 K","American Mineralogist","2000","85","","1497","1502","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002498","8.5318","","8.5318","","8.5318","","90","","90","","90","","621.043","","","","1400","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Franklinite","- Fe2.021 O4 Zn0.979 -","- Fe2.0207 O4 Zn0.9793 -","- Fe16.1656 O32 Zn7.8344 -","8","0.0416667","","Pavese, A.; Levy, D.; Hoser, A.","Cation distribution in synthetic zinc ferrite (Zn0.97Fe2.02O4) from in situ high temperature neutron powder diffraction Sample at T = 1400 K","American Mineralogist","2000","85","","1497","1502","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002499","8.545","","8.545","","8.545","","90","","90","","90","","623.93","","","","1500","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Franklinite","- Fe2.025 O4 Zn0.975 -","- Fe2.0249 O4 Zn0.9751 -","- Fe16.1992 O32 Zn7.8008 -","8","0.0416667","","Pavese, A.; Levy, D.; Hoser, A.","Cation distribution in synthetic zinc ferrite (Zn0.97Fe2.02O4) from in situ high temperature neutron powder diffraction Sample at T = 1500 K","American Mineralogist","2000","85","","1497","1502","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002500","7.1248","","7.1248","","4.8177","","90","","90","","90","","244.56","","","","","","","","","","","","","4","P -4 21 m","P -4 2ab","113","","","Okayamalite","- B2 Ca2 O7 Si -","- B2 Ca2 O7 Si -","- B4 Ca4 O14 Si2 -","2","0.25","","Giuli, G.; Bindi, L.; Bonazzi, P.","Rietveld refinement of okayamalite, Ca2SiB2O7: Structural evidence for the B/Si ordered distribution","American Mineralogist","2000","85","","1512","1515","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:41:58",""
"9002501","9.144","","8.818","","7.537","","90","","113.22","","90","","558.495","","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","Tumchaite","- H4 Na2 O13 Si4 Sn0.2 Zr0.8 -","- H4 Na2 O13 Si4 Sn0.2 Zr0.8 -","- H8 Na4 O26 Si8 Sn0.4 Zr1.6 -","2","0.5","","Subbotin, V. V.; Merlino, S.; Pushcharovsky, D. Y.; Pakhomovsky, Y. A.; Ferro, O.; Bogdanova, A. N.; Voloshin, A. V.; Sorokhtina, N. V.; Zubkova, N. V.","Tumchaite Na2(Zr,Sn)Si4O11.2H2O - a new mineral from carbonatites of the Vuoriyarvi alkali-ultrabasic massif, Murmansk Region, Russia","American Mineralogist","2000","85","","1516","1520","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:36",""
"9002502","29.124","","29.124","","17.2602","","90","","90","","120","","12678.8","","","","","","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","","Thornasite","- H36 Na12 O94 Si32 Th3 -","- H36 Na12 O94 Si32 Th3 -","- H216 Na72 O564 Si192 Th18 -","6","0.166667","","Li, Y.; Krivovichev, S. V.; Burns, P. C.","The crystal structure of thornasite: A novel interrupted silicate framework","American Mineralogist","2000","85","","1521","1525","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:36",""
"9002503","19.727","","8.796","","13.631","","82.21","","78.08","","100.04","","2242.38","","","","","","","","","","","","","4","B -1","-P 1 (-1/2*x+1/2*z,-y,1/2*x+1/2*z)","2","","","Symesite","- Cl4 O12 Pb10 S -","- Cl4 O12 Pb10 S -","- Cl16 O48 Pb40 S4 -","4","","","Welch, M. D.; Cooper, M. A.; Hawthorne, F. C.; Criddle, A. J.","Symesite, Pb10(SO4)O7Cl4(H2O), a new PbO-related sheet mineral: Description and crystal structure","American Mineralogist","2000","85","","1526","1533","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002504","10.873","","10.5516","","7.4287","","90","","109.74","","90","","802.192","","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","Cuspidine","- Ca2.01 F2 Na1.99 O7 P2 -","- Ca2.01 F2 Na1.99 O7 P2 -","- Ca8.04 F8 Na7.96 O28 P8 -","4","1","","Piotrowski, A.; Kahlenberg, V.; Fischer, R. X.","Na2Ca2(P2O7)F2, the first diphosphate of the cuspidine family Sample: single position O1","American Mineralogist","2000","85","","1534","1539","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002506","8.7616","","8.7616","","2.785","","90","","90","","120","","185.15","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Al3 Ca0.5 Mg O6 -","- Al3 Ca0.5 Mg O6 -","- Al6 Ca Mg2 O12 -","2","0.166667","","Miura, H.; Hamada, Y.; Suzuki, T.; Akaogi, M.; Miyajima, N.; Fujino, K.","Crystal structure of MaMg2Al6O12, a new Al-rich high pressure form","American Mineralogist","2000","85","","1799","1803","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002507","6.5269","","6.5269","","18.1835","","90","","90","","90","","774.625","","","","","","","","","","","","","5","I -4 2 d","I -4 2bw","122","TAPP","","Jeffbenite","- Al1.942 Fe0.49 Mg2.658 O12 Si2.91 -","- Al1.942 Fe0.49 Mg2.658 O12 Si2.91 -","- Al7.768 Fe1.96 Mg10.632 O48 Si11.64 -","4","0.25","","Finger, L. W.; Conrad, P. G.","The crystal structure of ""Tetragonal Almandine-Pyrope Phase"" (TAPP): A reexamination","American Mineralogist","2000","85","","1804","1807","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002508","13.197","","13.197","","6.63","","90","","90","","90","","1154.69","","","","","","","","","","","","","6","I -4 2 d","I -4 2bw","122","","","Gonnardite","- Al2.15 Ca0.3 H8 Na1.7 O12.72 Si2.85 -","- Al2.15 Ca0.3 H5.44 Na1.7 O12.72 Si2.85 -","- Al8.6 Ca1.2 H21.76 Na6.8 O50.88 Si11.4 -","4","0.25","","Evans, H. T.; Konnert, J. A.; Ross, M.","The crystal structure of tetranatrolite from Mont Saint-Hilaire, Quebec, and its chemical and structural relationship to paranatrolite and gonnardite","American Mineralogist","2000","85","","1808","1815","","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:08",""
"9002509","14.233","","11.532","","14.611","","90","","100.45","","90","","2358.4","","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","Elyite","- Cu H5 O11 Pb4 S -","- Cu H5 O11 Pb4 S -","- Cu8 H40 O88 Pb32 S8 -","8","2","","Kolitsch, U.; Giester, G.","Elyite, Pb4Cu(SO4)O2(OH)4.H2O: Crystal structure and new data","American Mineralogist","2000","85","","1816","1821","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002510","15.067","","15.067","","15.293","","90","","90","","120","","3006.61","","","","","","","","","","","","","4","P 3 1 c","P 3 -2c","159","","","Dukeite","- Bi12 Cr4 H6 O33 -","- Bi12 Cr4 H6 O33 -","- Bi48 Cr16 H24 O132 -","4","0.666667","","Burns, P. C.; Roberts, A. C.; Stirling, J. A. R.; Criddle, A. J.; Feinglos, M. N.","Dukeite, Bi24Cr8O57(OH)6(H2O)3, a new mineral from Brejauba, Minas Gerais, Brazil: Description and crystal structure","American Mineralogist","2000","85","","1822","1827","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:36",""
"9002824","16.017","","16.017","","7.256","","90","","90","","120","","1612.09","","","","","","","","","","","","","12","R 3 m :H","R 3 -2""","160","","","Schorl","- Al4.56 B3 Ca0.48 F0.18 Fe2.04 H6.18 K0.01 Mg2.19 Na0.49 O30.82 Si6 Ti0.21 -","- Al4.56 B3 Ca0.48 F0.18 Fe2.04 H6.18 K0.01 Mg2.19 Na0.49 O30.82 Si6 Ti0.21 -","- Al13.68 B9 Ca1.44 F0.54 Fe6.12 H18.54 K0.03 Mg6.57 Na1.47 O92.46 Si18 Ti0.63 -","3","0.166667","","Camara, F.; Ottolini, L.; Hawthorne, F. C.","Crystal chemistry of three tourmalines by SREF, EMPA and SIMS Sample: Crystal 1 from Madagascar Note: intermediate between feruvite and schorl","American Mineralogist","2000","87","","1437","1442","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:36",""
"9002825","15.983","","15.983","","7.152","","90","","90","","120","","1582.25","","","","","","","","","","","","Alto Lighona pegmatite field, Zambezia, Mozambique","15","R 3 m :H","R 3 -2""","160","","","Schorl","- Al6.75 B3 Ca0.03 F0.15 Fe2.01 H6.85 K0.01 Li0.33 Mg0.06 Mn0.18 Na0.64 O30.85 Si5.76 Ti0.06 Zn0.03 -","- Al6.75 B3 Ca0.03 F0.15 Fe2.01 H6.85 K0.01 Li0.33 Mg0.06 Mn0.18 Na0.64 O30.85 Si5.76 Ti0.06 Zn0.03 -","- Al20.25 B9 Ca0.09 F0.45 Fe6.03 H20.55 K0.03 Li0.99 Mg0.18 Mn0.54 Na1.92 O92.55 Si17.28 Ti0.18 Zn0.09 -","3","0.166667","","Camara, F.; Ottolini, L.; Hawthorne, F. C.","Crystal chemistry of three tourmalines by SREF, EMPA and SIMS Sample: Crystal 2 from Alto Lighona pegmatite field, Zambezia, Mozambique","American Mineralogist","2000","87","","1437","1442","","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:10",""
"9002826","15.921","","15.921","","7.137","","90","","90","","120","","1566.7","","","","","","","","","","","","a pegmatite at Minas Gerais, Brazil","13","R 3 m :H","R 3 -2""","160","","","Fluor-elbaite","- Al6.78 B3 Ca0.01 F0.55 Fe0.9 H3.42 K0.01 Li0.66 Mg0.6 Na0.81 O30.45 Si5.76 Ti0.06 -","- Al6.78 B3 Ca0.01 F0.55 Fe0.9 H3.42 K0.01 Li0.66 Mg0.6 Na0.81 O30.45 Si5.76 Ti0.06 -","- Al20.34 B9 Ca0.03 F1.65 Fe2.7 H10.26 K0.03 Li1.98 Mg1.8 Na2.43 O91.35 Si17.28 Ti0.18 -","3","0.166667","","Camara, F.; Ottolini, L.; Hawthorne, F. C.","Crystal chemistry of three tourmalines by SREF, EMPA and SIMS Sample: Crystal 3 from a pegmatite at Minas Gerais, Brazil","American Mineralogist","2000","87","","1437","1442","","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:10",""
"9004547","5.5108","","5.5084","","7.7964","","90","","90","","90","","236.665","","","","","","","","","","","","Khibina complex, Russia","11","P b n m","-P 2c 2ab","62","","","Loparite-(Ce)","- Ca0.09 Ce0.17 La0.09 Na0.54 Nb0.23 Nd0.03 O3 Pr0.01 Sr0.04 Ta0.01 Ti0.76 -","- Ca0.09 Ce0.17 La0.09 Na0.54 Nb0.23 Nd0.03 O3 Pr0.01 Sr0.04 Ta0.01 Ti0.76 -","- Ca0.36 Ce0.68 La0.36 Na2.16 Nb0.92 Nd0.12 O12 Pr0.04 Sr0.16 Ta0.04 Ti3.04 -","4","0.5","","Mitchell, R. H.; Burns, P. C.; Chakhmouradian, A. R.","The crystal structures of loparite-(Ce) Sample: Loparite K","The Canadian Mineralogist","2000","38","","145","152","10.2113/gscanmin.38.1.145","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004548","5.5022","","5.5084","","7.7767","","90","","90","","90","","235.699","","","","","","","","","","","","Lovozero complex, Russia","10","I 4/m c m","-I 4 2c","140","","","Loparite-(Ce)","- Ca0.13 Ce0.18 La0.09 Na0.46 Nb0.13 Nd0.05 O3 Pr0.02 Sr0.05 Ti0.87 -","- Ca0.13 Ce0.18 La0.09 Na0.46 Nb0.13 Nd0.05 O3 Pr0.02 Sr0.05 Ti0.87 -","- Ca0.52 Ce0.72 La0.36 Na1.84 Nb0.52 Nd0.2 O12 Pr0.08 Sr0.2 Ti3.48 -","4","0.125","","Mitchell, R. H.; Burns, P. C.; Chakhmouradian, A. R.","The crystal structures of loparite-(Ce) Sample: Loparite L","The Canadian Mineralogist","2000","38","","145","152","10.2113/gscanmin.38.1.145","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004549","5.5076","","5.5076","","7.7767","","90","","90","","90","","235.896","","","","","","","","","","","","Bearpaw Mountains, Montana, USA","10","I 4/m c m","-I 4 2c","140","","","Loparite-(Ce)","- Ca0.07 Ce0.15 La0.1 Na0.31 Nb0.05 Nd0.03 O3 Sr0.3 Th0.01 Ti0.94 -","- Ca0.07 Ce0.15 La0.1 Na0.31 Nb0.05 Nd0.03 O3 Sr0.3 Th0.01 Ti0.94 -","- Ca0.28 Ce0.6 La0.4 Na1.24 Nb0.2 Nd0.12 O12 Sr1.2 Th0.04 Ti3.76 -","4","0.125","","Mitchell, R. H.; Burns, P. C.; Chakhmouradian, A. R.","The crystal structures of loparite-(Ce) Sample: Loparite BM","The Canadian Mineralogist","2000","38","","145","152","10.2113/gscanmin.38.1.145","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004550","21.234","","12.958","","44.911","","90","","90","","90","","12357.3","","","","","","","","","","","","","13","C 1 2 1","C 2y","5","","","Bijvoetite-(Y)","- C16 H8 Ce0.152 Dy0.782 Er0.226 Eu0.188 Gd0.678 Nd0.767 O135 Sm0.678 Tb0.112 U16 Y4.22 -","- C16 H86 Ce0.152 Dy0.782 Er0.226 Eu0.188 Gd0.678 Nd0.767 O135 Sm0.678 Tb0.112 U16 Y4.22 -","- C64 H344 Ce0.608 Dy3.128 Er0.904 Eu0.752 Gd2.712 Nd3.068 O540 Sm2.712 Tb0.448 U64 Y16.88 -","4","1","","Li, Y.; Burns, P. C.; Gault, R. A.","A new rare-earth-element uranyl carbonate sheet in the structure of bijvoetite-(Y)","The Canadian Mineralogist","2000","38","","153","162","10.2113/gscanmin.38.1.153","","","","","","","","","","","","","","","","","","","","","has coordinates","283907","2023-05-21","07:14:43",""
"9004551","13.179","","20.895","","13.431","","90","","106.316","","90","","3549.61","","","","","","","","","","","","","4","P 1 n 1","P -2yac","7","","","","- H11 K5 O38 U10 -","- H11 K5 O38 U10 -","- H44 K20 O152 U40 -","4","2","","Burns, P. C.; Hill, F. C.","A new uranyl sheet in K5[(UO2)10O8(OH)9](H2O): New insight into sheet anion-topologies","The Canadian Mineralogist","2000","38","","163","173","10.2113/gscanmin.38.1.163","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:37",""
"9004552","12.3143","","12.9609","","8.4053","","90","","90","","90","","1341.52","","","","","","","","","","","","","4","P n a m","-P 2c 2n","62","","","Curite","- H5 O16 Sr2 U4 -","- H5 O16 Sr2 U4 -","- H20 O64 Sr8 U16 -","4","0.5","","Burns, P. C.; Hill, F. C.","Implications of the synthesis and structure of the Sr analogue of curite","The Canadian Mineralogist","2000","38","","175","181","10.2113/gscanmin.38.1.175","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:37",""
"9004553","9.735","","8.898","","5.242","","90","","105.72","","90","","437.089","","","","10","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","Diopside","- Ca Mg O6 Si2 -","- Ca Mg O6 Si2 -","- Ca4 Mg4 O24 Si8 -","4","0.5","","Prencipe, M.; Tribaudino, M.; Pavese, A.; Hoser, A.; Reehuis, M.","A single-crystal neutron-diffraction investigation of diopside at 10 K","The Canadian Mineralogist","2000","38","","183","189","10.2113/gscanmin.38.1.183","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004554","4.0074","","44.81","","11.513","","90","","90","","90","","2067.41","","","","","","","","","","","","","4","P m c 21","P 2c -2","26","","","","- Bi13 Cu2.87 Pb3 S24 -","- Bi13 Cu2.87 Pb3 S24 -","- Bi26 Cu5.74 Pb6 S48 -","2","0.5","","Topa, D.; Balic-Zunic T; Makovicky, E.","The crystal structure of Cu1.6Pb1.6Bi6.4S12, a new 44.8 Angstrom derivative of the bismuthinite-aikinite solid-solution series","The Canadian Mineralogist","2000","38","","611","616","10.2113/gscanmin.38.3.611","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004555","10.219","","10.219","","2.963","","90","","90","","90","","309.42","","","","","","","","","","","","Kovdor Complex, Russia","8","I 4/m","-I 4","87","","","Henrymeyerite","- Ba0.86 Ce0.02 Fe0.52 K0.01 La0.02 Na0.09 O8 Ti3.44 -","- Ba0.86 Ce0.02 Fe0.52 K0.01 La0.02 Na0.09 O8 Ti3.44 -","- Ba1.72 Ce0.04 Fe1.04 K0.02 La0.04 Na0.18 O16 Ti6.88 -","2","0.125","","Mitchell, R. H.; Yakovenchuk, V. N.; Chakhmouradian, A. R.; Burns, P. C.; Pakhomovsky, Y. A.","Henrymeyerite, a new hollandite-type Ba-Fe titanate from the Kovdor Complex, Russia","The Canadian Mineralogist","2000","38","","617","626","10.2113/gscanmin.38.3.617","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004556","5.4303","","11.924","","11.747","","112.927","","94.75","","103.175","","669.497","","","","","","","","","","","","","10","P -1","-P 1","2","","","Niobokupletskite","- H4 K1.78 Mn5.65 Na0.63 Nb1.8 O30.5 Rb0.13 Si8 Ti0.2 Zn0.67 -","- H4 K1.78 Mn5.65 Na0.63 Nb1.8 O30.5 Rb0.13 Si8 Ti0.2 Zn0.67 -","- H4 K1.78 Mn5.65 Na0.63 Nb1.8 O30.5 Rb0.13 Si8 Ti0.2 Zn0.67 -","1","0.5","","Piilonen, P. C.; Lalonde, A. E.; McDonald, A. M.; Gault, R. A.","Niobokupletskite, a new astrophyllite-group mineral from Mont Saint-Hilaire, Quebec, Canada: Description and crystal structure Locality: Mont Saint-Hilaire, Quebec, Canada","The Canadian Mineralogist","2000","38","","627","639","10.2113/gscanmin.38.3.627","","","","","","","","","","","","","","","","","","","","","has coordinates","287550","2023-11-11","17:51:30",""
"9004557","10.798","","9.835","","7.09","","90","","108.08","","90","","715.769","","","","","","","","","","","","Amdrup Fjord","8","P 1 21/a 1","-P 2yab","14","","","Normandite","- Ca0.83 F Mn Na1.17 O8 Si2 Ti0.612 Zr0.388 -","- Ca0.83 F Mn Na1.17 O8 Si2 Ti0.612 Zr0.388 -","- Ca3.32 F4 Mn4 Na4.68 O32 Si8 Ti2.448 Zr1.552 -","4","1","","Perchiazzi, N.; McDonald, A. M.; Gault, R. A.; Johnsen, O.; Merlino, S.","The crystal structure of normandite and its crystal-chemical relationships with lavenite","The Canadian Mineralogist","2000","38","","641","648","10.2113/gscanmin.38.3.641","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004558","10.799","","9.801","","7.054","","90","","108.075","","90","","709.758","","","","","","","","","","","","Mont Saint-Hilaire, Quebec, Canada","8","P 1 21/a 1","-P 2yab","14","","","Normandite","- Ca0.936 F Mn0.784 Na1.28 Nb0.124 O8 Si2 Ti0.876 -","- Ca0.936 F Mn0.784 Na1.28 Nb0.124 O8 Si2 Ti0.876 -","- Ca3.744 F4 Mn3.136 Na5.12 Nb0.496 O32 Si8 Ti3.504 -","4","1","","Perchiazzi, N.; McDonald, A. M.; Gault, R. A.; Johnsen, O.; Merlino, S.","The crystal structure of normandite and its crystal-chemical relationships with lavenite","The Canadian Mineralogist","2000","38","","641","648","10.2113/gscanmin.38.3.641","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004559","5.386","","6.999","","14.748","","89.98","","93.62","","95.5","","552.277","","","","","","","","","","","","","9","P -1","-P 1","2","","","Yoshimuraite","- Ba2 Fe0.22 H Mn2 O13 P0.46 S0.34 Si2.17 Ti0.78 -","- Ba2 Fe0.22 H Mn2 O13 P0.46 S0.34 Si2.17 Ti0.78 -","- Ba4 Fe0.44 H2 Mn4 O26 P0.92 S0.68 Si4.34 Ti1.56 -","2","1","","McDonald A M; Grice J D; Chao G Y","The crystal structure of yoshimuraite, a layered Ba-Mn-Ti silicophosphate, with comments on five-coordinated Ti","The Canadian Mineralogist","2000","38","","649","656","10.2113/gscanmin.38.3.649","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:37",""
"9004560","12.916","","12.916","","26.543","","90","","90","","120","","3834.75","","","","","","","","","","","","","7","P 3 2 1","P 3 2""","150","","","Franzinite","- Al30 H12 K15.32 Na15.4 O196 S10 Si30 -","- Al30 H12 K15.32 Na15.4 O196 S9.99994 Si30 -","- Al30 H12 K15.32 Na15.4 O196 S9.99994 Si30 -","1","0.166667","","Ballirano, P.; Bonaccorsi, E.; Maras, A.; Merlino, S.","The crystal structure of franzinite, the ten-layer mineral of the cancrinite group","The Canadian Mineralogist","2000","38","","657","668","10.2113/gscanmin.38.3.657","","","","","","","","","","","","","","","","","","","","","has coordinates","283911","2023-05-21","08:37:45",""
"9004561","9.9309","","18.0949","","5.3681","","90","","105.19","","90","","930.938","","","","","","","","","","","","contact zone of the Ilmen alkaline massif, Ilmen Mountains, southern Urals, Russia","10","C 1 2/m 1","-C 2y","12","","","Potassic-ferrisadanagaite","- Al2.14 Ca1.73 Fe3.22 K0.66 Mg0.6 Mn0.25 Na0.55 O24 Si6.64 Ti0.19 -","- Al2.14 Ca1.73 Fe3.22 K0.66 Mg0.6 Mn0.25 Na0.55 O24 Si6.64 Ti0.19 -","- Al4.28 Ca3.46 Fe6.44 K1.32 Mg1.2 Mn0.5 Na1.1 O48 Si13.28 Ti0.38 -","2","0.25","","Sokolova, E. V.; Hawthorne, F. C.; Kabalov, Y. K.; Schneider, J.; McCammon, C. A.","The crystal chemistry of potassic-ferrisadanagaite Locality: contact zone of the Ilmen alkaline massif, Ilmen Mountains, southern Urals, Russia","The Canadian Mineralogist","2000","38","","669","674","10.2113/gscanmin.38.3.669","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:07",""
"9004562","6.171","","6.171","","5.587","","90","","90","","90","","212.76","","","","","","","","","","","","","5","P 4/n :1","P 4ab -1ab","85","","","Bandylite","- B Cl Cu H4 O4 -","- B Cl Cu H4 O4 -","- B2 Cl2 Cu2 H8 O8 -","2","0.25","","Li, Y.; Burns, P. C.","Refinement of the structure of bandylite","The Canadian Mineralogist","2000","38","","713","715","10.2113/gscanmin.38.3.713","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004563","6.3748","","7.5287","","14.628","","82.64","","85.95","","89.91","","694.513","","","","","","","","","","","","","4","P -1","-P 1","2","","","Umohoite","- H4 Mo O8 U -","- H4 Mo O8 U -","- H16 Mo4 O32 U4 -","4","2","","Krivovichev, S. V.; Burns, P. C.","Crystal chemistry of uranyl molybdates. 1. The structure and formula of umohoite","The Canadian Mineralogist","2000","38","","717","726","10.2113/gscanmin.38.3.717","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:37",""
"9004564","12.558","","13.024","","8.398","","90","","90","","90","","1373.54","","","","","","","","","","","","Shinkolobwe, Democratic Republic of Congo","4","P n a m","-P 2c 2n","62","","","Curite","- H5 O16 Pb0.786 U4 -","- H5 O16 Pb0.786 U4 -","- H20 O64 Pb3.144 U16 -","4","0.5","","Li, Y.; Burns, P. C.","Investigations of crystal-chemical variability in lead uranyl oxide hydrates. I. Curite Note: sample JVS4338 Locality: Shinkolobwe, Democratic Republic of Congo","The Canadian Mineralogist","2000","38","","727","735","10.2113/gscanmin.38.3.727","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:07",""
"9004565","12.554","","13.019","","8.391","","90","","90","","90","","1371.43","","","","","","","","","","","","Swaambo,Democratic Republic of Congo","4","P n a m","-P 2c 2n","62","","","Curite","- H5 O16 Pb0.779 U4 -","- H5 O16 Pb0.779 U4 -","- H20 O64 Pb3.116 U16 -","4","0.5","","Li, Y.; Burns, P. C.","Investigations of crystal-chemical variability in lead uranyl oxide hydrates. I. Curite Note: sample JVS4331 Locality: Swaambo,Democratic Republic of Congo","The Canadian Mineralogist","2000","38","","727","735","10.2113/gscanmin.38.3.727","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:07",""
"9004566","12.54","","13.017","","8.395","","90","","90","","90","","1370.34","","","","","","","","","","","","Shinkolobwe, Democratic Republic of Congo","4","P n a m","-P 2c 2n","62","","","Curite","- H5 O16 Pb0.768 U4 -","- H5 O16 Pb0.768 U4 -","- H20 O64 Pb3.072 U16 -","4","0.5","","Li, Y.; Burns, P. C.","Investigations of crystal-chemical variability in lead uranyl oxide hydrates. I. Curite Note: sample JVS901 Locality: Shinkolobwe, Democratic Republic of Congo","The Canadian Mineralogist","2000","38","","727","735","10.2113/gscanmin.38.3.727","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:07",""
"9004567","12.562","","13.018","","8.392","","90","","90","","90","","1372.36","","","","","","","","","","","","Swaambo, Democratic Republic of Congo","4","P n a m","-P 2c 2n","62","","","Curite","- H5 O16 Pb0.78 U4 -","- H5 O16 Pb0.78 U4 -","- H20 O64 Pb3.12 U16 -","4","0.5","","Li, Y.; Burns, P. C.","Investigations of crystal-chemical variability in lead uranyl oxide hydrates. I. Curite Note: sample JVS4331(b) Locality: Swaambo, Democratic Republic of Congo","The Canadian Mineralogist","2000","38","","727","735","10.2113/gscanmin.38.3.727","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:07",""
"9004568","12.548","","13.012","","8.391","","90","","90","","90","","1370.04","","","","","","","","","","","","Swaambo, Democratic Republic of Congo","4","P n a m","-P 2c 2n","62","","","Curite","- H5 O16 Pb0.766 U4 -","- H5 O16 Pb0.766 U4 -","- H20 O64 Pb3.064 U16 -","4","0.5","","Li, Y.; Burns, P. C.","Investigations of crystal-chemical variability in lead uranyl oxide hydrates. I. Curite Note: sample JVS4332 Locality: Swaambo, Democratic Republic of Congo","The Canadian Mineralogist","2000","38","","727","735","10.2113/gscanmin.38.3.727","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:07",""
"9004569","12.579","","13.022","","8.392","","90","","90","","90","","1374.64","","","","","","","","","","","","Shinkolobwe, Democratic Republic of Congo","4","P n a m","-P 2c 2n","62","","","Curite","- H O8 Pb0.396 U2 -","- H O8 Pb0.3955 U2 -","- H8 O64 Pb3.164 U16 -","8","1","","Li, Y.; Burns, P. C.","Investigations of crystal-chemical variability in lead uranyl oxide hydrates. I. Curite Note: sample CMNMC 81091 Locality: Shinkolobwe, Democratic Republic of Congo","The Canadian Mineralogist","2000","38","","727","735","10.2113/gscanmin.38.3.727","","","","","","","","","","","","","","","","","","","","","has coordinates","285044","2023-07-06","18:10:13",""
"9004570","12.575","","13.013","","8.39","","90","","90","","90","","1372.93","","","","","","","","","","","","Shinkolobwe, Democratic Republic of Congo","4","P n a m","-P 2c 2n","62","","","Curite","- H5 O16 Pb0.781 U4 -","- H5 O16 Pb0.781 U4 -","- H20 O64 Pb3.124 U16 -","4","0.5","","Li, Y.; Burns, P. C.","Investigations of crystal-chemical variability in lead uranyl oxide hydrates. I. Curite Note: sample CMNMC 81092 Locality: Shinkolobwe, Democratic Republic of Congo","The Canadian Mineralogist","2000","38","","727","735","10.2113/gscanmin.38.3.727","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:07",""
"9004571","12.536","","13.017","","8.394","","90","","90","","90","","1369.74","","","","","","","","","","","","Shinkolobwe, Democratic Republic of Congo","4","P n a m","-P 2c 2n","62","","","Curite","- H5 O16 Pb0.784 U4 -","- H5 O16 Pb0.784 U4 -","- H20 O64 Pb3.136 U16 -","4","0.5","","Li, Y.; Burns, P. C.","Investigations of crystal-chemical variability in lead uranyl oxide hydrates. I. Curite Note: sample CMNMC 81093 Locality: Shinkolobwe, Democratic Republic of Congo","The Canadian Mineralogist","2000","38","","727","735","10.2113/gscanmin.38.3.727","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:07",""
"9004572","12.545","","13.015","","8.392","","90","","90","","90","","1370.19","","","","","","","","","","","","Shinkolobwe, Democratic Republic of Congo","4","P n a m","-P 2c 2n","62","","","Curite","- H5 O16 Pb0.778 U4 -","- H5 O16 Pb0.778 U4 -","- H20 O64 Pb3.112 U16 -","4","0.5","","Li, Y.; Burns, P. C.","Investigations of crystal-chemical variability in lead uranyl oxide hydrates. I. Curite Note: sample CMNMC 30059 Locality: Shinkolobwe, Democratic Republic of Congo","The Canadian Mineralogist","2000","38","","727","735","10.2113/gscanmin.38.3.727","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:07",""
"9004573","12.569","","13.026","","8.393","","90","","90","","90","","1374.13","","","","","","","","","","","","Shinkolobwe, Democratic Republic of Congo","4","P n a m","-P 2c 2n","62","","","Curite","- H5 O16 Pb0.751 U4 -","- H5 O16 Pb0.751 U4 -","- H20 O64 Pb3.004 U16 -","4","0.5","","Li, Y.; Burns, P. C.","Investigations of crystal-chemical variability in lead uranyl oxide hydrates. I. Curite Note: sample FC8 Locality: Shinkolobwe, Democratic Republic of Congo","The Canadian Mineralogist","2000","38","","727","735","10.2113/gscanmin.38.3.727","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:07",""
"9004574","12.584","","13.033","","8.402","","90","","90","","90","","1377.99","","","","","","","","","","","","Shinkolobwe, Democratic Republic of Congo","4","P n a m","-P 2c 2n","62","","","Curite","- H5 O16 Pb0.723 U4 -","- H5 O16 Pb0.723 U4 -","- H20 O64 Pb2.892 U16 -","4","0.5","","Li, Y.; Burns, P. C.","Investigations of crystal-chemical variability in lead uranyl oxide hydrates. I. Curite Note: sample M13067 Locality: Shinkolobwe, Democratic Republic of Congo","The Canadian Mineralogist","2000","38","","727","735","10.2113/gscanmin.38.3.727","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:07",""
"9004575","12.548","","13.026","","8.389","","90","","90","","90","","1371.18","","","","","","","","","","","","Shinkolobwe, Democratic Republic of Congo","4","P n a m","-P 2c 2n","62","","","Curite","- H5 O16 Pb0.755 U4 -","- H5 O16 Pb0.755 U4 -","- H20 O64 Pb3.02 U16 -","4","0.5","","Li, Y.; Burns, P. C.","Investigations of crystal-chemical variability in lead uranyl oxide hydrates. I. Curite Note: sample FC5 Locality: Shinkolobwe, Democratic Republic of Congo","The Canadian Mineralogist","2000","38","","727","735","10.2113/gscanmin.38.3.727","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:07",""
"9004576","12.584","","13.025","","8.391","","90","","90","","90","","1375.34","","","","","","","","","","","","Shinkolobwe, Democratic Republic of Congo","4","P n a m","-P 2c 2n","62","","","Curite","- H5 O16 Pb0.786 U4 -","- H5 O16 Pb0.786 U4 -","- H20 O64 Pb3.144 U16 -","4","0.5","","Li, Y.; Burns, P. C.","Investigations of crystal-chemical variability in lead uranyl oxide hydrates. I. Curite Note: sample FC11 Locality: Shinkolobwe, Democratic Republic of Congo","The Canadian Mineralogist","2000","38","","727","735","10.2113/gscanmin.38.3.727","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:07",""
"9004577","12.537","","13.001","","8.384","","90","","90","","90","","1366.54","","","","","","","","","","","","Shinkolobwe, Democratic Republic of Congo","4","P n a m","-P 2c 2n","62","","","Curite","- H5 O16 Pb0.761 U4 -","- H5 O16 Pb0.761 U4 -","- H20 O64 Pb3.044 U16 -","4","0.5","","Li, Y.; Burns, P. C.","Investigations of crystal-chemical variability in lead uranyl oxide hydrates. I. Curite Note: sample M14266 Locality: Shinkolobwe, Democratic Republic of Congo","The Canadian Mineralogist","2000","38","","727","735","10.2113/gscanmin.38.3.727","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:07",""
"9004578","12.505","","12.992","","8.379","","90","","90","","90","","1361.29","","","","","","","","","","","","","4","P n a m","-P 2c 2n","62","","","Curite","- H5 O16 Pb0.832 U4 -","- H5 O16 Pb0.832 U4 -","- H20 O64 Pb3.328 U16 -","4","0.5","","Li, Y.; Burns, P. C.","Investigations of crystal-chemical variability in lead uranyl oxide hydrates. I. Curite Note: sample SYN, Synthetic","The Canadian Mineralogist","2000","38","","727","735","10.2113/gscanmin.38.3.727","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:07",""
"9004579","14.01","","16.401","","14.317","","90","","90","","90","","3289.73","","","","","","","","","","","","Shinkolobwe, Democratic Republic of Congo","4","B b 21 m","B -2 -2b","36","","","Fourmarierite","- H10 O19 Pb U4 -","- H10 O19 Pb U4 -","- H80 O152 Pb8 U32 -","8","1","","Li, Y.; Burns, P. C.","Investigations of crystal-chemical variability in lead uranyl oxide hydrates. II. Fourmarierite Note: sample CMCNC 81096","The Canadian Mineralogist","2000","38","","737","749","10.2113/gscanmin.38.3.737","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:07",""
"9004580","14.014","","16.419","","14.33","","90","","90","","90","","3297.27","","","","","","","","","","","","Shinkolobwe, Democratic Republic of Congo","4","B b 21 m","B -2 -2b","36","","","Fourmarierite","- H10 O19 Pb U4 -","- H10 O19 Pb U4 -","- H80 O152 Pb8 U32 -","8","1","","Li, Y.; Burns, P. C.","Investigations of crystal-chemical variability in lead uranyl oxide hydrates. II. Fourmarierite Note: sample CMCNC 81097","The Canadian Mineralogist","2000","38","","737","749","10.2113/gscanmin.38.3.737","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:07",""
"9004581","14.013","","16.42","","14.329","","90","","90","","90","","3297.01","","","","","","","","","","","","Shinkolobwe, Democratic Republic of Congo","4","B b 21 m","B -2 -2b","36","","","Fourmarierite","- H10 O19 Pb U4 -","- H10 O19 Pb U4 -","- H80 O152 Pb8 U32 -","8","1","","Li, Y.; Burns, P. C.","Investigations of crystal-chemical variability in lead uranyl oxide hydrates. II. Fourmarierite Note: sample CMNMC 81098","The Canadian Mineralogist","2000","38","","737","749","10.2113/gscanmin.38.3.737","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:07",""
"9004582","14.014","","16.412","","14.322","","90","","90","","90","","3294.03","","","","","","","","","","","","Shinkolobwe, Democratic Republic of Congo","4","B b 21 m","B -2 -2b","36","","","Fourmarierite","- H10 O19 Pb U4 -","- H10 O19 Pb U4 -","- H80 O152 Pb8 U32 -","8","1","","Li, Y.; Burns, P. C.","Investigations of crystal-chemical variability in lead uranyl oxide hydrates. II. Fourmarierite Note: sample CMNMC 81099","The Canadian Mineralogist","2000","38","","737","749","10.2113/gscanmin.38.3.737","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:07",""
"9004583","14.022","","16.45","","14.355","","90","","90","","90","","3311.15","","","","","","","","","","","","Shinkolobwe, Democratic Republic of Congo","4","B b 21 m","B -2 -2b","36","","","Fourmarierite","- H10 O19 Pb U4 -","- H10 O19 Pb U4 -","- H80 O152 Pb8 U32 -","8","1","","Li, Y.; Burns, P. C.","Investigations of crystal-chemical variability in lead uranyl oxide hydrates. II. Fourmarierite Note: sample CMNMC 81100","The Canadian Mineralogist","2000","38","","737","749","10.2113/gscanmin.38.3.737","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:07",""
"9004584","14.02","","16.441","","14.348","","90","","90","","90","","3307.25","","","","","","","","","","","","Shinkolobwe, Democratic Republic of Congo","4","B b 21 m","B -2 -2b","36","","","Fourmarierite","- H10 O19 Pb U4 -","- H10 O19 Pb U4 -","- H80 O152 Pb8 U32 -","8","1","","Li, Y.; Burns, P. C.","Investigations of crystal-chemical variability in lead uranyl oxide hydrates. II. Fourmarierite Note: sample CMNMC 53066","The Canadian Mineralogist","2000","38","","737","749","10.2113/gscanmin.38.3.737","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:07",""
"9004585","14.02","","16.425","","14.334","","90","","90","","90","","3300.81","","","","","","","","","","","","Shinkolobwe, Democratic Republic of Congo","4","B b 21 m","B -2 -2b","36","","","Fourmarierite","- H10 O19 Pb U4 -","- H10 O19 Pb U4 -","- H80 O152 Pb8 U32 -","8","1","","Li, Y.; Burns, P. C.","Investigations of crystal-chemical variability in lead uranyl oxide hydrates. II. Fourmarierite Note: sample M30767","The Canadian Mineralogist","2000","38","","737","749","10.2113/gscanmin.38.3.737","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:07",""
"9004586","14","","16.417","","14.357","","90","","90","","90","","3299.78","","","","","","","","","","","","Shinkolobwe, Democratic Republic of Congo","4","B b 21 m","B -2 -2b","36","","","Fourmarierite","- H10 O19 Pb U4 -","- H10 O19 Pb U4 -","- H80 O152 Pb8 U32 -","8","1","","Li, Y.; Burns, P. C.","Investigations of crystal-chemical variability in lead uranyl oxide hydrates. II. Fourmarierite Note: sample M31669","The Canadian Mineralogist","2000","38","","737","749","10.2113/gscanmin.38.3.737","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:07",""
"9004587","14.018","","16.468","","14.368","","90","","90","","90","","3316.83","","","","","","","","","","","","Shinkolobwe, Democratic Republic of Congo","4","B b 21 m","B -2 -2b","36","","","Fourmarierite","- H10 O19 Pb U4 -","- H10 O19 Pb U4 -","- H80 O152 Pb8 U32 -","8","1","","Li, Y.; Burns, P. C.","Investigations of crystal-chemical variability in lead uranyl oxide hydrates. II. Fourmarierite Note: sample CMNMC 81103","The Canadian Mineralogist","2000","38","","737","749","10.2113/gscanmin.38.3.737","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:07",""
"9004588","14.024","","16.42","","14.338","","90","","90","","90","","3301.67","","","","","","","","","","","","","4","B b 21 m","B -2 -2b","36","","","Fourmarierite","- H10 O19 Pb U4 -","- H10 O19 Pb U4 -","- H80 O152 Pb8 U32 -","8","1","","Li, Y.; Burns, P. C.","Investigations of crystal-chemical variability in lead uranyl oxide hydrates. II. Fourmarierite Sample: UMN753","The Canadian Mineralogist","2000","38","","737","749","10.2113/gscanmin.38.3.737","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:07",""
"9004589","14.01","","16.468","","14.369","","90","","90","","90","","3315.17","","","","","","","","","","","","Shaba, Democratic Republic of Congo","4","B b 21 m","B -2 -2b","36","","","Fourmarierite","- H10 O19 Pb U4 -","- H10 O19 Pb U4 -","- H80 O152 Pb8 U32 -","8","1","","Li, Y.; Burns, P. C.","Investigations of crystal-chemical variability in lead uranyl oxide hydrates. II. Fourmarierite Note: sample UMN486","The Canadian Mineralogist","2000","38","","737","749","10.2113/gscanmin.38.3.737","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:07",""
"9004590","14.026","","16.476","","14.382","","90","","90","","90","","3323.57","","","","","","","","","","","","Shaba, Democratic Republic of Congo","4","B b 21 m","B -2 -2b","36","","","Fourmarierite","- H10 O19 Pb U4 -","- H10 O19 Pb U4 -","- H80 O152 Pb8 U32 -","8","1","","Li, Y.; Burns, P. C.","Investigations of crystal-chemical variability in lead uranyl oxide hydrates. II. Fourmarierite Note: sample CMNMC 81101","The Canadian Mineralogist","2000","38","","737","749","10.2113/gscanmin.38.3.737","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:07",""
"9004591","13.938","","16.638","","14.672","","90","","90","","90","","3402.44","","","","","","","","","","","","","4","B b 21 m","B -2 -2b","36","","","Fourmarierite","- H10 O19 Pb U4 -","- H10 O19 Pb U4 -","- H80 O152 Pb8 U32 -","8","1","","Li, Y.; Burns, P. C.","Investigations of crystal-chemical variability in lead uranyl oxide hydrates. II. Fourmarierite Sample: Synthetic","The Canadian Mineralogist","2000","38","","737","749","10.2113/gscanmin.38.3.737","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:07",""
"9004592","15.288","","15.288","","15.288","","90","","90","","90","","3573.16","","","","","","","","","","","","","7","P m -3 m","-P 4 2 3","221","","","Boleite","- Ag9 Cl62 Cu24 H48 K O48 Pb26 -","- Ag9 Cl62 Cu24 H48 K O48 Pb26 -","- Ag9 Cl62 Cu24 H48 K O48 Pb26 -","1","0.0208333","","Cooper, M. A.; Hawthorne, F. C.","Boleite: Resolution of the formula, KPb26Ag9Cu24Cl62(OH)48","The Canadian Mineralogist","2000","38","","801","808","10.2113/gscanmin.38.4.801","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004593","8.9903","","10.1197","","8.9959","","102.654","","92.432","","70.432","","752.013","","","","","","","","","","","","","6","P -1","-P 1","2","","","Juabite","- As4 Ca Cu10 H10 O34 Te4 -","- As4 Ca Cu10 H10 O34 Te4 -","- As4 Ca Cu10 H10 O34 Te4 -","1","0.5","","Burns, P. C.; Clark, C. M.; Gault, R. A.","Juabite, CaCu10(TeO3)4(AsO4)4(OH)2(H2O)4: Crystal structure and revision of the chemical formula","The Canadian Mineralogist","2000","38","","809","816","10.2113/gscanmin.38.4.809","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:07",""
"9004594","9.8102","","10.0424","","9.9788","","90","","101.686","","90","","962.714","","","","","","","","","","","","","8","P 1 21/m 1","-P 2yb","11","","","Andyrobertsite","- As5 Ca0.428 Cd0.426 Cu5 H6 K Mn0.146 O22 -","- As5 Ca0.428 Cd0.426 Cu5 H6 K Mn0.146 O22 -","- As10 Ca0.856 Cd0.852 Cu10 H12 K2 Mn0.292 O44 -","2","0.5","","Cooper, M. A.; Hawthorne, F. C.","Highly undersaturated anions in the crystal structure of andyrobertsite - calcio-andyrobertsite, a doubly acid arsenate of the form K(Cd,Ca)[Cu5(AsO4)4{As(OH)2O2}](H2O)2","The Canadian Mineralogist","2000","38","","817","830","10.2113/gscanmin.38.4.817","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:37",""
"9004595","8.3086","","12.906","","17.486","","90","","102.01","","90","","1833.99","","","","","","","","","","","","Kovdor phoscorite - carbonatite complex, Russia","6","P 1 21/c 1","-P 2ybc","14","","","Bakhchisaraitsevite","- Fe0.528 H15 Mg4.472 Na2 O23 P4 -","- Fe0.528 H15 Mg4.472 Na2 O23 P4 -","- Fe2.112 H60 Mg17.888 Na8 O92 P16 -","4","1","","Yakubovich, O. V.; Massa, W.; Liferovich, R. P.; Pakhomovsky, Y. A.","The crystal structure of bakhchisaraitsevite, [Na2(H2O)2]{(Mg4.5Fe0.5)(PO4)4(H2O)5}, a new mineral species of hydrothermal origin from the Kovdor phoscorite - carbonatite complex, Russia","The Canadian Mineralogist","2000","38","","831","838","10.2113/gscanmin.38.4.831","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:37",""
"9004596","9.416","","9.416","","6.924","","90","","90","","120","","531.644","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","Fluorapatite","- Ca4.417 F O12 P3 Sr0.583 -","- Ca4.4169 F O12 P3 Sr0.5831 -","- Ca8.8338 F2 O24 P6 Sr1.1662 -","2","0.166667","","Rakovan J F; Hughes J M","Strontium in the apatite structure: Strontian fluorapatite and belovite-(Ce)","The Canadian Mineralogist","2000","38","","839","845","10.2113/gscanmin.38.4.839","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004597","9.659","","9.659","","7.182","","90","","90","","120","","580.284","","","","","","","","","","","","","7","P -3","-P 3","147","","","Belovite-(Ce)","- Ce1.833 Cl0.021 F2 Na2 O24 P6 Sr6 -","- Ce1.8334 Cl0.021 F2 Na3.004 O24 P6 Sr6.072 -","- Ce1.8334 Cl0.021 F2 Na3.004 O24 P6 Sr6.072 -","1","0.166667","","Rakovan, J. F.; Hughes, J. M.","Strontium in the apatite structure: Strontian fluorapatite and belovite-(Ce)","The Canadian Mineralogist","2000","38","","839","845","10.2113/gscanmin.38.4.839","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004598","6.705","","12.731","","11.524","","90","","90","","90","","983.704","","","","","","","","","","","","","4","P b c m","-P 2c 2b","57","","","Iriginite","- H6 Mo2 O12 U -","- H6 Mo2 O12 U -","- H24 Mo8 O48 U4 -","4","0.5","","Krivovichev, S. V.; Burns, P. C.","The crystal chemistry of uranyl molybdates. II. the crystal structure of iriginite","The Canadian Mineralogist","2000","38","","847","851","10.2113/gscanmin.38.4.847","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:07",""
"9004599","10.124","","10.124","","14.3198","","90","","90","","120","","1271.08","","","","","","","","","","","","Dara-i-Pioz, Tadjikistan","5","P 6/m c c","-P 6 2c","192","","","Sogdianite","- K Li3 O30 Si12 Zr2 -","- K Li3 O30 Si12 Zr2 -","- K2 Li6 O60 Si24 Zr4 -","2","0.0833333","","Sokolova, E. V.; Hawthorne, F. C.; Pautov, L. A.","The crystal chemistry of Li-bearing minerals with the milarite-type structure: The crystal structure of end-member sogdianite","The Canadian Mineralogist","2000","38","","853","859","10.2113/gscanmin.38.4.853","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004600","15.731","","15.731","","7.0638","","90","","90","","120","","1513.85","","","","","","","","","","","","Stoffhutte, Koralpe, Austria","9","R 3 m :H","R 3 -2""","160","","","Olenite","- Al8.424 B4.062 Ca0.4 F0.06 H3.31 Li0.357 Na0.294 O30.94 Si4.854 -","- Al8.424 B4.062 Ca0.4 F0.06 H3.31 Li0.357 Na0.294 O30.94 Si4.854 -","- Al25.272 B12.186 Ca1.2 F0.18 H9.93 Li1.071 Na0.882 O92.82 Si14.562 -","3","0.166667","","Hughes, J. M.; Ertl, A.; Dyar, M. D.; Grew, E. S.; Shearer, C. K.; Yates, M. G.; Guidotti, C. V.","Tetrahedrally coordinated boron in a tourmaline: Boron-rich olenite from Stoffhutte, Koralpe, Austria","The Canadian Mineralogist","2000","38","","861","868","10.2113/gscanmin.38.4.861","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:37",""
"9004601","9.73","","8.873","","5.275","","90","","105.95","","90","","437.881","","","","","","","","","","","","Southern Baffin Island, Nunavut, Canada","9","C 1 2/c 1","-C 2yc","15","","","Diopside","- Al0.16 Ca0.96 Fe0.05 H0.06 Mg0.86 Na0.04 O6 Si1.9 Ti0.02 -","- Al0.16 Ca0.96 Fe0.05 H0.06 Mg0.86 Na0.04 O6 Si1.9 Ti0.02 -","- Al0.64 Ca3.84 Fe0.2 H0.24 Mg3.44 Na0.16 O24 Si7.6 Ti0.08 -","4","0.5","","Herd, C. D. K.; Peterson, R. C.; Rossman, G. R.","Violet-colored diopside from Southern Baffin Island, Nunavut, Canada","The Canadian Mineralogist","2000","38","","1193","1199","10.2113/gscanmin.38.5.1193","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:37",""
"9004602","12.1476","","12.1476","","7.5636","","90","","90","","90","","1116.12","","","","","","","","","","","","Bolton, Massachusetts, USA","9","I 4/m","-I 4","87","","","Meionite","- C0.44 Al4.88 Ca2.68 Cl0.07 F0.03 K0.2 Na1.12 O25.32 Si7.12 -","- C0.44 Al4.88 Ca2.68 Cl0.07 F0.03 K0.2 Na1.12 O25.32 Si7.12 -","- C0.88 Al9.76 Ca5.36 Cl0.14 F0.06 K0.4 Na2.24 O50.64 Si14.24 -","2","0.125","","Sherriff, B. L.; Sokolova, E. V.; Kabalov, Y. K.; Jenkins, D. M.; Kunath-Fandrei G; Goetz, S.; Jager, C.; Schneider, J.","Meionite: Rietveld structure-refinement, Si MAS and Al SATRAS NMR spectroscopy, and comments on the marialite-meionite series Note: sample BOLT","The Canadian Mineralogist","2000","38","","1201","1213","10.2113/gscanmin.38.5.1201","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:07",""
"9004603","12.1637","","12.1637","","7.5739","","90","","90","","90","","1120.6","","","","","","","","","","","","Slyudyanka mineral deposit, eastern Siberia, Russia","9","I 4/m","-I 4","87","","","Meionite","- C0.32 Al5.2 Ca3.12 Cl0.01 K0.04 Na0.76 O25.28 S0.16 Si6.8 -","- C0.32 Al5.2 Ca3.12 Cl0.01 K0.04 Na0.76 O25.28 S0.16 Si6.8 -","- C0.64 Al10.4 Ca6.24 Cl0.02 K0.08 Na1.52 O50.56 S0.32 Si13.6 -","2","0.125","","Sherriff, B. L.; Sokolova, E. V.; Kabalov, Y. K.; Jenkins, D. M.; Kunath-Fandrei G; Goetz, S.; Jager, C.; Schneider, J.","Meionite: Rietveld structure-refinement, Si MAS and Al SATRAS NMR spectroscopy, and comments on the marialite-meionite series Note: sample SL-1","The Canadian Mineralogist","2000","38","","1201","1213","10.2113/gscanmin.38.5.1201","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:07",""
"9004604","12.1969","","12.1969","","7.5763","","90","","90","","90","","1127.08","","","","","","","","","","","","Monte Somma, Italy","9","I 4/m","-I 4","87","","","Meionite","- C0.44 Al5.88 Ca3.84 Cl0.01 K0.04 Na0.12 O25.4 S0.02 Si6.12 -","- C0.44 Al5.88 Ca3.84 Cl0.01 K0.04 Na0.12 O25.4 S0.02 Si6.12 -","- C0.88 Al11.76 Ca7.68 Cl0.02 K0.08 Na0.24 O50.8 S0.04 Si12.24 -","2","0.125","","Sherriff, B. L.; Sokolova, E. V.; Kabalov, Y. K.; Jenkins, D. M.; Kunath-Fandrei G; Goetz, S.; Jager, C.; Schneider, J.","Meionite: Rietveld structure-refinement, Si MAS and Al SATRAS NMR spectroscopy, and comments on the marialite-meionite series Note: sample MONT","The Canadian Mineralogist","2000","38","","1201","1213","10.2113/gscanmin.38.5.1201","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:07",""
"9004605","12.2119","","12.2119","","7.5811","","90","","90","","90","","1130.57","","","","","","","","","","","","","5","I 4/m","-I 4","87","","","Meionite","- C0.13 Al1.5 Ca0.96 O6.39 Si1.5 -","- C0.13 Al1.5 Ca0.96 O6.39 Si1.5 -","- C1.04 Al12 Ca7.68 O51.12 Si12 -","8","0.5","","Sherriff, B. L.; Sokolova, E. V.; Kabalov, Y. K.; Jenkins, D. M.; Kunath-Fandrei G; Goetz, S.; Jager, C.; Schneider, J.","Meionite: Rietveld structure-refinement, Si MAS and Al SATRAS NMR spectroscopy, and comments on the marialite-meionite series Sample: S.MEI, Synthetic","The Canadian Mineralogist","2000","38","","1201","1213","10.2113/gscanmin.38.5.1201","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004606","9.549","","9.549","","9.163","","90","","90","","120","","723.576","","","","","","","","","","","","Baveno granite, Piemonte, Italy","8","P 6/m c c","-P 6 2c","192","","","Bazzite","- Be3 Cs0.1 Fe0.48 H0.26 Na0.44 O18.9 Sc1.52 Si6 -","- Be3 Cs0.1 Fe0.48 H1.8 Na0.44 O18.9 Sc1.52 Si6 -","- Be6 Cs0.2 Fe0.96 H3.6 Na0.88 O37.8 Sc3.04 Si12 -","2","0.0833333","","Demartin, F.; Gramaccioli, C. M.; Pilati, T.","Structure refinement of bazzite from pegmatitic and miarolitic occurrences","The Canadian Mineralogist","2000","38","","1419","1424","10.2113/gscanmin.38.6.1419","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:09",""
"9004607","9.555","","9.555","","9.16","","90","","90","","120","","724.248","","","","","","","","","","","","Tordal, Norway","10","P 6/m c c","-P 6 2c","192","","","Bazzite","- Al0.12 Be2.91 Cs0.14 Fe0.52 H0.26 Li0.09 Na0.36 O18.86 Sc1.36 Si6 -","- Al0.12 Be2.91 Cs0.14 Fe0.52 H1.72 Li0.09 Na0.36 O18.86 Sc1.36 Si6 -","- Al0.24 Be5.82 Cs0.28 Fe1.04 H3.44 Li0.18 Na0.72 O37.72 Sc2.72 Si12 -","2","0.0833333","","Demartin, F.; Gramaccioli, C. M.; Pilati, T.","Structure refinement of bazzite from pegmatitic and miarolitic occurrences","The Canadian Mineralogist","2000","38","","1419","1424","10.2113/gscanmin.38.6.1419","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:09",""
"9004608","5.4044","","14.5145","","4.7052","","90","","102.798","","90","","359.917","","","","","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","Vayrynenite","- Be F0.08 Fe0.226 H0.92 Mn0.774 O4.92 P0.988 -","- Be F0.08 Fe0.226 H0.92 Mn0.774 O4.92 P0.988 -","- Be4 F0.32 Fe0.904 H3.68 Mn3.096 O19.68 P3.952 -","4","1","","Huminicki, D. M. C.; Hawthorne, F. C.","Refinement of the crystal structure of vayrynenite","The Canadian Mineralogist","2000","38","","1425","1432","10.2113/gscanmin.38.6.1425","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004609","13.281","","10.223","","26.1","","90","","103.202","","90","","3449.99","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- H14 O41 Pb2 U11 -","- H6 O41 Pb2 U11 -","- H24 O164 Pb8 U44 -","4","0.5","","Li, Y.; Burns, P. C.","Synthesis and crystal structure of a new Pb uranyl oxide hydrate with a framework structure that contains channels","The Canadian Mineralogist","2000","38","","1433","1441","10.2113/gscanmin.38.6.1433","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:09",""
"9004610","6.2592","","13.0838","","13.2271","","91.13","","103.554","","90.188","","1052.81","","","","","","","","","","","","Mont Saint-Hilaire, Quebec, Canada","15","P -1","-P 1","2","","","Adamsite-(Y)","- C2 H4.89 Ce0.01 Dy0.06 Er0.05 Gd0.04 Ho0.02 Na Nd0.03 O12 Sm0.02 Tb0.01 Tm0.01 Y0.72 Yb0.02 -","- C2 H12 Ce0.01 Dy0.06 Er0.05 Gd0.04 Ho0.02 Na Nd0.03 O12 Sm0.02 Tb0.01 Tm0.01 Y0.72 Yb0.02 -","- C8 H48 Ce0.04 Dy0.24 Er0.2 Gd0.16 Ho0.08 Na4 Nd0.12 O48 Sm0.08 Tb0.04 Tm0.04 Y2.88 Yb0.08 -","4","2","","Grice, J. D.; Gault, R. A.; Roberts, A. C.; Cooper, M. A.","Adamsite-(Y), a new sodium-yttrium carbonate mineral species from Note: O8 y-coordinate altered","The Canadian Mineralogist","2000","38","","1457","1466","10.2113/gscanmin.38.6.1457","","","","","","","","","","","","","","","","","","","","","has coordinates","283907","2023-05-21","07:14:43",""
"9005429","13.6164","","15.6672","","19.1869","","106.933","","91.531","","98.401","","3863.3","","","","","","","","","","","","","5","P -1","-P 1","2","","","Pushcharovskite","- As15 Cu18 H103.583 K0.632 O88.3 -","- As15 Cu18 H65.0167 K0.632 O88.3 -","- As30 Cu36 H130.033 K1.264 O176.6 -","2","1","","Pushcharovsky, D. Y.; Teat, S. J.; Zaitsev, V. N.; Zubkova, N. V.; Sarp, H.","Crystal structure of pushcharovskite","European Journal of Mineralogy","2000","12","","95","104","","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:09",""
"9005430","9.8475","","9.0277","","5.2495","","90","","104.805","","90","","451.189","","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","Hedenbergite","- Ca0.94 Fe Na0.06 O6 Si2 -","- Ca0.94 Fe Na0.06 O6 Si2 -","- Ca3.76 Fe4 Na0.24 O24 Si8 -","4","0.5","","Redhammer, G. J.; Amthauer, G.; Lottermoser, W.; Treutmann, W.","Synthesis and structural properties of clinopyroxenes of the hedenbergite CaFeSi2O6 - aegirine NaFeSi2O6 solid-solution series Sample: hd/6","European Journal of Mineralogy","2000","12","","105","120","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005431","9.8472","","9.0288","","5.2466","","90","","104.789","","90","","451.014","","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","Hedenbergite","- Ca0.9 Fe Na0.1 O6 Si2 -","- Ca0.9 Fe Na0.1 O6 Si2 -","- Ca3.6 Fe4 Na0.4 O24 Si8 -","4","0.5","","Redhammer, G. J.; Amthauer, G.; Lottermoser, W.; Treutmann, W.","Synthesis and structural properties of clinopyroxenes of the hedenbergite CaFeSi2O6 - aegirine NaFeSi2O6 solid-solution series Sample: hd/10","European Journal of Mineralogy","2000","12","","105","120","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005432","9.7951","","8.9698","","5.2634","","90","","105.523","","90","","445.574","","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","Hedenbergite","- Ca0.75 Fe Na0.25 O6 Si2 -","- Ca0.75 Fe Na0.25 O6 Si2 -","- Ca3 Fe4 Na O24 Si8 -","4","0.5","","Redhammer, G. J.; Amthauer, G.; Lottermoser, W.; Treutmann, W.","Synthesis and structural properties of clinopyroxenes of the hedenbergite CaFeSi2O6 - aegirine NaFeSi2O6 solid-solution series Sample: ae25/20","European Journal of Mineralogy","2000","12","","105","120","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005433","9.7598","","8.9277","","5.2748","","90","","106.041","","90","","441.712","","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","Hedenbergite","- Ca0.6 Fe Na0.4 O6 Si2 -","- Ca0.6 Fe Na0.4 O6 Si2 -","- Ca2.4 Fe4 Na1.6 O24 Si8 -","4","0.5","","Redhammer, G. J.; Amthauer, G.; Lottermoser, W.; Treutmann, W.","Synthesis and structural properties of clinopyroxenes of the hedenbergite CaFeSi2O6 - aegirine NaFeSi2O6 solid-solution series Sample: ae40/20","European Journal of Mineralogy","2000","12","","105","120","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005434","9.7441","","8.9103","","5.2791","","90","","106.225","","90","","440.091","","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","Clinopyroxene","- Ca0.5 Fe Na0.5 O6 Si2 -","- Ca0.5 Fe Na0.5 O6 Si2 -","- Ca2 Fe4 Na2 O24 Si8 -","4","0.5","","Redhammer G J; Amthauer G; Lottermoser W; Treutmann W","Synthesis and structural properties of clinopyroxenes of the hedenbergite CaFeSi2O6 - aegirine NaFeSi2O6 solid-solution series Sample: ae50/20","European Journal of Mineralogy","2000","12","","105","120","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005435","9.7189","","8.8818","","5.2835","","90","","106.598","","90","","437.075","","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","Aegirine","- Ca0.4 Fe Na0.6 O6 Si2 -","- Ca0.4 Fe Na0.6 O6 Si2 -","- Ca1.6 Fe4 Na2.4 O24 Si8 -","4","0.5","","Redhammer, G. J.; Amthauer, G.; Lottermoser, W.; Treutmann, W.","Synthesis and structural properties of clinopyroxenes of the hedenbergite CaFeSi2O6 - aegirine NaFeSi2O6 solid-solution series Sample: ae60/1","European Journal of Mineralogy","2000","12","","105","120","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005436","9.6977","","8.8519","","5.2861","","90","","106.765","","90","","434.488","","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","Aegirine","- Ca0.25 Fe Na0.75 O6 Si2 -","- Ca0.25 Fe Na0.75 O6 Si2 -","- Ca Fe4 Na3 O24 Si8 -","4","0.5","","Redhammer, G. J.; Amthauer, G.; Lottermoser, W.; Treutmann, W.","Synthesis and structural properties of clinopyroxenes of the hedenbergite CaFeSi2O6 - aegirine NaFeSi2O6 solid-solution series Sample: ae75/20","European Journal of Mineralogy","2000","12","","105","120","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005437","9.6714","","8.8152","","5.2926","","90","","107.166","","90","","431.122","","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","Aegirine","- Ca0.1 Fe Na0.9 O6 Si2 -","- Ca0.1 Fe Na0.9 O6 Si2 -","- Ca0.4 Fe4 Na3.6 O24 Si8 -","4","0.5","","Redhammer, G. J.; Amthauer, G.; Lottermoser, W.; Treutmann, W.","Synthesis and structural properties of clinopyroxenes of the hedenbergite CaFeSi2O6 - aegirine NaFeSi2O6 solid-solution series Sample: ae90/13","European Journal of Mineralogy","2000","12","","105","120","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005438","9.6549","","8.7947","","5.2938","","90","","107.394","","90","","428.952","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","Aegirine","- Fe Na O6 Si2 -","- Fe Na O6 Si2 -","- Fe4 Na4 O24 Si8 -","4","0.5","","Redhammer, G. J.; Amthauer, G.; Lottermoser, W.; Treutmann, W.","Synthesis and structural properties of clinopyroxenes of the hedenbergite CaFeSi2O6 - aegirine NaFeSi2O6 solid-solution series Sample: ae100/12","European Journal of Mineralogy","2000","12","","105","120","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005439","9.6543","","8.807","","5.2943","","90","","107.316","","90","","429.748","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","Aegirine","- Fe Na O6 Si2 -","- Fe Na O6 Si2 -","- Fe4 Na4 O24 Si8 -","4","0.5","","Redhammer, G. J.; Amthauer, G.; Lottermoser, W.; Treutmann, W.","Synthesis and structural properties of clinopyroxenes of the hedenbergite CaFeSi2O6 - aegirine NaFeSi2O6 solid-solution series Sample: ae100/F3d","European Journal of Mineralogy","2000","12","","105","120","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005440","5.42","","14.743","","5.597","","90","","90","","90","","447.24","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","","Srebrodolskite","- Al0.135 Ca2 Fe1.865 O5 -","- Al0.135 Ca2 Fe1.865 O5 -","- Al0.54 Ca8 Fe7.46 O20 -","4","0.5","","Kahlenberg, V.; Fischer, R. X.","Crystal growth and cation distribution in doped dicalcium ferrite Ca2(Fe1-xMex)2O5 (Me=Al,Ga) Sample: Me = Al","European Journal of Mineralogy","2000","12","","129","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005441","5.42","","14.721","","5.599","","90","","90","","90","","446.732","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","","Srebrodolskite","- Ca2 Fe1.445 Ga0.555 O5 -","- Ca2 Fe1.445 Ga0.555 O5 -","- Ca8 Fe5.78 Ga2.22 O20 -","4","0.5","","Kahlenberg, V.; Fischer, R. X.","Crystal growth and cation distribution in doped dicalcium ferrite Ca2(Fe1-xMex)2O5 (Me=Al,Ga) Sample: Me = Ga","European Journal of Mineralogy","2000","12","","129","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005442","9.467","","5.466","","9.14","","96.67","","101.04","","90","","460.949","","","","","","","","","","","","","6","C -1","-P 1 (1/2*x+1/2*y,1/2*x-1/2*y,-z)","2","","","Chloritoid","- Al3.983 Fe1.038 H4 Mg0.97 O14 Si2 -","- Al3.9825 Fe1.0375 Mg0.97 O14 Si2 -","- Al7.965 Fe2.075 Mg1.94 O28 Si4 -","2","","","Koch-Muller M; Abs-Wurmbach I; Langer, K.; Shaw, C.; Wirth, R.; Gottschalk, M.","Synthetic and natural Fe-Mg chloritoid: structural, spectroscopic and thermodynamic studies Sample: MKM-97-4","European Journal of Mineralogy","2000","12","","293","314","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005443","9.451","","5.4674","","18.159","","90","","101.4","","90","","919.807","","","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","Chloritoid","- Al3.985 Fe0.875 H4 Mg1.12 O14 Si2 -","- Al3.985 Fe0.875 Mg1.12 O14 Si2 -","- Al15.94 Fe3.5 Mg4.48 O56 Si8 -","4","0.5","","Koch-Muller M; Abs-Wurmbach I; Langer, K.; Shaw, C.; Wirth, R.; Gottschalk, M.","Synthetic and natural Fe-Mg chloritoid: structural, spectroscopic and thermodynamic studies Sample: RO2","European Journal of Mineralogy","2000","12","","293","314","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005444","11.274","","7.344","","11.468","","99.18","","97.19","","90.02","","929.775","","","","","","","","","","","","","4","C 1","C 1","1","","","Clinotobermorite","- Ca5 H10 O22 Si6 -","- Ca5 H10 O22 Si6 -","- Ca10 H20 O44 Si12 -","2","","","Merlino, S.; Bonaccorsi, E.; Armbruster, T.","The real structure of clinotobermorite and tobermorite 9 A: OD character, polytypes, and structural relationships Sample: MDO2 data collected at Pisa","European Journal of Mineralogy","2000","12","","411","429","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:52:28",""
"9005445","11.273","","7.35","","11.498","","99.17","","97.19","","89.97","","932.93","","","","","","","","","","","","","4","C 1","C 1","1","","","Clinotobermorite","- Ca5 H10 O22 Si6 -","- Ca5 H10 O22 Si6 -","- Ca10 H20 O44 Si12 -","2","","","Merlino, S.; Bonaccorsi, E.; Armbruster, T.","The real structure of clinotobermorite and tobermorite 9 A: OD character, polytypes, and structural relationships Sample: MDO2 data collected at Bern","European Journal of Mineralogy","2000","12","","411","429","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:52:32",""
"9005446","11.276","","7.343","","22.642","","90","","97.28","","90","","1859.64","","","","","","","","","","","","","4","C 1 c 1","C -2yc","9","","","Clinotobermorite","- Ca5 H10 O22 Si6 -","- Ca5 H10 O22 Si6 -","- Ca20 H40 O88 Si24 -","4","1","","Merlino, S.; Bonaccorsi, E.; Armbruster, T.","The real structure of clinotobermorite and tobermorite 9 A: OD character, polytypes, and structural relationships Sample: MDO1 data collected at Pisa","European Journal of Mineralogy","2000","12","","411","429","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:52:37",""
"9005447","11.156","","7.303","","9.566","","101.08","","92.83","","89.98","","763.87","","","","","","","","","","","","","4","C -1","-P 1 (1/2*x+1/2*y,1/2*x-1/2*y,-z)","2","","","Tobermorite","- Ca2.5 H O9 Si3 -","- Ca2.5 H O9 Si3 -","- Ca10 H4 O36 Si12 -","4","","","Merlino, S.; Bonaccorsi, E.; Armbruster, T.","The real structure of clinotobermorite and tobermorite 9 A: OD character, polytypes, and structural relationships Sample: MDO2","European Journal of Mineralogy","2000","12","","411","429","","","","","","","","","","","","","","","","","","","","","","has coordinates","287550","2023-11-11","17:51:30",""
"9005448","18.4049","","56.655","","6.5443","","90","","90","","90","","6823.94","","","","","","","","","","","","","6","F d d 2","F 2 -2d","43","","","Mesolite","- Al6 Ca2 H16 Na2 O38 Si9 -","- Al6 Ca2 H16 Na2 O38 Si9 -","- Al48 Ca16 H128 Na16 O304 Si72 -","8","0.5","","Stuckenschmidt, E.; Kirfel, A.","Zeolites of NAT topology: Structure refinement of mesolite from single crystal X-ray data and comparison with the structures of natrolite and scolecite","European Journal of Mineralogy","2000","12","","571","579","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005449","7.965","","9.999","","7.644","","103.94","","115.91","","67.86","","505.086","","","","","","","","","","","","Rocabruna mines, Bruguers, Barcelona, Catalonia, Spain","5","P -1","-P 1","2","","","Tinticite","- Fe5.34 H20 O26.8 P3.62 V0.38 -","- Fe5.34 H17.6 O26.8 P3.62 V0.38 -","- Fe5.34 H17.6 O26.8 P3.62 V0.38 -","1","0.5","","Rius, J.; Louer, D.; Louer, M.; Gali, S.; Melgarejo, J. C.","Structure solution from powder data of the phosphate hydrate tinticite","European Journal of Mineralogy","2000","12","","581","588","","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:09",""
"9005450","3.909","","3.909","","3.909","","90","","90","","90","","59.731","","","","","","","","","","","","","6","P m -3 m","-P 4 2 3","221","","","Isolueshite","- Ca0.06 La0.19 Na0.75 Nb0.5 O3 Ti0.5 -","- Ca0.06 La0.19 Na0.75 Nb0.5 O3 Ti0.5 -","- Ca0.06 La0.19 Na0.75 Nb0.5 O3 Ti0.5 -","1","0.0208333","","Krivovichev, S. V.; Chakhmouradian, A. R.; Mitchell, R. H.; Filatov, S. K.; Chukanov, N. V.","Crystal structure of isolueshite and its synthetic compositional analogue Sample: isolueshite","European Journal of Mineralogy","2000","12","","597","607","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005451","7.7842","","7.8033","","7.7828","","90","","90","","90","","472.746","","","","","","","","","","","","","5","C m c m","-C 2c 2","63","","","Isolueshite","- La0.25 Na0.75 Nb0.5 O3 Ti0.5 -","- La0.25 Na0.75 Nb0.5 O3 Ti0.5 -","- La2 Na6 Nb4 O24 Ti4 -","8","0.5","","Krivovichev, S. V.; Chakhmouradian, A. R.; Mitchell, R. H.; Filatov, S. K.; Chukanov, N. V.","Crystal structure of isolueshite and its synthetic compositional analogue Sample: synthetic (Na.75La.25)(Nb.5Ti.5)O3","European Journal of Mineralogy","2000","12","","597","607","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005452","27.637","","4.0499","","20.741","","90","","131.258","","90","","1745.17","","","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","Felbertalite","- Bi8 Cu2 Pb6 S19 -","- Bi8 Cu2 Pb6 S19 -","- Bi16 Cu4 Pb12 S38 -","2","0.25","","Topa, D.; Makovicky, E.; Balic-Zunic T; Berlepsch, P.","The crystal structure of Cu2Pb6Bi8S19","European Journal of Mineralogy","2000","12","","825","833","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005453","51.996","","8.148","","24.311","","90","","104.09","","90","","9989.81","","","","","","","","","","","","Tuscany, Italy","4","C 1 2/m 1","-C 2y","12","","","Scainiite","- O5 Pb14 S54 Sb30 -","- O5 Pb14 S54 Sb30 -","- O20 Pb56 S216 Sb120 -","4","0.5","","Moelo, Y.; Meerschaut, A.; Orlandi, P.; Palvadeau, P.","Lead-antimony sulfosalts from Tuscany (Italy): II - Crystal structure of scainiite, Pb14Sb30S54O5, an expanded monoclinic derivative of Ba12Bi24S48 hexagonal sub-type (zinkenite group)","European Journal of Mineralogy","2000","12","","835","846","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005454","12.018","","12.565","","6.415","","90","","114.33","","90","","882.672","","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- Fe2 Mn Na O12 P3 -","- Fe2 Mn Na O12 P3 -","- Fe8 Mn4 Na4 O48 P12 -","4","0.5","","Hatert, F.; Keller, P.; Lissner, F.; Antenucci, D.; Fransolet, A.-M.","First experimental evidence of alluaudite-like phosphates with high Li-content: the (Na1-xLix)MnFe2(PO4)3 series (x= 0 to 1) Sample: NaMnFe2(PO4)3","European Journal of Mineralogy","2000","12","","847","857","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005455","11.988","","12.5","","6.392","","90","","114.67","","90","","870.416","","","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- Fe2 Li0.5 Mn Na0.5 O12 P3 -","- Fe2 Li0.5 Mn Na0.5 O12 P3 -","- Fe8 Li2 Mn4 Na2 O48 P12 -","4","0.5","","Hatert, F.; Keller, P.; Lissner, F.; Antenucci, D.; Fransolet, A.-M.","First experimental evidence of alluaudite-like phosphates with high Li-content: the (Na1-xLix)MnFe2(PO4)3 series (x= 0 to 1) Sample: Na.5Li.5MnFe2(PO4)3","European Journal of Mineralogy","2000","12","","847","857","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005456","8.5424","","5.7117","","9.6484","","90","","108.298","","90","","446.958","","","","","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","Sursassite","- Al2.58 H3.42 Mg2.42 O14 Si3 -","- Al2.58 H3.42 Mg2.42 O14 Si3 -","- Al5.16 H6.84 Mg4.84 O28 Si6 -","2","0.5","","Gottschalk, M.; Fockenberg, T.; Grevel, K.-D.; Wunder, B.; Wirth, R.; Schreyer, W.; Maresch, W. V.","Crystal structure of the high-pressure phase Mg4(MgAl)Al4[Si6O21/(OH)7]: an analogue of sursassite Sample: A53","European Journal of Mineralogy","2000","12","","935","945","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005457","15.964","","15.964","","7.119","","90","","90","","120","","1571.21","","","","","","","","","","","","","6","R 3 m :H","R 3 -2""","160","","","Foitite","- Al7.419 B3 Fe1.581 H3.58 O31 Si6 -","- Al7.419 B3 Fe1.581 H3.58 O31 Si6 -","- Al22.257 B9 Fe4.743 H10.74 O93 Si18 -","3","0.166667","","Kahlenberg, V.; Velickov, B.","Structural investigations on a synthetic alkali-free hydrogen-deficient Fe-tourmaline (foitite)","European Journal of Mineralogy","2000","12","","947","953","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:52:53",""
"9005458","5.2046","","9.0368","","19.886","","90","","95.615","","90","","930.809","","","","","","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","Phengite","- Al1.368 F0.8 Fe0.038 H1.2 K0.964 Mg0.73 O11.2 Si3.808 -","- Al1.368 F0.8 Fe0.038 H1.2 K0.964 Mg0.73 O11.2 Si3.808 -","- Al5.472 F3.2 Fe0.152 H4.8 K3.856 Mg2.92 O44.8 Si15.232 -","4","0.5","","Smyth, J. R.; Jacobsen, S. D.; Swope, R. J.; Angel, R. J.; Arlt, T.; Domanik, K.; Holloway, J. R.","Crystal structures and compressibilities of synthetic 2M_1 and 3T phengite micas Sample: synthetic 2M_1","European Journal of Mineralogy","2000","12","","955","963","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:44",""
"9005459","5.211","","5.211","","29.689","","90","","90","","120","","698.182","","","","","","","","","","","","","8","P 31 1 2","P 31 2 (0 0 4)","151","","","Phengite","- Al0.998 F0.8 Fe0.026 H1.2 K Mg0.5 O11.2 Si3.808 -","- Al0.998 F0.8 Fe0.026 H1.2 K Mg0.5 O11.2 Si3.808 -","- Al2.994 F2.4 Fe0.078 H3.6 K3 Mg1.5 O33.6 Si11.424 -","3","0.5","","Smyth, J. R.; Jacobsen, S. D.; Swope, R. J.; Angel, R. J.; Arlt, T.; Domanik, K.; Holloway, J. R.","Crystal structures and compressibilities of synthetic 2M_1 and 3T phengite micas Sample: synthetic 3T","European Journal of Mineralogy","2000","12","","955","963","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:44",""
"9005460","5.6906","","17.061","","9.732","","90","","90","","90","","944.854","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","","Rollandite","- As2 Cu3 H8 O12 -","- As2 Cu3 H8 O12 -","- As8 Cu12 H32 O48 -","4","0.5","","Sarp, H.; Cerny, R.","Rollandite, Cu3(AsO4)2.4H2O, a new mineral: its description and crystal structure","European Journal of Mineralogy","2000","12","","1045","1050","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:52:56",""
"9005461","13.601","","18.232","","17.81","","90","","90","","90","","4416.41","","","","","","","","","","","","","10","F m m m","-F 2 2","69","","","Barrerite","- Al1.876 Ba0.002 Ca0.162 H34 K0.03 Mg0.047 N1.315 Na0.106 O22.52 Si7.123 -","- Al1.8765 Ba0.0025 Ca0.1625 H9.04 K0.03 Mg0.0475 N1.315 Na0.10625 O22.52 Si7.1235 -","- Al15.012 Ba0.02 Ca1.3 H72.32 K0.24 Mg0.38 N10.52 Na0.85 O180.16 Si56.988 -","8","0.25","","Meneghinello, E.; Alberti, A.; Cruciani, G.; Sacerdoti, M.; McIntyre, G.; Ciambelli, P.; Rapascciuolo, M. T.","Single crystal neutron diffraction study of the natural zeolite barrerite in its ND4-exchanged form","European Journal of Mineralogy","2000","12","","1123","1129","","","","","","","","","","","","","","","","","","","","","","has coordinates","285044","2023-07-06","18:10:13",""
"9005462","6.1844","","24.2715","","21.2265","","90","","100.326","","90","","3134.59","","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","Pickeringite","- Al2 H44 Mg0.93 Mn0.07 O38 S4 -","- Al2 H44 Mg0.93 Mn0.07 O38 S4 -","- Al8 H176 Mg3.72 Mn0.28 O152 S16 -","4","1","","Quartieri, S.; Triscari, M.; Viani, A.","Crystal structure of the hydrated sulphate pickeringite (MgAl2(SO4)4.22H2O): X-ray powder diffraction study","European Journal of Mineralogy","2000","12","","1131","1138","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:52:56",""
"9005463","7.1381","","9.1626","","8.9421","","91.903","","98.105","","77.468","","565.206","","","","","","","","","","","","","10","P -1","-P 1","2","","","Magnesio-axinite","- Al2 B Ca1.975 Cr0.005 H0.95 Mg0.96 Mn0.035 O16 Si4 V0.015 -","- Al2 B Ca1.975 Cr0.005 H0.95 Mg0.96 Mn0.035 O16 Si4 V0.015 -","- Al4 B2 Ca3.95 Cr0.01 H1.9 Mg1.92 Mn0.07 O32 Si8 V0.03 -","2","1","","Andreozzi G B; Lucchesi S; Graziani G","Structural study of magnesioaxinite and its crystal-chemical relations with axinite-group minerals","European Journal of Mineralogy","2000","12","","1185","1194","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9006784","4.2131","","4.2131","","4.2131","","90","","90","","90","","74.783","","","","300","","","","0","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Zhang, J.","Effect of pressure on the thermal expansion of MgO up to 8.2 GPa Sample: Run1 at T = 300 K, P = 0.00 GPa, measured at beginning of the experiments","Physics and Chemistry of Minerals","2000","27","","145","148","10.1007/s002690050001","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006785","4.2136","","4.2136","","4.2136","","90","","90","","90","","74.81","","","","300","","","","0","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Zhang, J.","Effect of pressure on the thermal expansion of MgO up to 8.2 GPa Sample: Run1 at T = 300 K, P = 0.00 GPa, measured at the end of the experiments","Physics and Chemistry of Minerals","2000","27","","145","148","10.1007/s002690050001","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006786","4.1899","","4.1899","","4.1899","","90","","90","","90","","73.555","","","","300","","","","2650000","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Zhang, J.","Effect of pressure on the thermal expansion of MgO up to 8.2 GPa Sample: Run1 at T = 300 K, P = 2.65 GPa","Physics and Chemistry of Minerals","2000","27","","145","148","10.1007/s002690050001","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006787","4.1942","","4.1942","","4.1942","","90","","90","","90","","73.781","","","","373","","","","2680000","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Zhang, J.","Effect of pressure on the thermal expansion of MgO up to 8.2 GPa Sample: Run1 at T = 373 K, P = 2.68 GPa","Physics and Chemistry of Minerals","2000","27","","145","148","10.1007/s002690050001","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006788","4.1988","","4.1988","","4.1988","","90","","90","","90","","74.025","","","","473","","","","2620000","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Zhang, J.","Effect of pressure on the thermal expansion of MgO up to 8.2 GPa Sample: Run1 at T = 473 K, P = 2.62 GPa","Physics and Chemistry of Minerals","2000","27","","145","148","10.1007/s002690050001","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006789","4.2039","","4.2039","","4.2039","","90","","90","","90","","74.295","","","","573","","","","2660000","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Zhang, J.","Effect of pressure on the thermal expansion of MgO up to 8.2 GPa Sample: Run1 at T = 573 K, P = 2.66 GPa","Physics and Chemistry of Minerals","2000","27","","145","148","10.1007/s002690050001","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006790","4.2081","","4.2081","","4.2081","","90","","90","","90","","74.517","","","","673","","","","2660000","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Zhang, J.","Effect of pressure on the thermal expansion of MgO up to 8.2 GPa Sample: Run1 at T = 673 K, P = 2.66 GPa","Physics and Chemistry of Minerals","2000","27","","145","148","10.1007/s002690050001","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006791","4.2143","","4.2143","","4.2143","","90","","90","","90","","74.847","","","","773","","","","2610000","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Zhang, J.","Effect of pressure on the thermal expansion of MgO up to 8.2 GPa Sample: Run1 at T = 773 K, P = 2.61 GPa","Physics and Chemistry of Minerals","2000","27","","145","148","10.1007/s002690050001","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006792","4.2202","","4.2202","","4.2202","","90","","90","","90","","75.162","","","","873","","","","2640000","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Zhang, J.","Effect of pressure on the thermal expansion of MgO up to 8.2 GPa Sample: Run1 at T = 873 K, P = 2.64 GPa","Physics and Chemistry of Minerals","2000","27","","145","148","10.1007/s002690050001","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006793","4.2251","","4.2251","","4.2251","","90","","90","","90","","75.424","","","","973","","","","2670000","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Zhang, J.","Effect of pressure on the thermal expansion of MgO up to 8.2 GPa Sample: Run1 at T = 973 K, P = 2.67 GPa","Physics and Chemistry of Minerals","2000","27","","145","148","10.1007/s002690050001","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006794","4.2322","","4.2322","","4.2322","","90","","90","","90","","75.805","","","","1073","","","","2630000","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Zhang, J.","Effect of pressure on the thermal expansion of MgO up to 8.2 GPa Sample: Run1 at T = 1073 K, P = 2.63 GPa","Physics and Chemistry of Minerals","2000","27","","145","148","10.1007/s002690050001","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006795","4.2128","","4.2128","","4.2128","","90","","90","","90","","74.767","","","","300","","","","0","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Zhang, J.","Effect of pressure on the thermal expansion of MgO up to 8.2 GPa Sample: Run2 at T = 300 K, P = 0.00 GPa, measured at beginning of the experiments","Physics and Chemistry of Minerals","2000","27","","145","148","10.1007/s002690050001","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006796","4.2133","","4.2133","","4.2133","","90","","90","","90","","74.794","","","","300","","","","0","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Zhang, J.","Effect of pressure on the thermal expansion of MgO up to 8.2 GPa Sample: Run2 at T = 300 K, P = 0.00 GPa, measured at end of the experiments","Physics and Chemistry of Minerals","2000","27","","145","148","10.1007/s002690050001","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006797","4.1674","","4.1674","","4.1674","","90","","90","","90","","72.376","","","","300","","","","5440000","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Zhang, J.","Effect of pressure on the thermal expansion of MgO up to 8.2 GPa Sample: Run2 at T = 300 K, P = 5.44 GPa","Physics and Chemistry of Minerals","2000","27","","145","148","10.1007/s002690050001","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006798","4.1697","","4.1697","","4.1697","","90","","90","","90","","72.496","","","","373","","","","5470000","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Zhang, J.","Effect of pressure on the thermal expansion of MgO up to 8.2 GPa Sample: Run2 at T = 373 K, P = 5.47 GPa","Physics and Chemistry of Minerals","2000","27","","145","148","10.1007/s002690050001","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006799","4.1749","","4.1749","","4.1749","","90","","90","","90","","72.768","","","","473","","","","5440000","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Zhang, J.","Effect of pressure on the thermal expansion of MgO up to 8.2 GPa Sample: Run2 at T = 473 K, P = 5.44 GPa","Physics and Chemistry of Minerals","2000","27","","145","148","10.1007/s002690050001","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006800","4.1801","","4.1801","","4.1801","","90","","90","","90","","73.04","","","","573","","","","5430000","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Zhang, J.","Effect of pressure on the thermal expansion of MgO up to 8.2 GPa Sample: Run2 at T = 573 K, P = 5.43 GPa","Physics and Chemistry of Minerals","2000","27","","145","148","10.1007/s002690050001","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006801","4.1842","","4.1842","","4.1842","","90","","90","","90","","73.255","","","","673","","","","5440000","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Zhang, J.","Effect of pressure on the thermal expansion of MgO up to 8.2 GPa Sample: Run2 at T = 673 K, P = 5.44 GPa","Physics and Chemistry of Minerals","2000","27","","145","148","10.1007/s002690050001","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006802","4.1894","","4.1894","","4.1894","","90","","90","","90","","73.528","","","","773","","","","5390000","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Zhang, J.","Effect of pressure on the thermal expansion of MgO up to 8.2 GPa Sample: Run2 at T = 773 K, P = 5.39 GPa","Physics and Chemistry of Minerals","2000","27","","145","148","10.1007/s002690050001","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006803","4.1948","","4.1948","","4.1948","","90","","90","","90","","73.813","","","","873","","","","5420000","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Zhang, J.","Effect of pressure on the thermal expansion of MgO up to 8.2 GPa Sample: Run2 at T = 873 K, P = 5.42 GPa","Physics and Chemistry of Minerals","2000","27","","145","148","10.1007/s002690050001","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006804","4.2005","","4.2005","","4.2005","","90","","90","","90","","74.114","","","","973","","","","5420000","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Zhang, J.","Effect of pressure on the thermal expansion of MgO up to 8.2 GPa Sample: Run2 at T = 973 K, P = 5.42 GPa","Physics and Chemistry of Minerals","2000","27","","145","148","10.1007/s002690050001","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006805","4.2052","","4.2052","","4.2052","","90","","90","","90","","74.364","","","","1073","","","","5400000","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Zhang, J.","Effect of pressure on the thermal expansion of MgO up to 8.2 GPa Sample: Run2 at T = 1073 K, P = 5.40 GPa","Physics and Chemistry of Minerals","2000","27","","145","148","10.1007/s002690050001","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006806","4.2126","","4.2126","","4.2126","","90","","90","","90","","74.757","","","","300","","","","0","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Zhang, J.","Effect of pressure on the thermal expansion of MgO up to 8.2 GPa Sample: Run3 at T = 300 K, P = 0.00 GPa, measured at beginning of the experiments","Physics and Chemistry of Minerals","2000","27","","145","148","10.1007/s002690050001","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006808","4.1451","","4.1451","","4.1451","","90","","90","","90","","71.221","","","","300","","","","8210000","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Zhang, J.","Effect of pressure on the thermal expansion of MgO up to 8.2 GPa Sample: Run3 at T = 300 K, P = 8.21 GPa","Physics and Chemistry of Minerals","2000","27","","145","148","10.1007/s002690050001","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006809","4.1476","","4.1476","","4.1476","","90","","90","","90","","71.349","","","","373","","","","8240000","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Zhang, J.","Effect of pressure on the thermal expansion of MgO up to 8.2 GPa Sample: Run3 at T = 373 K, P = 8.24 GPa","Physics and Chemistry of Minerals","2000","27","","145","148","10.1007/s002690050001","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006810","4.1515","","4.1515","","4.1515","","90","","90","","90","","71.551","","","","473","","","","8210000","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Zhang, J.","Effect of pressure on the thermal expansion of MgO up to 8.2 GPa Sample: Run3 at T = 473 K, P = 8.21 GPa","Physics and Chemistry of Minerals","2000","27","","145","148","10.1007/s002690050001","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006811","4.1559","","4.1559","","4.1559","","90","","90","","90","","71.779","","","","573","","","","8250000","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Zhang, J.","Effect of pressure on the thermal expansion of MgO up to 8.2 GPa Sample: Run3 at T = 573 K, P = 8.25 GPa","Physics and Chemistry of Minerals","2000","27","","145","148","10.1007/s002690050001","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006812","4.1605","","4.1605","","4.1605","","90","","90","","90","","72.017","","","","673","","","","8200000","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Zhang, J.","Effect of pressure on the thermal expansion of MgO up to 8.2 GPa Sample: Run3 at T = 673 K, P = 8.20 GPa","Physics and Chemistry of Minerals","2000","27","","145","148","10.1007/s002690050001","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006813","4.1655","","4.1655","","4.1655","","90","","90","","90","","72.277","","","","773","","","","8200000","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Zhang, J.","Effect of pressure on the thermal expansion of MgO up to 8.2 GPa Sample: Run3 at T = 773 K, P = 8.20 GPa","Physics and Chemistry of Minerals","2000","27","","145","148","10.1007/s002690050001","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006814","4.1693","","4.1693","","4.1693","","90","","90","","90","","72.475","","","","873","","","","8190000","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Zhang, J.","Effect of pressure on the thermal expansion of MgO up to 8.2 GPa Sample: Run3 at T = 873 K, P = 8.19 GPa","Physics and Chemistry of Minerals","2000","27","","145","148","10.1007/s002690050001","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006815","4.1752","","4.1752","","4.1752","","90","","90","","90","","72.783","","","","973","","","","8210000","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Zhang, J.","Effect of pressure on the thermal expansion of MgO up to 8.2 GPa Sample: Run3 at T = 973 K, P = 8.21 GPa","Physics and Chemistry of Minerals","2000","27","","145","148","10.1007/s002690050001","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006816","4.1789","","4.1789","","4.1789","","90","","90","","90","","72.977","","","","1073","","","","8190000","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Zhang, J.","Effect of pressure on the thermal expansion of MgO up to 8.2 GPa Sample: Run3 at T = 1073 K, P = 8.19 GPa","Physics and Chemistry of Minerals","2000","27","","145","148","10.1007/s002690050001","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006817","8.2891","","8.2891","","8.2891","","90","","90","","90","","569.537","","","","","","","","","","quenched from T = 1402 C","","Synthetic","3","F d -3 m :2","-F 4vw 2vw 3","227","","","","- Ga2 Mg O4 -","- Ga2 Mg O4 -","- Ga16 Mg8 O32 -","8","0.0416667","","Millard, R. L.; Peterson, R. C.; Swainson, I. P.","Synthetic MgGa2O4-Mg2GeO4 spinel solid solution and beta-Mg3Ga2GeO8: chemistry, crystal structures, cation ordering, and comparison to Mg2GeO4 olivine Sample: RLM808, quenched from T = 1402 C Locality: synthetic","Physics and Chemistry of Minerals","2000","27","","179","193","10.1007/s002690050006","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006818","8.2984","","8.2984","","8.2984","","90","","90","","90","","571.456","","","","","","","","","","quenched from T = 1402 C","","Synthetic","4","F d -3 m :2","-F 4vw 2vw 3","227","","","","- Ga1.8 Ge0.1 Mg1.1 O4 -","- Ga1.8 Ge0.1 Mg1.1 O4 -","- Ga14.4 Ge0.8 Mg8.8 O32 -","8","0.0416667","","Millard, R. L.; Peterson, R. C.; Swainson, I. P.","Synthetic MgGa2O4-Mg2GeO4 spinel solid solution and beta-Mg3Ga2GeO8: chemistry, crystal structures, cation ordering, and comparison to Mg2GeO4 olivine Sample: RLM801, quenched from T = 1402 C Locality: synthetic","Physics and Chemistry of Minerals","2000","27","","179","193","10.1007/s002690050006","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006819","8.3007","","8.3007","","8.3007","","90","","90","","90","","571.932","","","","","","","","","","quenched from T = 1401 C","","Synthetic","4","F d -3 m :2","-F 4vw 2vw 3","227","","","","- Ga1.6 Ge0.2 Mg1.2 O4 -","- Ga1.6 Ge0.2 Mg1.2 O4 -","- Ga12.8 Ge1.6 Mg9.6 O32 -","8","0.0416667","","Millard, R. L.; Peterson, R. C.; Swainson, I. P.","Synthetic MgGa2O4-Mg2GeO4 spinel solid solution and beta-Mg3Ga2GeO8: chemistry, crystal structures, cation ordering, and comparison to Mg2GeO4 olivine Sample: RLM802, quenched from T = 1401 C Locality: synthetic","Physics and Chemistry of Minerals","2000","27","","179","193","10.1007/s002690050006","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006820","8.3026","","8.3026","","8.3026","","90","","90","","90","","572.325","","","","","","","","","","quenched from T = 1400 C","","Synthetic","4","F d -3 m :2","-F 4vw 2vw 3","227","","","","- Ga1.5 Ge0.25 Mg1.25 O4 -","- Ga1.5 Ge0.25 Mg1.25 O4 -","- Ga12 Ge2 Mg10 O32 -","8","0.0416667","","Millard, R. L.; Peterson, R. C.; Swainson, I. P.","Synthetic MgGa2O4-Mg2GeO4 spinel solid solution and beta-Mg3Ga2GeO8: chemistry, crystal structures, cation ordering, and comparison to Mg2GeO4 olivine Sample: RLM813, quenched from T = 1400 C Locality: synthetic","Physics and Chemistry of Minerals","2000","27","","179","193","10.1007/s002690050006","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006821","5.8236","","11.8162","","8.3304","","90","","90","","90","","573.238","","","","","","","","","","quenched from T = 1350 C","","Synthetic","4","I m m a","-I 2b 2","74","","","","- Ga Ge0.5 Mg1.5 O4 -","- Ga Ge0.5 Mg1.5 O4 -","- Ga8 Ge4 Mg12 O32 -","8","0.5","","Millard, R. L.; Peterson, R. C.; Swainson, I. P.","Synthetic MgGa2O4-Mg2GeO4 spinel solid solution and beta-Mg3Ga2GeO8: chemistry, crystal structures, cation ordering, and comparison to Mg2GeO4 olivine Sample: RLM812, beta-Mg3Ga2GeO8 spinelloid, quenched from T = 1350 C","Physics and Chemistry of Minerals","2000","27","","179","193","10.1007/s002690050006","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006822","7.8563","","7.8563","","9.5642","","90","","90","","120","","511.229","","","","","","","","0","","","","","4","P 63","P 6c","173","","","","- H6 Mg7 O14 Si2 -","- H6 Mg7 O14 Si2 -","- H12 Mg14 O28 Si4 -","2","0.333333","","Kagi, H.; Parise, J. B.; Cho, H.; Rossman, G. R.; Loveday, J. S.","Hydrogen bonding interactions in phase A [Mg7Si2O8(OH)6] at ambient and high pressure Sample: P = 0 GPa","Physics and Chemistry of Minerals","2000","27","","225","233","10.1007/s002690050251","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006823","7.7972","","7.7972","","9.5071","","90","","90","","120","","500.56","","","","","","","","3200000","","","","","4","P 63","P 6c","173","","","","- H6 Mg7 O14 Si2 -","- H6 Mg7 O14 Si2 -","- H12 Mg14 O28 Si4 -","2","0.333333","","Kagi, H.; Parise, J. B.; Cho, H.; Rossman, G. R.; Loveday, J. S.","Hydrogen bonding interactions in phase A [Mg7Si2O8(OH)6] at ambient and high pressure Sample: P = 3.2 GPa","Physics and Chemistry of Minerals","2000","27","","225","233","10.1007/s002690050251","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006824","4.7564","","10.2283","","5.9696","","90","","90","","90","","290.42","","","","","","","","","","","","","5","P b n m","-P 2c 2ab","62","","","","- Co0.754 Ni0.792 O4 Si Zn0.454 -","- Co0.754 Ni0.792 O4 Si Zn0.454 -","- Co3.016 Ni3.168 O16 Si4 Zn1.816 -","4","0.5","","Tsukimura, K.; Sasaki, S.","Determination of cation distribution in (Co,Ni,Zn)2Si04 olivine by synchrotron X-ray diffraction","Physics and Chemistry of Minerals","2000","27","","234","241","10.1007/s002690050252","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006825","5.14","","8.911","","19.38","","90","","94.62","","90","","884.769","","","","298.15","","","","","","","","","12","C 1 2/c 1","-C 2yc","15","","","Paragonite","- Al3.07 Ba0.01 Ca0.01 Fe0.01 H2 K0.07 Mg0.02 Mn0.001 Na0.91 O12 Si2.92 Ti0.005 -","- Al3.07 Ba0.01 Ca0.01 Fe0.01 H2 K0.07 Mg0.02 Mn0.001 Na0.91 O12 Si2.92 Ti0.005 -","- Al12.28 Ba0.04 Ca0.04 Fe0.04 H8 K0.28 Mg0.08 Mn0.004 Na3.64 O48 Si11.68 Ti0.02 -","4","0.5","","Comodi, P.; Zanazzi, P. F.","Structural thermal behavior of paragonite and its dehydroxylate: a high-temperature single-crystal study Sample 2: T = 25 C","Physics and Chemistry of Minerals","2000","27","","377","385","10.1007/s002690000085","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006826","5.152","","8.941","","19.459","","90","","94.26","","90","","893.884","","","","483.15","","","","","","","","","12","C 1 2/c 1","-C 2yc","15","","","Paragonite","- Al3.07 Ba0.01 Ca0.01 Fe0.01 H2 K0.07 Mg0.02 Mn0.001 Na0.91 O12 Si2.92 Ti0.005 -","- Al3.07 Ba0.01 Ca0.01 Fe0.01 H2 K0.07 Mg0.02 Mn0.001 Na0.91 O12 Si2.92 Ti0.005 -","- Al12.28 Ba0.04 Ca0.04 Fe0.04 H8 K0.28 Mg0.08 Mn0.004 Na3.64 O48 Si11.68 Ti0.02 -","4","0.5","","Comodi, P.; Zanazzi, P. F.","Structural thermal behavior of paragonite and its dehydroxylate: a high-temperature single-crystal study Sample 2: T = 210 C","Physics and Chemistry of Minerals","2000","27","","377","385","10.1007/s002690000085","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006827","5.173","","8.985","","19.553","","90","","93.58","","90","","907.038","","","","723.15","","","","","","","","","12","C 1 2/c 1","-C 2yc","15","","","Paragonite","- Al3.07 Ba0.01 Ca0.01 Fe0.01 H2 K0.07 Mg0.02 Mn0.001 Na0.91 O12 Si2.92 Ti0.005 -","- Al3.07 Ba0.01 Ca0.01 Fe0.01 H2 K0.07 Mg0.02 Mn0.001 Na0.91 O12 Si2.92 Ti0.005 -","- Al12.28 Ba0.04 Ca0.04 Fe0.04 H8 K0.28 Mg0.08 Mn0.004 Na3.64 O48 Si11.68 Ti0.02 -","4","0.5","","Comodi, P.; Zanazzi, P. F.","Structural thermal behavior of paragonite and its dehydroxylate: a high-temperature single-crystal study Sample 2: T = 450 C","Physics and Chemistry of Minerals","2000","27","","377","385","10.1007/s002690000085","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006828","5.19","","9.011","","19.603","","90","","92.96","","90","","915.552","","","","873.15","","","","","","","","","12","C 1 2/c 1","-C 2yc","15","","","Paragonite","- Al3.07 Ba0.01 Ca0.01 Fe0.01 H2 K0.07 Mg0.02 Mn0.001 Na0.91 O12 Si2.92 Ti0.005 -","- Al3.07 Ba0.01 Ca0.01 Fe0.01 H2 K0.07 Mg0.02 Mn0.001 Na0.91 O12 Si2.92 Ti0.005 -","- Al12.28 Ba0.04 Ca0.04 Fe0.04 H8 K0.28 Mg0.08 Mn0.004 Na3.64 O48 Si11.68 Ti0.02 -","4","0.5","","Comodi, P.; Zanazzi, P. F.","Structural thermal behavior of paragonite and its dehydroxylate: a high-temperature single-crystal study Sample 2: T = 600 C","Physics and Chemistry of Minerals","2000","27","","377","385","10.1007/s002690000085","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:46",""
"9006829","5.182","","9.117","","19.55","","90","","92.7","","90","","922.601","","","","298.15","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- Al3 Na O11 Si3 -","- Al3 Na O11 Si3 -","- Al12 Na4 O44 Si12 -","4","0.5","","Comodi, P.; Zanazzi, P. F.","Structural thermal behavior of paragonite and its dehydroxylate: a high-temperature single-crystal study Sample: Dehydroxylate phase at T = 25 C","Physics and Chemistry of Minerals","2000","27","","377","385","10.1007/s002690000085","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:47",""
"9006830","7.3294","","7.4921","","7.4148","","90","","118.43","","90","","358.061","","","","298","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","Barbosalite","- Fe3 H2 O10 P2 -","- Fe3 H2 O10 P2 -","- Fe6 H4 O20 P4 -","2","0.5","","Redhammer, G. J.; Tippelt, G.; Roth, G.; Lottermoser, W.; Amthauer, G.","Structure and Mossbauer spectroscopy of barbosalite Fe2+Fe3+2(PO4)2(OH)2 between 80 K and 300 K Sample: T = 298 K","Physics and Chemistry of Minerals","2000","27","","419","429","10.1007/s002699900078","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006831","7.3065","","7.5026","","7.4105","","90","","118.49","","90","","357.033","","","","110","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","Barbosalite","- Fe3 H2 O10 P2 -","- Fe3 H2 O10 P2 -","- Fe6 H4 O20 P4 -","2","0.5","","Redhammer, G. J.; Tippelt, G.; Roth, G.; Lottermoser, W.; Amthauer, G.","Structure and Mossbauer spectroscopy of barbosalite Fe2+Fe3+2(PO4)2(OH)2 between 80 K and 300 K Sample: T = 110 K","Physics and Chemistry of Minerals","2000","27","","419","429","10.1007/s002699900078","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006832","3.5682","","3.5682","","4.8625","","90","","90","","120","","53.615","","","","","","","","500000","","","","","3","P -3 m 1","-P 3 2""","164","","","Portlandite","- Ca H2 O2 -","- Ca H2 O2 -","- Ca H2 O2 -","1","0.0833333","","Nagai, T.; Ito, T.; Hattori, T.; Yamanaka, T.","Compression mechanism and amorphization of portlandite, Ca(OH)2: structural refinement under pressure Sample: P = 0.5 GPa","Physics and Chemistry of Minerals","2000","27","","462","466","10.1007/s002690000084","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:46",""
"9006833","3.5338","","3.5338","","4.712","","90","","90","","120","","50.959","","","","","","","","2400000","","","","","3","P -3 m 1","-P 3 2""","164","","","Portlandite","- Ca H2 O2 -","- Ca H2 O2 -","- Ca H2 O2 -","1","0.0833333","","Nagai, T.; Ito, T.; Hattori, T.; Yamanaka, T.","Compression mechanism and amorphization of portlandite, Ca(OH)2: structural refinement under pressure Sample: P = 2.4 GPa","Physics and Chemistry of Minerals","2000","27","","462","466","10.1007/s002690000084","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:46",""
"9006834","3.5104","","3.5104","","4.6294","","90","","90","","120","","49.405","","","","","","","","4300000","","","","","3","P -3 m 1","-P 3 2""","164","","","Portlandite","- Ca H2 O2 -","- Ca H2 O2 -","- Ca H2 O2 -","1","0.0833333","","Nagai, T.; Ito, T.; Hattori, T.; Yamanaka, T.","Compression mechanism and amorphization of portlandite, Ca(OH)2: structural refinement under pressure Sample: P = 4.3 GPa","Physics and Chemistry of Minerals","2000","27","","462","466","10.1007/s002690000084","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:46",""
"9006835","3.4806","","3.4806","","4.5352","","90","","90","","120","","47.581","","","","","","","","6300000","","","","","3","P -3 m 1","-P 3 2""","164","","","Portlandite","- Ca H2 O2 -","- Ca H2 O2 -","- Ca H2 O2 -","1","0.0833333","","Nagai, T.; Ito, T.; Hattori, T.; Yamanaka, T.","Compression mechanism and amorphization of portlandite, Ca(OH)2: structural refinement under pressure Sample: P = 6.3 GPa","Physics and Chemistry of Minerals","2000","27","","462","466","10.1007/s002690000084","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:46",""
"9006836","3.4575","","3.4575","","4.451","","90","","90","","120","","46.08","","","","","","","","8100000","","","","","3","P -3 m 1","-P 3 2""","164","","","Portlandite","- Ca H2 O2 -","- Ca H2 O2 -","- Ca H2 O2 -","1","0.0833333","","Nagai, T.; Ito, T.; Hattori, T.; Yamanaka, T.","Compression mechanism and amorphization of portlandite, Ca(OH)2: structural refinement under pressure Sample: P = 8.1 GPa","Physics and Chemistry of Minerals","2000","27","","462","466","10.1007/s002690000084","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:46",""
"9006837","3.442","","3.442","","4.4053","","90","","90","","120","","45.199","","","","","","","","9700000","","","","","3","P -3 m 1","-P 3 2""","164","","","Portlandite","- Ca H2 O2 -","- Ca H2 O2 -","- Ca H2 O2 -","1","0.0833333","","Nagai, T.; Ito, T.; Hattori, T.; Yamanaka, T.","Compression mechanism and amorphization of portlandite, Ca(OH)2: structural refinement under pressure Sample: P = 9.7 GPa","Physics and Chemistry of Minerals","2000","27","","462","466","10.1007/s002690000084","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:46",""
"9006838","5.316","","8.892","","6.428","","90","","90","","90","","303.851","","","","","","","","0","","","","","3","P m c n","-P 2n 2a","62","","","Witherite","- C Ba O3 -","- C Ba O3 -","- C4 Ba4 O12 -","4","0.5","","Holl, C. M.; Smyth, J. R.; Laustsen, H. M. S.; Jacobsen, S. D.; Downs, R. T.","Compression of witherite to 8 GPa and the crystal structure of BaCO3 II Sample: P = 0.00 GPa","Physics and Chemistry of Minerals","2000","27","","467","473","10.1007/s002690000087","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006839","5.3","","8.868","","6.318","","90","","90","","90","","296.949","","","","","","","","1260000","","","","","3","P m c n","-P 2n 2a","62","","","Witherite","- C Ba O3 -","- C Ba O3 -","- C4 Ba4 O12 -","4","0.5","","Holl, C. M.; Smyth, J. R.; Laustsen, H. M. S.; Jacobsen, S. D.; Downs, R. T.","Compression of witherite to 8 GPa and the crystal structure of BaCO3 II Sample: P = 1.26 GPa","Physics and Chemistry of Minerals","2000","27","","467","473","10.1007/s002690000087","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006840","5.292","","8.856","","6.246","","90","","90","","90","","292.725","","","","","","","","1980000","","","","","3","P m c n","-P 2n 2a","62","","","Witherite","- C Ba O3 -","- C Ba O3 -","- C4 Ba4 O12 -","4","0.5","","Holl, C. M.; Smyth, J. R.; Laustsen, H. M. S.; Jacobsen, S. D.; Downs, R. T.","Compression of witherite to 8 GPa and the crystal structure of BaCO3 II Sample: P = 1.98 GPa","Physics and Chemistry of Minerals","2000","27","","467","473","10.1007/s002690000087","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006841","5.282","","8.843","","6.148","","90","","90","","90","","287.165","","","","","","","","2950000","","","","","3","P m c n","-P 2n 2a","62","","","Witherite","- C Ba O3 -","- C Ba O3 -","- C4 Ba4 O12 -","4","0.5","","Holl, C. M.; Smyth, J. R.; Laustsen, H. M. S.; Jacobsen, S. D.; Downs, R. T.","Compression of witherite to 8 GPa and the crystal structure of BaCO3 II Sample: P = 2.95 GPa","Physics and Chemistry of Minerals","2000","27","","467","473","10.1007/s002690000087","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006842","5.274","","8.838","","6.06","","90","","90","","90","","282.466","","","","","","","","3940000","","","","","3","P m c n","-P 2n 2a","62","","","Witherite","- C Ba O3 -","- C Ba O3 -","- C4 Ba4 O12 -","4","0.5","","Holl, C. M.; Smyth, J. R.; Laustsen, H. M. S.; Jacobsen, S. D.; Downs, R. T.","Compression of witherite to 8 GPa and the crystal structure of BaCO3 II Sample: P = 3.94 GPa","Physics and Chemistry of Minerals","2000","27","","467","473","10.1007/s002690000087","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006843","5.269","","8.838","","5.999","","90","","90","","90","","279.358","","","","","","","","4560000","","","","","3","P m c n","-P 2n 2a","62","","","Witherite","- C Ba O3 -","- C Ba O3 -","- C4 Ba4 O12 -","4","0.5","","Holl, C. M.; Smyth, J. R.; Laustsen, H. M. S.; Jacobsen, S. D.; Downs, R. T.","Compression of witherite to 8 GPa and the crystal structure of BaCO3 II Sample: P = 4.56 GPa","Physics and Chemistry of Minerals","2000","27","","467","473","10.1007/s002690000087","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006844","5.26","","8.846","","5.895","","90","","90","","90","","274.294","","","","","","","","5500000","","","","","3","P m c n","-P 2n 2a","62","","","Witherite","- C Ba O3 -","- C Ba O3 -","- C4 Ba4 O12 -","4","0.5","","Holl, C. M.; Smyth, J. R.; Laustsen, H. M. S.; Jacobsen, S. D.; Downs, R. T.","Compression of witherite to 8 GPa and the crystal structure of BaCO3 II Sample: P = 5.50 GPa","Physics and Chemistry of Minerals","2000","27","","467","473","10.1007/s002690000087","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006845","5.255","","8.852","","5.838","","90","","90","","90","","271.568","","","","","","","","6200000","","","","","3","P m c n","-P 2n 2a","62","","","Witherite","- C Ba O3 -","- C Ba O3 -","- C4 Ba4 O12 -","4","0.5","","Holl, C. M.; Smyth, J. R.; Laustsen, H. M. S.; Jacobsen, S. D.; Downs, R. T.","Compression of witherite to 8 GPa and the crystal structure of BaCO3 II Sample: P = 6.20 GPa","Physics and Chemistry of Minerals","2000","27","","467","473","10.1007/s002690000087","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006846","5.251","","8.868","","5.762","","90","","90","","90","","268.313","","","","","","","","7050000","","","","","3","P m c n","-P 2n 2a","62","","","Witherite","- C Ba O3 -","- C Ba O3 -","- C4 Ba4 O12 -","4","0.5","","Holl, C. M.; Smyth, J. R.; Laustsen, H. M. S.; Jacobsen, S. D.; Downs, R. T.","Compression of witherite to 8 GPa and the crystal structure of BaCO3 II Sample: P = 7.05 GPa","Physics and Chemistry of Minerals","2000","27","","467","473","10.1007/s002690000087","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006847","5.258","","5.258","","5.64","","90","","90","","120","","135.036","","","","","","","","7200000","","","","","3","P -3 1 c","-P 3 2c","163","","","Witherite","- C Ba O3 -","- C0.5 Ba0.5 O1.5 -","- C2 Ba2 O6 -","4","0.333333","","Holl, C. M.; Smyth, J. R.; Laustsen, H. M. S.; Jacobsen, S. D.; Downs, R. T.","Compression of witherite to 8 GPa and the crystal structure of BaCO3 II Sample: P = 7.2 GPa","Physics and Chemistry of Minerals","2000","27","","467","473","10.1007/s002690000087","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006848","8.0693","","8.0693","","8.0693","","90","","90","","90","","525.421","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","","Ringwoodite","- H0.3 Mg1.89 O4 Si0.98 -","- Mg1.89 O4 Si0.98 -","- Mg15.12 O32 Si7.84 -","8","0.0416667","","Kudoh, Y.; Kuribayashi, T.; Mizobata, H.; Ohtami, E.","Structure and cation disorder of hydrous ringwoodite, gamma-Mg1.89Si0.98H0.30O4","Physics and Chemistry of Minerals","2000","27","","474","479","10.1007/s002690000091","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006849","4.3966","","4.3966","","2.8626","","90","","90","","90","","55.334","","","","","","","","0","","","","","2","P 42/m n m","-P 4n 2n","136","","","Argutite","- Ge O2 -","- Ge O2 -","- Ge2 O4 -","2","0.125","","Haines, J.; Leger, J. M.; Chateau, C.; Pereira, A. S.","Structural evolution of rutile-type and CaCl2-type germanium dioxide at high pressure Sample: rutile-type, P = 0 GPa","Physics and Chemistry of Minerals","2000","27","","575","582","10.1007/s002690000092","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006850","4.3751","","4.3751","","2.8511","","90","","90","","90","","54.574","","","","","","","","4200000","","","","","2","P 42/m n m","-P 4n 2n","136","","","Argutite","- Ge O2 -","- Ge O2 -","- Ge2 O4 -","2","0.125","","Haines, J.; Leger, J. M.; Chateau, C.; Pereira, A. S.","Structural evolution of rutile-type and CaCl2-type germanium dioxide at high pressure Sample: rutile-type, P = 4.2 GPa","Physics and Chemistry of Minerals","2000","27","","575","582","10.1007/s002690000092","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006851","4.3553","","4.3553","","2.8463","","90","","90","","90","","53.99","","","","","","","","6200000","","","","","2","P 42/m n m","-P 4n 2n","136","","","Argutite","- Ge O2 -","- Ge O2 -","- Ge2 O4 -","2","0.125","","Haines, J.; Leger, J. M.; Chateau, C.; Pereira, A. S.","Structural evolution of rutile-type and CaCl2-type germanium dioxide at high pressure Sample: rutile-type, P = 6.2 GPa","Physics and Chemistry of Minerals","2000","27","","575","582","10.1007/s002690000092","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006852","4.3417","","4.3417","","2.8407","","90","","90","","90","","53.548","","","","","","","","8900000","","","","","2","P 42/m n m","-P 4n 2n","136","","","Argutite","- Ge O2 -","- Ge O2 -","- Ge2 O4 -","2","0.125","","Haines, J.; Leger, J. M.; Chateau, C.; Pereira, A. S.","Structural evolution of rutile-type and CaCl2-type germanium dioxide at high pressure Sample: rutile-type, P = 8.9 GPa","Physics and Chemistry of Minerals","2000","27","","575","582","10.1007/s002690000092","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006853","4.334","","4.334","","2.8376","","90","","90","","90","","53.3","","","","","","","","10400000","","","","","2","P 42/m n m","-P 4n 2n","136","","","Argutite","- Ge O2 -","- Ge O2 -","- Ge2 O4 -","2","0.125","","Haines, J.; Leger, J. M.; Chateau, C.; Pereira, A. S.","Structural evolution of rutile-type and CaCl2-type germanium dioxide at high pressure Sample: rutile-type, P = 10.4 GPa","Physics and Chemistry of Minerals","2000","27","","575","582","10.1007/s002690000092","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006854","4.3349","","4.3349","","2.8424","","90","","90","","90","","53.413","","","","","","","","10500000","","","","","2","P 42/m n m","-P 4n 2n","136","","","Argutite","- Ge O2 -","- Ge O2 -","- Ge2 O4 -","2","0.125","","Haines, J.; Leger, J. M.; Chateau, C.; Pereira, A. S.","Structural evolution of rutile-type and CaCl2-type germanium dioxide at high pressure Sample: rutile-type, P = 10.5 GPa","Physics and Chemistry of Minerals","2000","27","","575","582","10.1007/s002690000092","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006855","4.298","","4.298","","2.8295","","90","","90","","90","","52.269","","","","","","","","16100000","","","","","2","P 42/m n m","-P 4n 2n","136","","","Argutite","- Ge O2 -","- Ge O2 -","- Ge2 O4 -","2","0.125","","Haines, J.; Leger, J. M.; Chateau, C.; Pereira, A. S.","Structural evolution of rutile-type and CaCl2-type germanium dioxide at high pressure Sample: rutile-type, P = 16.1 GPa","Physics and Chemistry of Minerals","2000","27","","575","582","10.1007/s002690000092","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006856","4.2835","","4.2835","","2.8193","","90","","90","","90","","51.73","","","","","","","","20300000","","","","","2","P 42/m n m","-P 4n 2n","136","","","Argutite","- Ge O2 -","- Ge O2 -","- Ge2 O4 -","2","0.125","","Haines, J.; Leger, J. M.; Chateau, C.; Pereira, A. S.","Structural evolution of rutile-type and CaCl2-type germanium dioxide at high pressure Sample: rutile-type, P = 20.3 GPa","Physics and Chemistry of Minerals","2000","27","","575","582","10.1007/s002690000092","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006857","4.263","","4.263","","2.8148","","90","","90","","90","","51.154","","","","","","","","25000000","","","","","2","P 42/m n m","-P 4n 2n","136","","","Argutite","- Ge O2 -","- Ge O2 -","- Ge2 O4 -","2","0.125","","Haines, J.; Leger, J. M.; Chateau, C.; Pereira, A. S.","Structural evolution of rutile-type and CaCl2-type germanium dioxide at high pressure Sample: rutile-type, P = 25 GPa","Physics and Chemistry of Minerals","2000","27","","575","582","10.1007/s002690000092","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006858","4.2841","","4.2098","","2.8089","","90","","90","","90","","50.659","","","","","","","","28000000","","","","","2","P n n m","-P 2 2n","58","","","","- Ge O2 -","- Ge O2 -","- Ge2 O4 -","2","0.25","","Haines, J.; Leger, J. M.; Chateau, C.; Pereira, A. S.","Structural evolution of rutile-type and CaCl2-type germanium dioxide at high pressure Sample: CaCl2-type, post-argutite, P = 28 GPa","Physics and Chemistry of Minerals","2000","27","","575","582","10.1007/s002690000092","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006859","4.2852","","4.1959","","2.8062","","90","","90","","90","","50.456","","","","","","","","29000000","","","","","2","P n n m","-P 2 2n","58","","","","- Ge O2 -","- Ge O2 -","- Ge2 O4 -","2","0.25","","Haines, J.; Leger, J. M.; Chateau, C.; Pereira, A. S.","Structural evolution of rutile-type and CaCl2-type germanium dioxide at high pressure Sample: CaCl2-type, post-argutite, P = 29 GPa","Physics and Chemistry of Minerals","2000","27","","575","582","10.1007/s002690000092","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006860","4.2866","","4.1742","","2.7995","","90","","90","","90","","50.092","","","","","","","","32000000","","","","","2","P n n m","-P 2 2n","58","","","","- Ge O2 -","- Ge O2 -","- Ge2 O4 -","2","0.25","","Haines, J.; Leger, J. M.; Chateau, C.; Pereira, A. S.","Structural evolution of rutile-type and CaCl2-type germanium dioxide at high pressure Sample: CaCl2-type, post-argutite, P = 32 GPa","Physics and Chemistry of Minerals","2000","27","","575","582","10.1007/s002690000092","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006861","4.2834","","4.1508","","2.7941","","90","","90","","90","","49.678","","","","","","","","35000000","","","","","2","P n n m","-P 2 2n","58","","","","- Ge O2 -","- Ge O2 -","- Ge2 O4 -","2","0.25","","Haines, J.; Leger, J. M.; Chateau, C.; Pereira, A. S.","Structural evolution of rutile-type and CaCl2-type germanium dioxide at high pressure Sample: CaCl2-type, post-argutite, P = 35 GPa Note: O y-coordinate altered from the reported value","Physics and Chemistry of Minerals","2000","27","","575","582","10.1007/s002690000092","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006862","4.2814","","4.1424","","2.7919","","90","","90","","90","","49.515","","","","","","","","36000000","","","","","2","P n n m","-P 2 2n","58","","","","- Ge O2 -","- Ge O2 -","- Ge2 O4 -","2","0.25","","Haines, J.; Leger, J. M.; Chateau, C.; Pereira, A. S.","Structural evolution of rutile-type and CaCl2-type germanium dioxide at high pressure Sample: CaCl2-type, post-argutite, P = 36 GPa","Physics and Chemistry of Minerals","2000","27","","575","582","10.1007/s002690000092","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006863","5.49755","","5.49755","","7.7881","","90","","90","","90","","235.38","","","","","","","","","","","","","5","I 4/m c m","-I 4 2c","140","","","Tausonite","- La0.25 Na0.25 O3 Sr0.5 Ti -","- La0.25 Na0.25 O3 Sr0.5 Ti -","- La Na O12 Sr2 Ti4 -","4","0.125","","Mitchell, R. H.; Chakhmouradian, A. R.; Woodward, P. M.","Crystal chemistry of perovskite-type compounds in the tausonite-loparite series, (Sr1-2xNaxLax)TiO3 Sample: synchrotron XRD data","Physics and Chemistry of Minerals","2000","27","","583","589","10.1007/s002690000103","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006864","3.90528","","3.90528","","3.90528","","90","","90","","90","","59.56","","","","","","","","","","","","","3","P m -3 m","-P 4 2 3","221","","","Tausonite","- O3 Sr Ti -","- O3 Sr Ti -","- O3 Sr Ti -","1","0.0208333","","Mitchell, R. H.; Chakhmouradian, A. R.; Woodward, P. M.","Crystal chemistry of perovskite-type compounds in the tausonite-loparite series, (Sr1-2xNaxLax)TiO3 Sample: x = 0.00","Physics and Chemistry of Minerals","2000","27","","583","589","10.1007/s002690000103","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006865","3.90427","","3.90427","","3.90427","","90","","90","","90","","59.514","","","","","","","","","","","","","5","P m -3 m","-P 4 2 3","221","","","Tausonite","- La0.05 Na0.05 O3 Sr0.9 Ti -","- La0.05 Na0.05 O3 Sr0.9 Ti -","- La0.05 Na0.05 O3 Sr0.9 Ti -","1","0.0208333","","Mitchell, R. H.; Chakhmouradian, A. R.; Woodward, P. M.","Crystal chemistry of perovskite-type compounds in the tausonite-loparite series, (Sr1-2xNaxLax)TiO3 Sample: x = 0.05","Physics and Chemistry of Minerals","2000","27","","583","589","10.1007/s002690000103","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006866","3.9017","","3.9017","","3.9017","","90","","90","","90","","59.397","","","","","","","","","","","","","5","P m -3 m","-P 4 2 3","221","","","Tausonite","- La0.1 Na0.1 O3 Sr0.8 Ti -","- La0.1 Na0.1 O3 Sr0.8 Ti -","- La0.1 Na0.1 O3 Sr0.8 Ti -","1","0.0208333","","Mitchell, R. H.; Chakhmouradian, A. R.; Woodward, P. M.","Crystal chemistry of perovskite-type compounds in the tausonite-loparite series, (Sr1-2xNaxLax)TiO3 Sample: x = 0.10","Physics and Chemistry of Minerals","2000","27","","583","589","10.1007/s002690000103","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006867","5.5116","","5.5116","","7.8036","","90","","90","","90","","237.056","","","","","","","","","","","","","5","I 4/m c m","-I 4 2c","140","","","Tausonite","- La0.15 Na0.15 O3 Sr0.7 Ti -","- La0.15 Na0.15 O3 Sr0.7 Ti -","- La0.6 Na0.6 O12 Sr2.8 Ti4 -","4","0.125","","Mitchell, R. H.; Chakhmouradian, A. R.; Woodward, P. M.","Crystal chemistry of perovskite-type compounds in the tausonite-loparite series, (Sr1-2xNaxLax)TiO3 Sample: x = 0.15","Physics and Chemistry of Minerals","2000","27","","583","589","10.1007/s002690000103","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006868","5.5073","","5.5073","","7.8018","","90","","90","","90","","236.631","","","","","","","","","","","","","5","I 4/m c m","-I 4 2c","140","","","Tausonite","- La0.2 Na0.2 O3 Sr0.6 Ti -","- La0.2 Na0.2 O3 Sr0.6 Ti -","- La0.8 Na0.8 O12 Sr2.4 Ti4 -","4","0.125","","Mitchell, R. H.; Chakhmouradian, A. R.; Woodward, P. M.","Crystal chemistry of perovskite-type compounds in the tausonite-loparite series, (Sr1-2xNaxLax)TiO3 Sample: x = 0.20","Physics and Chemistry of Minerals","2000","27","","583","589","10.1007/s002690000103","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006869","5.5016","","5.5016","","7.7976","","90","","90","","90","","236.015","","","","","","","","","","","","","5","I 4/m c m","-I 4 2c","140","","","Tausonite","- La0.25 Na0.25 O3 Sr0.5 Ti -","- La0.25 Na0.25 O3 Sr0.5 Ti -","- La Na O12 Sr2 Ti4 -","4","0.125","","Mitchell, R. H.; Chakhmouradian, A. R.; Woodward, P. M.","Crystal chemistry of perovskite-type compounds in the tausonite-loparite series, (Sr1-2xNaxLax)TiO3 Sample: x = 0.25","Physics and Chemistry of Minerals","2000","27","","583","589","10.1007/s002690000103","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006870","5.5025","","5.5025","","7.7701","","90","","90","","90","","235.259","","","","","","","","","","","","","5","I 4/m c m","-I 4 2c","140","","","Loparite","- La0.3 Na0.3 O3 Sr0.4 Ti -","- La0.3 Na0.3 O3 Sr0.4 Ti -","- La1.2 Na1.2 O12 Sr1.6 Ti4 -","4","0.125","","Mitchell, R. H.; Chakhmouradian, A. R.; Woodward, P. M.","Crystal chemistry of perovskite-type compounds in the tausonite-loparite series, (Sr1-2xNaxLax)TiO3 Sample: x = 0.30","Physics and Chemistry of Minerals","2000","27","","583","589","10.1007/s002690000103","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006871","5.4912","","5.4912","","7.7839","","90","","90","","90","","234.71","","","","","","","","","","","","","5","I 4/m c m","-I 4 2c","140","","","Loparite","- La0.35 Na0.35 O3 Sr0.3 Ti -","- La0.35 Na0.35 O3 Sr0.3 Ti -","- La1.4 Na1.4 O12 Sr1.2 Ti4 -","4","0.125","","Mitchell, R. H.; Chakhmouradian, A. R.; Woodward, P. M.","Crystal chemistry of perovskite-type compounds in the tausonite-loparite series, (Sr1-2xNaxLax)TiO3 Sample: x = 0.35","Physics and Chemistry of Minerals","2000","27","","583","589","10.1007/s002690000103","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006872","5.4882","","5.4882","","13.442","","90","","90","","120","","350.634","","","","","","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","","Loparite","- La0.4 Na0.4 O3 Sr0.2 Ti -","- La0.4 Na0.4 O3 Sr0.2 Ti -","- La2.4 Na2.4 O18 Sr1.2 Ti6 -","6","0.166667","","Mitchell, R. H.; Chakhmouradian, A. R.; Woodward, P. M.","Crystal chemistry of perovskite-type compounds in the tausonite-loparite series, (Sr1-2xNaxLax)TiO3 Sample: x = 0.40","Physics and Chemistry of Minerals","2000","27","","583","589","10.1007/s002690000103","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006873","5.4855","","5.4855","","13.44","","90","","90","","120","","350.237","","","","","","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","","Loparite","- La0.45 Na0.45 O3 Sr0.1 Ti -","- La0.45 Na0.45 O3 Sr0.1 Ti -","- La2.7 Na2.7 O18 Sr0.6 Ti6 -","6","0.166667","","Mitchell, R. H.; Chakhmouradian, A. R.; Woodward, P. M.","Crystal chemistry of perovskite-type compounds in the tausonite-loparite series, (Sr1-2xNaxLax)TiO3 Sample: x = 0.45","Physics and Chemistry of Minerals","2000","27","","583","589","10.1007/s002690000103","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006874","5.482","","5.482","","13.4104","","90","","90","","120","","349.02","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","","Loparite","- La0.5 Na0.5 O3 Ti -","- La0.5 Na0.5 O3 Ti -","- La3 Na3 O18 Ti6 -","6","0.166667","","Mitchell, R. H.; Chakhmouradian, A. R.; Woodward, P. M.","Crystal chemistry of perovskite-type compounds in the tausonite-loparite series, (Sr1-2xNaxLax)TiO3 Sample: x = 0.50","Physics and Chemistry of Minerals","2000","27","","583","589","10.1007/s002690000103","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006875","4.8025","","10.3648","","6.0529","","90","","90","","90","","301.295","","","","373.15","","","","","","","","","4","P b n m","-P 2c 2ab","62","","","Olivine","- Fe Mg O4 Si -","- Fe Mg O4 Si -","- Fe4 Mg4 O16 Si4 -","4","0.5","","Redfern, S. A. T.; Artioli, G.; Rinaldi, R.; Henderson, C. M. B.; Knight, K. S.; Wood, B. J.","Octahedral cation ordering in olivine at high temperature. II: an in situ neutron powder diffraction study on synthetic MgFeSiO4 (Fa50) Sample: T = 100 C","Physics and Chemistry of Minerals","2000","27","","630","637","10.1007/s002690000109","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006876","4.8065","","10.3759","","6.0609","","90","","90","","90","","302.268","","","","473.15","","","","","","","","","4","P b n m","-P 2c 2ab","62","","","Olivine","- Fe Mg O4 Si -","- Fe Mg O4 Si -","- Fe4 Mg4 O16 Si4 -","4","0.5","","Redfern, S. A. T.; Artioli, G.; Rinaldi, R.; Henderson, C. M. B.; Knight, K. S.; Wood, B. J.","Octahedral cation ordering in olivine at high temperature. II: an in situ neutron powder diffraction study on synthetic MgFeSiO4 (Fa50) Sample: T = 200 C","Physics and Chemistry of Minerals","2000","27","","630","637","10.1007/s002690000109","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006877","4.8106","","10.3863","","6.0682","","90","","90","","90","","303.194","","","","573.15","","","","","","","","","4","P b n m","-P 2c 2ab","62","","","Olivine","- Fe Mg O4 Si -","- Fe Mg O4 Si -","- Fe4 Mg4 O16 Si4 -","4","0.5","","Redfern, S. A. T.; Artioli, G.; Rinaldi, R.; Henderson, C. M. B.; Knight, K. S.; Wood, B. J.","Octahedral cation ordering in olivine at high temperature. II: an in situ neutron powder diffraction study on synthetic MgFeSiO4 (Fa50) Sample: T = 300 C","Physics and Chemistry of Minerals","2000","27","","630","637","10.1007/s002690000109","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006878","4.8126","","10.3916","","6.0721","","90","","90","","90","","303.669","","","","623.15","","","","","","","","","4","P b n m","-P 2c 2ab","62","","","Olivine","- Fe Mg O4 Si -","- Fe Mg O4 Si -","- Fe4 Mg4 O16 Si4 -","4","0.5","","Redfern, S. A. T.; Artioli, G.; Rinaldi, R.; Henderson, C. M. B.; Knight, K. S.; Wood, B. J.","Octahedral cation ordering in olivine at high temperature. II: an in situ neutron powder diffraction study on synthetic MgFeSiO4 (Fa50) Sample: T = 350 C","Physics and Chemistry of Minerals","2000","27","","630","637","10.1007/s002690000109","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006879","4.8147","","10.3971","","6.076","","90","","90","","90","","304.158","","","","673.15","","","","","","","","","4","P b n m","-P 2c 2ab","62","","","Olivine","- Fe Mg O4 Si -","- Fe Mg O4 Si -","- Fe4 Mg4 O16 Si4 -","4","0.5","","Redfern, S. A. T.; Artioli, G.; Rinaldi, R.; Henderson, C. M. B.; Knight, K. S.; Wood, B. J.","Octahedral cation ordering in olivine at high temperature. II: an in situ neutron powder diffraction study on synthetic MgFeSiO4 (Fa50) Sample: T = 400 C","Physics and Chemistry of Minerals","2000","27","","630","637","10.1007/s002690000109","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006880","4.8168","","10.4029","","6.08","","90","","90","","90","","304.661","","","","723.15","","","","","","","","","4","P b n m","-P 2c 2ab","62","","","Olivine","- Fe Mg O4 Si -","- Fe Mg O4 Si -","- Fe4 Mg4 O16 Si4 -","4","0.5","","Redfern, S. A. T.; Artioli, G.; Rinaldi, R.; Henderson, C. M. B.; Knight, K. S.; Wood, B. J.","Octahedral cation ordering in olivine at high temperature. II: an in situ neutron powder diffraction study on synthetic MgFeSiO4 (Fa50) Sample: T = 450 C","Physics and Chemistry of Minerals","2000","27","","630","637","10.1007/s002690000109","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006881","4.819","","10.4091","","6.0841","","90","","90","","90","","305.187","","","","773.15","","","","","","","","","4","P b n m","-P 2c 2ab","62","","","Olivine","- Fe Mg O4 Si -","- Fe Mg O4 Si -","- Fe4 Mg4 O16 Si4 -","4","0.5","","Redfern, S. A. T.; Artioli, G.; Rinaldi, R.; Henderson, C. M. B.; Knight, K. S.; Wood, B. J.","Octahedral cation ordering in olivine at high temperature. II: an in situ neutron powder diffraction study on synthetic MgFeSiO4 (Fa50) Sample: T = 500 C","Physics and Chemistry of Minerals","2000","27","","630","637","10.1007/s002690000109","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006882","4.8212","","10.4148","","6.0882","","90","","90","","90","","305.7","","","","823.15","","","","","","","","","4","P b n m","-P 2c 2ab","62","","","Olivine","- Fe Mg O4 Si -","- Fe Mg O4 Si -","- Fe4 Mg4 O16 Si4 -","4","0.5","","Redfern, S. A. T.; Artioli, G.; Rinaldi, R.; Henderson, C. M. B.; Knight, K. S.; Wood, B. J.","Octahedral cation ordering in olivine at high temperature. II: an in situ neutron powder diffraction study on synthetic MgFeSiO4 (Fa50) Sample: T = 550 C","Physics and Chemistry of Minerals","2000","27","","630","637","10.1007/s002690000109","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006883","4.8233","","10.4211","","6.0923","","90","","90","","90","","306.224","","","","873.15","","","","","","","","","4","P b n m","-P 2c 2ab","62","","","Olivine","- Fe Mg O4 Si -","- Fe Mg O4 Si -","- Fe4 Mg4 O16 Si4 -","4","0.5","","Redfern, S. A. T.; Artioli, G.; Rinaldi, R.; Henderson, C. M. B.; Knight, K. S.; Wood, B. J.","Octahedral cation ordering in olivine at high temperature. II: an in situ neutron powder diffraction study on synthetic MgFeSiO4 (Fa50) Sample: T = 600 C","Physics and Chemistry of Minerals","2000","27","","630","637","10.1007/s002690000109","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006884","4.8276","","10.4332","","6.1001","","90","","90","","90","","307.246","","","","973.15","","","","","","","","","4","P b n m","-P 2c 2ab","62","","","Olivine","- Fe Mg O4 Si -","- Fe Mg O4 Si -","- Fe4 Mg4 O16 Si4 -","4","0.5","","Redfern, S. A. T.; Artioli, G.; Rinaldi, R.; Henderson, C. M. B.; Knight, K. S.; Wood, B. J.","Octahedral cation ordering in olivine at high temperature. II: an in situ neutron powder diffraction study on synthetic MgFeSiO4 (Fa50) Sample: T = 700 C","Physics and Chemistry of Minerals","2000","27","","630","637","10.1007/s002690000109","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006885","4.8321","","10.4453","","6.1078","","90","","90","","90","","308.277","","","","1073.15","","","","","","","","","4","P b n m","-P 2c 2ab","62","","","Olivine","- Fe Mg O4 Si -","- Fe Mg O4 Si -","- Fe4 Mg4 O16 Si4 -","4","0.5","","Redfern, S. A. T.; Artioli, G.; Rinaldi, R.; Henderson, C. M. B.; Knight, K. S.; Wood, B. J.","Octahedral cation ordering in olivine at high temperature. II: an in situ neutron powder diffraction study on synthetic MgFeSiO4 (Fa50) Sample: T = 800 C","Physics and Chemistry of Minerals","2000","27","","630","637","10.1007/s002690000109","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006886","4.8341","","10.4515","","6.1115","","90","","90","","90","","308.775","","","","1123.15","","","","","","","","","4","P b n m","-P 2c 2ab","62","","","Olivine","- Fe Mg O4 Si -","- Fe Mg O4 Si -","- Fe4 Mg4 O16 Si4 -","4","0.5","","Redfern, S. A. T.; Artioli, G.; Rinaldi, R.; Henderson, C. M. B.; Knight, K. S.; Wood, B. J.","Octahedral cation ordering in olivine at high temperature. II: an in situ neutron powder diffraction study on synthetic MgFeSiO4 (Fa50) Sample: T = 850 C","Physics and Chemistry of Minerals","2000","27","","630","637","10.1007/s002690000109","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006887","4.8363","","10.4582","","6.1155","","90","","90","","90","","309.316","","","","1173.15","","","","","","","","","4","P b n m","-P 2c 2ab","62","","","Olivine","- Fe Mg O4 Si -","- Fe Mg O4 Si -","- Fe4 Mg4 O16 Si4 -","4","0.5","","Redfern, S. A. T.; Artioli, G.; Rinaldi, R.; Henderson, C. M. B.; Knight, K. S.; Wood, B. J.","Octahedral cation ordering in olivine at high temperature. II: an in situ neutron powder diffraction study on synthetic MgFeSiO4 (Fa50) Sample: T = 900 C","Physics and Chemistry of Minerals","2000","27","","630","637","10.1007/s002690000109","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006888","4.8426","","10.481","","6.1284","","90","","90","","90","","311.049","","","","1323.15","","","","","","","","","4","P b n m","-P 2c 2ab","62","","","Olivine","- Fe Mg O4 Si -","- Fe Mg O4 Si -","- Fe4 Mg4 O16 Si4 -","4","0.5","","Redfern, S. A. T.; Artioli, G.; Rinaldi, R.; Henderson, C. M. B.; Knight, K. S.; Wood, B. J.","Octahedral cation ordering in olivine at high temperature. II: an in situ neutron powder diffraction study on synthetic MgFeSiO4 (Fa50) Sample: T = 1050 C","Physics and Chemistry of Minerals","2000","27","","630","637","10.1007/s002690000109","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006889","4.8472","","10.4955","","6.1368","","90","","90","","90","","312.202","","","","1423.15","","","","","","","","","4","P b n m","-P 2c 2ab","62","","","Olivine","- Fe Mg O4 Si -","- Fe Mg O4 Si -","- Fe4 Mg4 O16 Si4 -","4","0.5","","Redfern, S. A. T.; Artioli, G.; Rinaldi, R.; Henderson, C. M. B.; Knight, K. S.; Wood, B. J.","Octahedral cation ordering in olivine at high temperature. II: an in situ neutron powder diffraction study on synthetic MgFeSiO4 (Fa50) Sample: T = 1150 C","Physics and Chemistry of Minerals","2000","27","","630","637","10.1007/s002690000109","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006890","4.8488","","10.5009","","6.1399","","90","","90","","90","","312.624","","","","1473.15","","","","","","","","","4","P b n m","-P 2c 2ab","62","","","Olivine","- Fe Mg O4 Si -","- Fe Mg O4 Si -","- Fe4 Mg4 O16 Si4 -","4","0.5","","Redfern, S. A. T.; Artioli, G.; Rinaldi, R.; Henderson, C. M. B.; Knight, K. S.; Wood, B. J.","Octahedral cation ordering in olivine at high temperature. II: an in situ neutron powder diffraction study on synthetic MgFeSiO4 (Fa50) Sample: T = 1200 C","Physics and Chemistry of Minerals","2000","27","","630","637","10.1007/s002690000109","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006891","4.8494","","10.5023","","6.1409","","90","","90","","90","","312.755","","","","1498.15","","","","","","","","","4","P b n m","-P 2c 2ab","62","","","Olivine","- Fe Mg O4 Si -","- Fe Mg O4 Si -","- Fe4 Mg4 O16 Si4 -","4","0.5","","Redfern, S. A. T.; Artioli, G.; Rinaldi, R.; Henderson, C. M. B.; Knight, K. S.; Wood, B. J.","Octahedral cation ordering in olivine at high temperature. II: an in situ neutron powder diffraction study on synthetic MgFeSiO4 (Fa50) Sample: T = 1225 C","Physics and Chemistry of Minerals","2000","27","","630","637","10.1007/s002690000109","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006892","4.8497","","10.5034","","6.1418","","90","","90","","90","","312.853","","","","1523.15","","","","","","","","","4","P b n m","-P 2c 2ab","62","","","Olivine","- Fe Mg O4 Si -","- Fe Mg O4 Si -","- Fe4 Mg4 O16 Si4 -","4","0.5","","Redfern, S. A. T.; Artioli, G.; Rinaldi, R.; Henderson, C. M. B.; Knight, K. S.; Wood, B. J.","Octahedral cation ordering in olivine at high temperature. II: an in situ neutron powder diffraction study on synthetic MgFeSiO4 (Fa50) Sample: T = 1250 C","Physics and Chemistry of Minerals","2000","27","","630","637","10.1007/s002690000109","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006893","8.4412","","8.4412","","8.4412","","90","","90","","90","","601.468","","","","","","","","0","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Franklinite","- Fe2 O4 Zn -","- Fe2 O4 Zn -","- Fe16 O32 Zn8 -","8","0.0416667","","Levy, D.; Pavese, A.; Hanfland, M.","Phase transition of synthetic zinc ferrite spinel (ZnFe2O4) at high pressure, from synchrotron X-ray powder diffraction Sample: P = 0.0 GPa","Physics and Chemistry of Minerals","2000","27","","638","644","10.1007/s002690000117","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006894","8.4129","","8.4129","","8.4129","","90","","90","","90","","595.439","","","","","","","","1800000","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Franklinite","- Fe2 O4 Zn -","- Fe2 O4 Zn -","- Fe16 O32 Zn8 -","8","0.0416667","","Levy, D.; Pavese, A.; Hanfland, M.","Phase transition of synthetic zinc ferrite spinel (ZnFe2O4) at high pressure, from synchrotron X-ray powder diffraction Sample: P = 1.8 GPa","Physics and Chemistry of Minerals","2000","27","","638","644","10.1007/s002690000117","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006895","8.3731","","8.3731","","8.3731","","90","","90","","90","","587.028","","","","","","","","4600000","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Franklinite","- Fe2 O4 Zn -","- Fe2 O4 Zn -","- Fe16 O32 Zn8 -","8","0.0416667","","Levy, D.; Pavese, A.; Hanfland, M.","Phase transition of synthetic zinc ferrite spinel (ZnFe2O4) at high pressure, from synchrotron X-ray powder diffraction Sample: P = 4.6 GPa","Physics and Chemistry of Minerals","2000","27","","638","644","10.1007/s002690000117","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006896","8.3603","","8.3603","","8.3603","","90","","90","","90","","584.34","","","","","","","","5500000","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Franklinite","- Fe2 O4 Zn -","- Fe2 O4 Zn -","- Fe16 O32 Zn8 -","8","0.0416667","","Levy, D.; Pavese, A.; Hanfland, M.","Phase transition of synthetic zinc ferrite spinel (ZnFe2O4) at high pressure, from synchrotron X-ray powder diffraction Sample: P = 5.5 GPa","Physics and Chemistry of Minerals","2000","27","","638","644","10.1007/s002690000117","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006897","8.347","","8.347","","8.347","","90","","90","","90","","581.556","","","","","","","","6800000","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Franklinite","- Fe2 O4 Zn -","- Fe2 O4 Zn -","- Fe16 O32 Zn8 -","8","0.0416667","","Levy, D.; Pavese, A.; Hanfland, M.","Phase transition of synthetic zinc ferrite spinel (ZnFe2O4) at high pressure, from synchrotron X-ray powder diffraction Sample: P = 6.8 GPa","Physics and Chemistry of Minerals","2000","27","","638","644","10.1007/s002690000117","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006898","8.3177","","8.3177","","8.3177","","90","","90","","90","","575.453","","","","","","","","9000000","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Franklinite","- Fe2 O4 Zn -","- Fe2 O4 Zn -","- Fe16 O32 Zn8 -","8","0.0416667","","Levy, D.; Pavese, A.; Hanfland, M.","Phase transition of synthetic zinc ferrite spinel (ZnFe2O4) at high pressure, from synchrotron X-ray powder diffraction Sample: P = 9.0 GPa","Physics and Chemistry of Minerals","2000","27","","638","644","10.1007/s002690000117","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006899","8.3069","","8.3069","","8.3069","","90","","90","","90","","573.214","","","","","","","","10200000","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Franklinite","- Fe2 O4 Zn -","- Fe2 O4 Zn -","- Fe16 O32 Zn8 -","8","0.0416667","","Levy, D.; Pavese, A.; Hanfland, M.","Phase transition of synthetic zinc ferrite spinel (ZnFe2O4) at high pressure, from synchrotron X-ray powder diffraction Sample: P = 10.2 GPa","Physics and Chemistry of Minerals","2000","27","","638","644","10.1007/s002690000117","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006900","8.2884","","8.2884","","8.2884","","90","","90","","90","","569.393","","","","","","","","11500000","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Franklinite","- Fe2 O4 Zn -","- Fe2 O4 Zn -","- Fe16 O32 Zn8 -","8","0.0416667","","Levy, D.; Pavese, A.; Hanfland, M.","Phase transition of synthetic zinc ferrite spinel (ZnFe2O4) at high pressure, from synchrotron X-ray powder diffraction Sample: P = 11.5 GPa","Physics and Chemistry of Minerals","2000","27","","638","644","10.1007/s002690000117","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006901","8.2719","","8.2719","","8.2719","","90","","90","","90","","565.999","","","","","","","","12900000","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Franklinite","- Fe2 O4 Zn -","- Fe2 O4 Zn -","- Fe16 O32 Zn8 -","8","0.0416667","","Levy, D.; Pavese, A.; Hanfland, M.","Phase transition of synthetic zinc ferrite spinel (ZnFe2O4) at high pressure, from synchrotron X-ray powder diffraction Sample: P = 12.9 GPa","Physics and Chemistry of Minerals","2000","27","","638","644","10.1007/s002690000117","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006902","8.2634","","8.2634","","8.2634","","90","","90","","90","","564.256","","","","","","","","14200000","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Franklinite","- Fe2 O4 Zn -","- Fe2 O4 Zn -","- Fe16 O32 Zn8 -","8","0.0416667","","Levy, D.; Pavese, A.; Hanfland, M.","Phase transition of synthetic zinc ferrite spinel (ZnFe2O4) at high pressure, from synchrotron X-ray powder diffraction Sample: P = 14.2 GPa","Physics and Chemistry of Minerals","2000","27","","638","644","10.1007/s002690000117","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006903","8.244","","8.244","","8.244","","90","","90","","90","","560.291","","","","","","","","16000000","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Franklinite","- Fe2 O4 Zn -","- Fe2 O4 Zn -","- Fe16 O32 Zn8 -","8","0.0416667","","Levy, D.; Pavese, A.; Hanfland, M.","Phase transition of synthetic zinc ferrite spinel (ZnFe2O4) at high pressure, from synchrotron X-ray powder diffraction Sample: P = 16.0 GPa","Physics and Chemistry of Minerals","2000","27","","638","644","10.1007/s002690000117","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006904","8.2289","","8.2289","","8.2289","","90","","90","","90","","557.218","","","","","","","","17800000","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Franklinite","- Fe2 O4 Zn -","- Fe2 O4 Zn -","- Fe16 O32 Zn8 -","8","0.0416667","","Levy, D.; Pavese, A.; Hanfland, M.","Phase transition of synthetic zinc ferrite spinel (ZnFe2O4) at high pressure, from synchrotron X-ray powder diffraction Sample: P = 17.8 GPa","Physics and Chemistry of Minerals","2000","27","","638","644","10.1007/s002690000117","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006905","8.2151","","8.2151","","8.2151","","90","","90","","90","","554.42","","","","","","","","19700000","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Franklinite","- Fe2 O4 Zn -","- Fe2 O4 Zn -","- Fe16 O32 Zn8 -","8","0.0416667","","Levy, D.; Pavese, A.; Hanfland, M.","Phase transition of synthetic zinc ferrite spinel (ZnFe2O4) at high pressure, from synchrotron X-ray powder diffraction Sample: P = 19.7 GPa","Physics and Chemistry of Minerals","2000","27","","638","644","10.1007/s002690000117","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006906","8.1939","","8.1939","","8.1939","","90","","90","","90","","550.138","","","","","","","","22100000","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Franklinite","- Fe2 O4 Zn -","- Fe2 O4 Zn -","- Fe16 O32 Zn8 -","8","0.0416667","","Levy, D.; Pavese, A.; Hanfland, M.","Phase transition of synthetic zinc ferrite spinel (ZnFe2O4) at high pressure, from synchrotron X-ray powder diffraction Sample: P = 22.1 GPa","Physics and Chemistry of Minerals","2000","27","","638","644","10.1007/s002690000117","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006907","8.1758","","8.1758","","8.1758","","90","","90","","90","","546.501","","","","","","","","24400000","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Franklinite","- Fe2 O4 Zn -","- Fe2 O4 Zn -","- Fe16 O32 Zn8 -","8","0.0416667","","Levy, D.; Pavese, A.; Hanfland, M.","Phase transition of synthetic zinc ferrite spinel (ZnFe2O4) at high pressure, from synchrotron X-ray powder diffraction Sample: P = 24.4 GPa","Physics and Chemistry of Minerals","2000","27","","638","644","10.1007/s002690000117","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006908","4.7134","","4.2241","","2.83252","","90","","90","","90","","56.395","","","","","","","","","","synthesized at 21 GPa and 1000 C","synthesized at 21 GPa","","3","P 21 n m","P -2 2ac","31","","","","- Al H O2 -","- Al H O2 -","- Al2 H2 O4 -","2","0.5","","Suzuki, A.; Ohtani, E.; Kamada, T.","A new hydrous phase delta-AlOOH synthesized at 21 GPa and 1000 C","Physics and Chemistry of Minerals","2000","27","","689","693","10.1007/s002690000120","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:46",""
"9006909","5.4744","","5.4766","","9.1505","","83.53","","76.68","","60.06","","231.335","","","","","","","","","","","","","7","P -1","-P 1","2","","","Chloritoid","- Al3.844 Fe0.857 H4 Mg0.598 Mn0.701 O14 Si2 -","- Al3.844 Fe0.857 H4 Mg0.598 Mn0.701 O14 Si2 -","- Al3.844 Fe0.857 H4 Mg0.598 Mn0.701 O14 Si2 -","1","0.5","","Koch-Muller M; Kahlenberg, V.; Schmidt, C.; Wirth, R.","Location of OH groups and oxidation processes in triclinic chloritoid","Physics and Chemistry of Minerals","2000","27","","703","712","10.1007/s002690000114","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006910","9.4628","","8.3882","","5.2186","","90","","110.187","","90","","388.785","","","","","","","","0","","","","","4","C 1 2/c 1","-C 2yc","15","","","Spodumene","- Al Li O6 Si2 -","- Al Li O6 Si2 -","- Al4 Li4 O24 Si8 -","4","0.5","","Arlt, T.; Angel, R. J.","Displacive phase transitions in C-centred clinopyroxenes: spodumene, LiScSi2O6 and ZnSiO3 Sample: P = 0 GPa","Physics and Chemistry of Minerals","2000","27","","719","731","10.1007/s002690000116","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006911","9.3895","","8.324","","5.1865","","90","","110.023","","90","","380.865","","","","","","","","3164000","","","","","4","C 1 2/c 1","-C 2yc","15","","","Spodumene","- Al Li O6 Si2 -","- Al Li O6 Si2 -","- Al4 Li4 O24 Si8 -","4","0.5","","Arlt, T.; Angel, R. J.","Displacive phase transitions in C-centred clinopyroxenes: spodumene, LiScSi2O6 and ZnSiO3 Sample: P = 3.164 GPa","Physics and Chemistry of Minerals","2000","27","","719","731","10.1007/s002690000116","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006912","9.3114","","8.3614","","5.11","","90","","109.274","","90","","375.547","","","","","","","","3342000","","","","","4","P 1 21/c 1","-P 2ybc","14","","","Spodumene","- Al Li O6 Si2 -","- Al Li O6 Si2 -","- Al4 Li4 O24 Si8 -","4","1","","Arlt, T.; Angel, R. J.","Displacive phase transitions in C-centred clinopyroxenes: spodumene, LiScSi2O6 and ZnSiO3 Sample: P = 3.342 GPa","Physics and Chemistry of Minerals","2000","27","","719","731","10.1007/s002690000116","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006913","9.2007","","8.2656","","5.024","","90","","108.91","","90","","361.451","","","","","","","","8835000","","","","","4","P 1 21/c 1","-P 2ybc","14","","","Spodumene","- Al Li O6 Si2 -","- Al Li O6 Si2 -","- Al4 Li4 O24 Si8 -","4","1","","Arlt, T.; Angel, R. J.","Displacive phase transitions in C-centred clinopyroxenes: spodumene, LiScSi2O6 and ZnSiO3 Sample: P = 8.835 GPa","Physics and Chemistry of Minerals","2000","27","","719","731","10.1007/s002690000116","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006914","9.7969","","8.9459","","5.3581","","90","","110.376","","90","","440.212","","","","","","","","0","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- Li O6 Sc Si2 -","- Li O6 Sc Si2 -","- Li4 O24 Sc4 Si8 -","4","0.5","","Arlt, T.; Angel, R. J.","Displacive phase transitions in C-centred clinopyroxenes: spodumene, LiScSi2O6 and ZnSiO3 Sample: P = 0 GPa","Physics and Chemistry of Minerals","2000","27","","719","731","10.1007/s002690000116","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006915","9.6937","","8.8958","","5.3047","","90","","109.992","","90","","429.876","","","","","","","","2113000","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- Li O6 Sc Si2 -","- Li O6 Sc Si2 -","- Li4 O24 Sc4 Si8 -","4","1","","Arlt, T.; Angel, R. J.","Displacive phase transitions in C-centred clinopyroxenes: spodumene, LiScSi2O6 and ZnSiO3 Sample: P = 2.113 GPa","Physics and Chemistry of Minerals","2000","27","","719","731","10.1007/s002690000116","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006916","9.5954","","8.8304","","5.2448","","90","","109.601","","90","","418.646","","","","","","","","4804000","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- Li O6 Sc Si2 -","- Li O6 Sc Si2 -","- Li4 O24 Sc4 Si8 -","4","1","","Arlt, T.; Angel, R. J.","Displacive phase transitions in C-centred clinopyroxenes: spodumene, LiScSi2O6 and ZnSiO3 Sample: P = 4.804 GPa","Physics and Chemistry of Minerals","2000","27","","719","731","10.1007/s002690000116","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006917","9.7633","","9.1598","","5.2889","","90","","111.294","","90","","440.695","","","","","","","","321000","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- O3 Si Zn -","- O3 Si Zn -","- O24 Si8 Zn8 -","8","1","","Arlt, T.; Angel, R. J.","Displacive phase transitions in C-centred clinopyroxenes: spodumene, LiScSi2O6 and ZnSiO3 Sample: P = .321 GPa","Physics and Chemistry of Minerals","2000","27","","719","731","10.1007/s002690000116","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006918","9.5781","","8.8905","","5.1798","","90","","109.443","","90","","415.928","","","","","","","","4258000","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- O3 Si Zn -","- O3 Si Zn -","- O24 Si8 Zn8 -","8","2","","Arlt, T.; Angel, R. J.","Displacive phase transitions in C-centred clinopyroxenes: spodumene, LiScSi2O6 and ZnSiO3 Sample: P = 4.258 GPa","Physics and Chemistry of Minerals","2000","27","","719","731","10.1007/s002690000116","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006919","9.4098","","8.8327","","4.98","","90","","103.906","","90","","401.776","","","","","","","","5304000","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- O3 Si Zn -","- O3 Si Zn -","- O24 Si8 Zn8 -","8","1","","Arlt, T.; Angel, R. J.","Displacive phase transitions in C-centred clinopyroxenes: spodumene, LiScSi2O6 and ZnSiO3 Sample: P = 5.304 GPa","Physics and Chemistry of Minerals","2000","27","","719","731","10.1007/s002690000116","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9007697","9.314","","9.314","","9.314","","90","","90","","90","","807.995","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","","Murdochite","- Cu6 O8 Pb -","- Cu6 O8 Pb -","- Cu24 O32 Pb4 -","4","0.0208333","","Winkler, B.; Chall, M.; Pickard, C. J.; Milman, V.; White, J.","Structure of Cu6PbO8 Note: these are model structure derived from quantum calculations This model appears to be the stable phase at ambient conditions","Acta Crystallographica, Section B","2000","56","1","22","26","10.1107/S0108768199011015","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007698","8.623","","8.623","","8.623","","90","","90","","90","","641.173","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","","Murdochite","- Cu6 O8 Pb -","- Cu6 O8 Pb -","- Cu24 O32 Pb4 -","4","0.0208333","","Winkler, B.; Chall, M.; Pickard, C. J.; Milman, V.; White, J.","Structure of Cu6PbO8 Note: these are model structure derived from quantum calculations This model appears to be the stable phase at high pressure","Acta Crystallographica, Section B","2000","56","1","22","26","10.1107/S0108768199011015","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9008436","18.076","","5.92","","5.083","","90","","96.97","","90","","539.912","","","","","","","","","","","","Tsumeb mine Namibia","4","C 1 2/c 1","-C 2yc","15","","","Biehlite","- As0.21 Mo O6 Sb1.79 -","- As0.21 Mo O6 Sb1.79 -","- As0.84 Mo4 O24 Sb7.16 -","4","0.5","","Adiwidjaja, G.; Friese, K.; Klaska, K. H.; Schluter, J.; Czank, M.","Crystal structure and crystal chemistry of biehlite, Sb1.79As0.21MoO6","Zeitschrift fur Kristallographie","2000","215","","529","535","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:55:59",""
"9009406","14.215","","14.215","","6.126","","90","","90","","90","","1237.86","","","","","","","","","","","","Cerchiara mine, Va di Vara, northern Apennines, Italy","5","I 4/m m m","-I 4 2","139","","","Cerchiaraite","- Ba4 Cl Mn4 O25 Si6 -","- Ba4 Cl Mn4 O25 Si6 -","- Ba8 Cl2 Mn8 O50 Si12 -","2","0.0625","","Basso, R.; Lucchetti, G.; Zefiro, L.; Palenzona, A.","Cerchiaraite, a new natural Ba-Mn-mixed-anion silicate chloride from the Cerchiara mine, northern Apennines, Italy","Neues Jahrbuch fur Mineralogie, Monatshefte","2000","2000","","373","384","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:31",""
"9009407","3.063","","3.063","","8.91","","90","","90","","120","","72.394","","","","","","","","","","","","Hilarion mine, Kamariza, near Laurion, Greece","5","P -3","-P 3","147","","","Zincowoodwardite","- Al0.375 H6 O2.686 S0.188 Zn0.625 -","- Al0.375 H2.376 O2.686 S0.188 Zn0.625 -","- Al0.375 H2.376 O2.686 S0.188 Zn0.625 -","1","0.166667","","Witzke, T.; Raade, G.","Zincowoodwardite, [Zn1-x Alx(OH)2][(SO4)x/2(H2O)n], a new mineral of the hydrotalcite group Locality: Hilarion mine, Kamariza, near Laurion, Greece Note: polytype Zincowoodwardite-1T","Neues Jahrbuch fur Mineralogie, Monatshefte","2000","2000","","455","465","","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:10",""
"9009408","3.065","","3.065","","25.42","","90","","90","","120","","206.808","","","","","","","","","","","","","5","R -3 m :H","-R 3 2""","166","","","Zincowoodwardite-3R","- Al0.375 H9 O2.692 S0.188 Zn0.625 -","- Al0.375 H2.376 O2.692 S0.188 Zn0.625 -","- Al1.125 H7.128 O8.076 S0.564 Zn1.875 -","3","0.0833333","","Witzke T; Raade G","Zincowoodwardite, [Zn1-x Alx(OH)2][(SO4)x/2(H2O)n], a new mineral of the hydrotalcite group Locality: Hilarion mine, Kamariza, near Laurion, Greece","Neues Jahrbuch fur Mineralogie, Monatshefte","2000","2000","","455","465","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:31",""
"9009409","7.51","","9.004","","5.948","","90","","90","","90","","402.204","","","","","","","","","","","","Glucksstern min, Gottlob hill, Friedrichroda, Thuringia, Germany","6","P 21 21 21","P 2ac 2ab","19","","","Gottlobite","- As0.25 Ca H Mg O5 V0.75 -","- As0.25 Ca H Mg O5 V0.75 -","- As Ca4 H4 Mg4 O20 V3 -","4","1","","Witzke, T.; Steins, M.; Doering, T.; Kolitsch, U.","Gottlobite, CaMg(VO4,AsO4)(OH), a new mineral from Friedrichroda, Thuringia, Germany Locality: Glucksstern min, Gottlob hill, Friedrichroda, Thuringia, Germany","Neues Jahrbuch fur Mineralogie, Monatshefte","2000","2000","","444","454","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:47",""
"9009514","5.7012","","5.1801","","29.265","","90","","89.99","","90","","864.277","","","","","","","","","","","","Humboldt mine, Patagonia, Arizona","6","B 1 21 1","P 2yb (1/2*x,y,-1/2*x+z)","4","","","Luetheite","- Al0.635 As Cu Fe0.365 H2 O6 -","- Al0.635 As Cu Fe0.365 H2 O6 -","- Al5.08 As8 Cu8 Fe2.92 H16 O48 -","8","","","Burns, P. C.; Smith, J. V.; Steele, I. M.","Arizona porphyry copper/hydrothermal deposits I. The structure of chenevixite and luetheite Note: Luetheite-chenevixite series","Mineralogical Magazine","2000","64","","25","30","10.1180/002646100549102","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:47",""
"9009515","8.79861","","5.73422","","7.27402","","90","","90","","90","","366.997","","","","1073","","","","","","","","Dundas, Tasmania","3","P n m a","-P 2ac 2n","62","","","Crocoite","- Cr O4 Pb -","- Cr O4 Pb -","- Cr4 O16 Pb4 -","4","0.5","","Knight, K. S.","A high temperature structural phase transition in crocoite (PbCrO4) at 1068 K: crystal structure refinement at 1073 K and thermal expansion tensor determination at 1000 K Sample: the high temperature form at T = 1073 K","Mineralogical Magazine","2000","64","","291","300","10.1180/002646100549193","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:31",""
"9009516","7.419","","7.629","","9.905","","69.17","","69.88","","64.98","","462.236","","","","","","","","","","","","Iron Monarch iron ore deposit, South Australia","5","P -1","-P 1","2","","","Faustite","- Al6 H16 O28 P4 Zn0.927 -","- Al6 H16 O28 P4 Zn0.927 -","- Al6 H16 O28 P4 Zn0.927 -","1","0.5","","Kolitsch, U.; Giester, G.","The crystal structure of faustite and its copper analogue turquoise","Mineralogical Magazine","2000","64","","905","913","10.1180/002646100549733","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:31",""
"9009517","7.41","","7.633","","9.904","","68.42","","69.65","","65.05","","459.808","","","","","","","","","","","","Iron Monarch iron ore deposit, South Australia","5","P -1","-P 1","2","","","Turquoise","- Al3 Cu0.452 H8 O14 P2 -","- Al3 Cu0.452 H8 O14 P2 -","- Al6 Cu0.904 H16 O28 P4 -","2","1","","Kolitsch, U.; Giester, G.","The crystal structure of faustite and its copper analogue turquoise","Mineralogical Magazine","2000","64","","905","913","10.1180/002646100549733","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:31",""
"9009518","9.0921","","9.0921","","24.923","","90","","90","","120","","1784.27","","","","","","","","","","","","Synthetic","4","P 63 c m","P 6c -2","185","","","Plumbonacrite","- C3 H2 O12 Pb5 -","- C3 H2 O12 Pb5 -","- C18 H12 O72 Pb30 -","6","0.5","","Krivovichev, S. V.; Burns, P. C.","Crystal chemistry of basic lead carbonates II. Crystal structure of synthetic `plumbonacrite'","Mineralogical Magazine","2000","64","","1069","1075","10.1180/002646100549887","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:47",""
"9009519","5.55","","5.62","","7.621","","68.59","","69.17","","69.51","","200.104","","","","","","","","","","","","Tsumeb, Namibia","7","P -1","-P 1","2","","","Zincgartrellite","- As2 Cu0.4 Fe0.4 H4.4 O10 Pb Zn1.2 -","- As2 Cu0.4 Fe0.4 H3.6 O10 Pb Zn1.2 -","- As2 Cu0.4 Fe0.4 H3.6 O10 Pb Zn1.2 -","1","0.5","","Effenberger, H.; Krause, W.; Bernhardt, H. J.; Martin, M.","On the symmetry of tsumcorite group minerals based on the new species rappoldite and zincgartrellite","Mineralogical Magazine","2000","64","","1109","1126","10.1180/002646100549922","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:10",""
"9009660","9.8881","","14.404","","8.6848","","90","","124.271","","90","","1022.2","","","","","","","","","","","","","7","P 1 21/m 1","-P 2yb","11","","","Phillipsite-K","- Al3.2 Ca0.78 H7.5 K1.22 Na0.41 O21.13 Si4.8 -","- Al3.2 Ca0.78 H10.26 K1.22 Na0.41 O21.13 Si4.8 -","- Al6.4 Ca1.56 H20.52 K2.44 Na0.82 O42.26 Si9.6 -","2","0.5","","Gualtieri, A. F.","Accuracy of XRPD QPA using the combined Rietveld-RIR method Locality: Vallerano, Rome, Italy","Journal of Applied Crystallography","2000","33","","267","278","10.1107/S002188989901643X","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:10",""
"9009661","9.39692","","9.39692","","9.39692","","93.866","","93.866","","93.866","","823.834","","","","","","","","","","","","Keller, Nidda, Germany","5","R -3 m :R","-P 3* 2","166","","","Chabazite-Ca","- Al3.48 Ca1.74 H70 O42.15 Si8.52 -","- Al3.48 Ca1.74 H36.3 O42.15 Si8.52 -","- Al3.48 Ca1.74 H36.3 O42.15 Si8.52 -","1","0.0833333","","Gualtieri, A. F.","Accuracy of XRPD QPA using the combined Rietveld-RIR method","Journal of Applied Crystallography","2000","33","","267","278","10.1107/S002188989901643X","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:10",""
"9009662","8.53573","","13.03129","","7.17536","","90","","115.985","","90","","717.44","","","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","Sanidine","- Al K O8 Si3 -","- Al K O8 Si3 -","- Al4 K4 O32 Si12 -","4","0.5","","Gualtieri, A. F.","Accuracy of XRPD QPA using the combined Rietveld-RIR method Locality: Latera, Viterbo, Italy","Journal of Applied Crystallography","2000","33","","267","278","10.1107/S002188989901643X","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9009663","8.14588","","12.7973","","7.15775","","94.2451","","116.6","","87.8","","665.342","","","","","","","","","","","","Baveno, Novara, Italy","5","C -1","-P 1 (1/2*x+1/2*y,1/2*x-1/2*y,-z)","2","","","Albite","- Al1.02 Ca0.02 Na0.98 O8 Si2.98 -","- Al1.02 Ca0.02 Na0.98 O8 Si2.98 -","- Al4.08 Ca0.08 Na3.92 O32 Si11.92 -","4","","","Gualtieri, A. F.","Accuracy of XRPD QPA using the combined Rietveld-RIR method","Journal of Applied Crystallography","2000","33","","267","278","10.1107/S002188989901643X","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9009664","9.7504","","8.9015","","5.27444","","90","","106.016","","90","","440.016","","","","","","","","","","","","Napoli, Italy","5","C 1 2/c 1","-C 2yc","15","","","Augite","- Ca Fe0.25 Mg0.74 O6 Si2 -","- Ca Fe0.25 Mg0.74 O6 Si2 -","- Ca4 Fe Mg2.96 O24 Si8 -","4","0.5","","Gualtieri, A. F.","Accuracy of XRPD QPA using the combined Rietveld-RIR method","Journal of Applied Crystallography","2000","33","","267","278","10.1107/S002188989901643X","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9009665","5.2226","","9.0183","","20.143","","90","","95.665","","90","","944.081","","","","","","","","","","","","Napoli, Italy","4","C 1 2/c 1","-C 2yc","15","","","Illite","- Al4 K O12 Si2 -","- Al4 K O12 Si2 -","- Al16 K4 O48 Si8 -","4","0.5","","Gualtieri, A. F.","Accuracy of XRPD QPA using the combined Rietveld-RIR method","Journal of Applied Crystallography","2000","33","","267","278","10.1107/S002188989901643X","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9009666","4.9158","","4.9158","","5.4091","","90","","90","","120","","113.199","","","","","","","","","","","","Baveno, Novara, Italy","2","P 31 2 1","P 31 2""","152","","","Quartz","- O2 Si -","- O2 Si -","- O6 Si3 -","3","0.5","","Gualtieri, A. F.","Accuracy of XRPD QPA using the combined Rietveld-RIR method","Journal of Applied Crystallography","2000","33","","267","278","10.1107/S002188989901643X","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9009951","10.5313","","10.5313","","6.4829","","90","","90","","120","","622.679","","","","","","","","","","","","Khibiny Massif, Kola Peninsula, Russia","11","P 63 m c","P 6c -2c","186","","","Burbankite","- C5 Ba0.318 Ca0.834 Ce0.222 La0.114 Na2.184 Nd0.048 O15 Pr0.018 Sr1.899 Y0.03 -","- C5 Ba0.318 Ca0.834 Ce0.222 La0.114 Na2.184 Nd0.048 O15 Pr0.018 Sr1.899 Y0.03 -","- C10 Ba0.636 Ca1.668 Ce0.444 La0.228 Na4.368 Nd0.096 O30 Pr0.036 Sr3.798 Y0.06 -","2","0.166667","","Belovitskaya Yu, V.; Pekov, I. V.; Kabalov Yu, K.","Refinement of the crystal structures of low-rare-earth and ""typical"" burbankites by the Rietveld method Sample: B-108 Note: x02 adjusted to satisfy symmetry constraints","Crystallography Reports","2000","45","","26","29","10.1134/1.171131","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:08",""
"9009952","10.5263","","10.5263","","6.5392","","90","","90","","120","","627.49","","","","","","","","","","","","Khibiny Massif, Kola Peninsula, Russia","9","P 63 m c","P 6c -2c","186","","","Burbankite","- C5 Ba0.378 Ca1.131 Ce0.018 La0.051 Na1.86 O15 Sr2.151 Y0.018 -","- C5 Ba0.378 Ca1.131 Ce0.018 La0.051 Na1.86 O15 Sr2.151 Y0.018 -","- C10 Ba0.756 Ca2.262 Ce0.036 La0.102 Na3.72 O30 Sr4.302 Y0.036 -","2","0.166667","","Belovitskaya Yu, V.; Pekov, I. V.; Kabalov Yu, K.","Refinement of the crystal structures of low-rare-earth and ""typical"" burbankites by the Rietveld method Sample: B-104","Crystallography Reports","2000","45","","26","29","10.1134/1.171131","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9010053","6.007","","3.602","","6.897","","90","","90","","90","","149.232","","","","","","","","","","","","Kaidun chondritic meteorite, South Yemen","5","P n m a","-P 2ac 2n","62","","","Florenskyite","- Fe Ni0.13 P0.97 Si0.03 Ti0.87 -","- Fe Ni0.13 P0.97 Si0.03 Ti0.87 -","- Fe4 Ni0.52 P3.88 Si0.12 Ti3.48 -","4","0.5","","Ivanov, A. V.; Zolensky, M. E.; Saito, A.; Ohsumi, K.; Yang, S. V.; Kononkova, N. N.; Mikouchi, T.","Florenskyite, FeTiP, a new phosphide from the Kaidun meteorite","American Mineralogist","2000","85","","1082","1086","","","","","","","","","","","","","","","","","","","","","","has coordinates","291792","2024-05-09","08:53:44",""
"9010566","6.999","","14.748","","5.386","","93.62","","89.98","","95.5","","552.277","","","","","","","","","","","","","9","P -1","-P 1","2","","","Yoshimuraite","- Ba2 Fe0.22 H Mn2 O13 P0.46 S0.34 Si2.17 Ti0.78 -","- Ba2 Fe0.22 H Mn2 O13 P0.46 S0.34 Si2.17 Ti0.78 -","- Ba4 Fe0.44 H2 Mn4 O26 P0.92 S0.68 Si4.34 Ti1.56 -","2","1","","McDonald, A. M.; Grice, J. D.; Chao, G. Y.","The crystal structure of yoshimuraite, a layered Ba-Mn-Ti silicophosphate, with comments on five-coordinated Ti","The Canadian Mineralogist","2000","38","","649","656","10.2113/gscanmin.38.3.649","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:48",""
"9011078","6.782","","6.782","","18.274","","90","","90","","90","","840.522","","","","","","","","","","","","Synthetic","4","P 41 21 2","P 4abw 2nw","92","","","Retgersite","- H12 Ni O10 S -","- H12 Ni O10 S -","- H48 Ni4 O40 S4 -","4","0.5","","Rousseau, B.; Maes, S. T.; Lenstra, A. T. H.","Systematic intensity errors and model imperfection as the consequence of spectral truncation","Acta Crystallographica, Section A","2000","56","3","300","307","10.1107/S0108767300002853","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9011298","14.6861","","13.9799","","16.7063","","90","","90","","90","","3429.97","","","","150","","","","","","","","Synthetic","3","P b c n","-P 2n 2ab","60","","","Metaschoepite","- H34 O40 U8 -","- H32 O40 U8 -","- H128 O160 U32 -","4","0.5","","Weller, M. T.; Light, M. E.; Gelbrich, T.","Structure of uranium (VI) oxide dihydrate UO3*2H2O; synthetic meta-schoepite (UO2)4O(OH)6*5H2O Sample: T = 150 K","Acta Crystallographica, Section B","2000","56","4","577","583","10.1107/S0108768199016559","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:51",""
"9011299","10.0507","","14.2016","","8.7281","","90","","125.123","","90","","1018.97","","","","","","","","","","","","Vallerano, Rome, Italy","6","P 1 21/m 1","-P 2yb","11","","","","- Al3 H21.52 N2.38 Na0.26 O20.64 Si5 -","- Al3 H18.8 N2.38 Na0.26 O20.64 Si5 -","- Al6 H37.6 N4.76 Na0.52 O41.28 Si10 -","2","0.5","","Gualtieri, A. F.","Study of NH4+ in the zeolite phillipsite by combined synchrotron powder diffraction and IR spectroscopy Sample: 1","Acta Crystallographica, Section B","2000","56","4","584","593","10.1107/S0108768100002032","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:11",""
"9011300","10.0122","","14.1943","","8.7284","","90","","125.024","","90","","1015.82","","","","","","","","","","","","Perrier, Puy du Dome, France","6","P 1 21/m 1","-P 2yb","11","","","","- Al2.2 H20.08 N2.02 Na0.2 O20.74 Si5.8 -","- Al2.2 H17.56 N2.02 Na0.2 O20.74 Si5.8 -","- Al4.4 H35.12 N4.04 Na0.4 O41.48 Si11.6 -","2","0.5","","Gualtieri, A. F.","Study of NH4+ in the zeolite phillipsite by combined synchrotron powder diffraction and IR spectroscopy Sample: 2","Acta Crystallographica, Section B","2000","56","4","584","593","10.1107/S0108768100002032","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:11",""
"9011301","9.9596","","14.2015","","8.7051","","90","","124.99","","90","","1008.71","","","","","","","","","","","","Monte Lungo, M. Berici, Vicenza, Italy","6","P 1 21/m 1","-P 2yb","11","","","","- Al1.9 H18.8 N1.7 Na0.2 O21.18 Si6.1 -","- Al1.9 H17.16 N1.7 Na0.2 O21.18 Si6.1 -","- Al3.8 H34.32 N3.4 Na0.4 O42.36 Si12.2 -","2","0.5","","Gualtieri, A. F.","Study of NH4+ in the zeolite phillipsite by combined synchrotron powder diffraction and IR spectroscopy Sample: 3","Acta Crystallographica, Section B","2000","56","4","584","593","10.1107/S0108768100002032","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:11",""
"9011520","4.108","","12.308","","9.331","","90","","90","","90","","471.787","","","","","","","","","","","","Synthetic","5","P m m n :2","-P 2ab 2a","59","","","Buckhornite","- Au Bi Pb2 S3 Te2 -","- Au Bi0.99999 Pb2.00001 S3 Te2 -","- Au2 Bi1.99998 Pb4.00002 S6 Te4 -","2","0.25","","Effenberger, H.; Culetto, F. J.; Topa, D.; Paar, W. H.","The crystal structure of synthetic buckhornite, [Pb2BiS3][AuTe2]","Zeitschrift fur Kristallographie","2000","215","","10","16","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:44",""
"9011521","6.631","","7.611","","7.377","","90","","91.8","","90","","372.123","","","","","","","","","","","","Tsumeb mine, Namibia","5","P 1 21/n 1","-P 2yn","14","","","Wilhelmkleinite","- As2 Fe2 H2 O10 Zn -","- As2 Fe2 H2 O10 Zn -","- As4 Fe4 H4 O20 Zn2 -","2","0.5","","Adiwidjaja, G.; Friese, K.; Klaska, K. H.; Moore, P. B.; Schluter, J.","The crystal structure of the new mineral wilhelmkleinite ZnFe3+2(OH)2(AsO4)2","Zeitschrift fur Kristallographie","2000","215","","96","101","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:44",""
"9011522","29.029","","8.595","","5.209","","90","","90","","90","","1299.67","","","","","","","","","","","","Kukisvumtschorr deposit, Khibiny alkaline massif, Kola peninsula, Russia","6","P c c n","-P 2ab 2ac","56","","","Kukisvumite","- H4 Na3 O16 Si4 Ti2 Zn0.5 -","- H4 Na3 O16 Si4 Ti2 Zn0.5 -","- H16 Na12 O64 Si16 Ti8 Zn2 -","4","0.5","","Merlino, S.; Pasero, M.; Ferro, O.","The crystal structure of kukisvumite, Na6ZnTi4(Si2O6)4O4*4H2O Locality: Kukisvumtschorr deposit, Khibiny alkaline massif, Kola peninsula, Russia","Zeitschrift fur Kristallographie","2000","215","","352","356","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:48",""
"9011765","11.181","","10.85","","10.252","","90.64","","90.05","","89.97","","1243.63","","","","","","","","","","","","Dara-i-Pioz glacier, Alaiskii mountain range, Tien-Shan,","14","I -1","-P 1 (-1/2*x+1/2*y+1/2*z,1/2*x-1/2*y+1/2*z,1/2*x+1/2*y-1/2*z)","2","","","Kapitsaite-(Y)","- B3.7 Ba3.68 Ca0.66 Dy0.08 Er0.06 F Gd0.08 K0.12 Nd0.06 O28 Pb0.2 Si8.3 Sm0.06 Y -","- B3.7 Ba3.68 Ca0.66 Dy0.08 Er0.06 F Gd0.08 K0.12 Nd0.06 O28 Pb0.2 Si8.3 Sm0.06 Y -","- B7.4 Ba7.36 Ca1.32 Dy0.16 Er0.12 F2 Gd0.16 K0.24 Nd0.12 O56 Pb0.4 Si16.6 Sm0.12 Y2 -","2","","","Sokolova, E. V.; Ferraris, G.; Ivaldi, G.; Pautov, L. A.; Khvorov, P. V.","Crystal structure of kapitsaite-(Y), a new borosilicate isotypic with hyalotekite - Crystal chemistry of the related isomorphous series Garmskii district, Northern Tajikistan","Neues Jahrbuch fur Mineralogie, Monatshefte","2000","2000","","74","84","","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:51",""
"9011806","13.765","","7.896","","10.804","","90","","102.57","","90","","1146.12","","","","","","","","","","","","Laurion, Attica, Greece","5","P 1 21/c 1","-P 2ybc","14","","","Georgiadesite","- As Cl4 H O4 Pb4 -","- As Cl4 H O4 Pb4 -","- As4 Cl16 H4 O16 Pb16 -","4","1","","Pasero, M.; Vacchiano, D.","Crystal structure and revision of the chemical formula of georgiadesite, Pb4(AsO3)Cl4(OH)","Mineralogical Magazine","2000","64","","879","884","10.1180/002646100549869","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011807","10.0056","","10.0056","","7.496","","90","","90","","120","","649.9","","","","","","","","","","","","Leadhills, Scotland","6","P 63/m","-P 6c","176","","","Mattheddleite","- Cl0.57 H0.43 O12.43 Pb5 S1.5 Si1.5 -","- Cl0.57 H0.43 O12.43 Pb5 S1.5 Si1.5 -","- Cl1.14 H0.86 O24.86 Pb10 S3 Si3 -","2","0.166667","","Steele, I. M.; Pluth, J. J.; Livingstone, A.","Crystal structure of mattheddleite: a Pb, S, Si phase with the apatite structure Locality: Leadhills, Scotland","Mineralogical Magazine","2000","64","","915","921","10.1180/002646100549742","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:49",""
"9011808","9.569","","8.759","","5.256","","90","","106.96","","90","","421.372","","","","298","","","","","","","","Gorduno, Lepontine Alps, Switzerland","7","P 1 2/n 1","-P 2yac","13","","","Omphacite","- Al0.51 Ca0.5 Fe0.06 Mg0.46 Na0.5 O6 Si1.97 -","- Al0.51 Ca0.5 Fe0.06 Mg0.46 Na0.5 O6 Si1.97 -","- Al2.04 Ca2 Fe0.24 Mg1.84 Na2 O24 Si7.88 -","4","1","","Pavese, A.; Bocchio, R.; Ivaldi, G.","In situ high temperature single crystal X-ray diffraction study of a natural omphacite Locality: Gorduno, Lepontine Alps, Switzerland Note: structure at room temperature (T=298K)","Mineralogical Magazine","2000","64","","983","993","10.1180/002646100549986","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011809","9.627","","8.846","","5.282","","90","","107.06","","90","","430.025","","","","1073","","","","","","","","Gorduno, Lepontine Alps, Switzerland","7","P 1 2/n 1","-P 2yac","13","","","Omphacite","- Al0.51 Ca0.5 Fe0.06 Mg0.46 Na0.5 O6 Si1.97 -","- Al0.51 Ca0.5 Fe0.06 Mg0.46 Na0.5 O6 Si1.97 -","- Al2.04 Ca2 Fe0.24 Mg1.84 Na2 O24 Si7.88 -","4","1","","Pavese, A.; Bocchio, R.; Ivaldi, G.","In situ high temperature single crystal X-ray diffraction study of a natural omphacite Locality: Gorduno, Lepontine Alps, Switzerland Note: structure at high temperature (T=1073K)","Mineralogical Magazine","2000","64","","983","993","10.1180/002646100549986","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011810","9.563","","8.776","","5.254","","90","","106.9","","90","","421.899","","","","298","","","","","","heated to 1073K","","Gorduno, Lepontine Alps, Switzerland","7","P 1 2/n 1","-P 2yac","13","","","Omphacite","- Al0.51 Ca0.5 Fe0.06 Mg0.46 Na0.5 O6 Si1.97 -","- Al0.51 Ca0.5 Fe0.06 Mg0.46 Na0.5 O6 Si1.97 -","- Al2.04 Ca2 Fe0.24 Mg1.84 Na2 O24 Si7.88 -","4","1","","Pavese, A.; Bocchio, R.; Ivaldi, G.","In situ high temperature single crystal X-ray diffraction study of a natural omphacite Locality: Gorduno, Lepontine Alps, Switzerland Note: structure at room temperature (T=298K), after being heated to 1073K","Mineralogical Magazine","2000","64","","983","993","10.1180/002646100549986","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011811","5.1465","","9.014","","9.315","","90","","90","","90","","432.128","","","","","","","","","","","","Synthetic","3","P 21 21 21","P 2ac 2ab","19","","","Shannonite","- C O4 Pb2 -","- C O4 Pb2 -","- C4 O16 Pb8 -","4","1","","Krivovichev, S. V.; Burns, P. C.","Crystal chemistry of basic lead carbonates. I. Crystal structure of synthetic shannonite, Pb2O(CO3) Locality: synthetic","Mineralogical Magazine","2000","64","","1063","1068","10.1180/002646100550065","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011812","22.194","","9.108","","5.7405","","90","","90","","90","","1160.4","","","","","","","","","","","","Synthetic","3","P n m a","-P 2ac 2n","62","","","","- C O5 Pb3 -","- C O5 Pb3 -","- C8 O40 Pb24 -","8","1","","Krivovichev, S. V.; Burns, P. C.","Crystal chemistry of basic lead carbonates. III. Crystal structures of Pb3O2(CO3) and NaPb2(OH)(CO3)2","Mineralogical Magazine","2000","64","","1077","1087","10.1180/002646100549896","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011813","5.276","","5.276","","13.474","","90","","90","","120","","324.816","","","","","","","","","","","","Synthetic","5","P 63 m c","P 6c -2c","186","","","","- C2 H Na O7 Pb2 -","- C2 H Na O7 Pb2 -","- C4 H2 Na2 O14 Pb4 -","2","0.166667","","Krivovichev, S. V.; Burns, P. C.","Crystal chemistry of basic lead carbonates. III. Crystal structures of Pb3O2(CO3) and NaPb2(OH)(CO3)2","Mineralogical Magazine","2000","64","","1077","1087","10.1180/002646100549896","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:49",""
"9011814","18.451","","18.451","","4.952","","90","","90","","90","","1685.86","","","","","","","","","","","","","5","P 4/n :2","-P 4a","85","","","Piypite","- Cl Cu4.37 Na4.26 O18 S4 -","- Cl Cu4.37 Na4.26 O18 S4 -","- Cl4 Cu17.48 Na17.04 O72 S16 -","4","0.5","","Kahlenberg, V.; Piotrowski, A.; Giester, G.","Crystal structure of Na4[Cu4O2(SO4)4]*MeCl (Me: Na, Cu, vac) - the synthetic Na-analogue of piypite (caratiite) Locality; synthetic","Mineralogical Magazine","2000","64","","1099","1108","10.1180/002646100549913","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011815","5.595","","5.572","","7.593","","70.19","","70.41","","69.23","","201.911","","","","","","","","","","","","Rappold mine, near Schneeberg, Saxony, Germany","7","P -1","-P 1","2","","","Rappoldite","- As2 Co H4 Ni0.64 O10 Pb Zn0.36 -","- As2 Co H4 Ni0.64 O10 Pb Zn0.36 -","- As2 Co H4 Ni0.64 O10 Pb Zn0.36 -","1","0.5","","Effenberger, H.; Krause, W.; Bernhardt, H. J.; Martin, M.","On the symmetry of tsumcorite group minerals based on the new species rappoldite and zincgartrellite","Mineralogical Magazine","2000","64","","1109","1126","10.1180/002646100549922","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:49",""
"9012400","9.2","","12.369","","5.003","","90","","100.21","","90","","560.3","","","","","","","","","","","","Spring Creek copper mine, southern Flinders Ranges, South Australia","6","P 1 21/m 1","-P 2yb","11","","","Johntomaite","- Ba Ca0.3 Fe3.7 H3 O15 P3 -","- Ba Ca0.3 Fe3.7 H3 O15 P3 -","- Ba2 Ca0.6 Fe7.4 H6 O30 P6 -","2","0.5","","Kolitsch, U.; Pring, A.; Tiekink, E. R. T.","Johntomaite, a new member of the bjarebyite group of barium phosphates: description and structure refinement Locality: Spring Creek copper mine, southern Flinders Ranges, South Australia","Mineralogy and Petrology","2000","70","","1","14","10.1007/s007100070009","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:49",""
"9012401","7.701","","5.365","","12.126","","90","","90.41","","90","","500.983","","","","","","","","","","","","Sounion, Lavrion mining district, Greece","4","P 1 21/n 1","-P 2yn","14","","","Nesquehonite","- C H6 Mg O6 -","- C H6 Mg O6 -","- C4 H24 Mg4 O24 -","4","1","","Giester, G.; Lengauer, C. L.; Rieck, B.","The crystal structure of nesquehonite, MgCO3*3H2O, from Lavrion, Greece","Mineralogy and Petrology","2000","70","","153","163","10.1007/s007100070001","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:47",""
"9012497","6.9564","","6.9564","","6.1953","","90","","90","","90","","299.8","","","","","","","","","","","","Synthetic","3","I 41/a m d :2","-I 4bd 2","141","","","Stetindite","- Ce O4 Si -","- Ce O4 Si -","- Ce4 O16 Si4 -","4","0.125","","Skakle, J. M. S.; Dickson, C. L.; Glasser, F. P.","The crystal structures of CeSiO4 and Ca2Ce8(SiO4)6O2","Powder Diffraction","2000","15","","234","238","10.1017/S0885715600011143","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:47",""
"9012498","9.4343","","9.4343","","6.8885","","90","","90","","120","","530.976","","","","","","","","","","","","Synthetic","4","P 63/m","-P 6c","176","","","","- Ca1.011 Ce3.989 O13 Si3 -","- Ca1.011 Ce3.989 O13 Si3 -","- Ca2.022 Ce7.978 O26 Si6 -","2","0.166667","","Skakle, J. M. S.; Dickson, C. L.; Glasser, F. P.","The crystal structures of CeSiO4 and Ca2Ce8(SiO4)6O2","Powder Diffraction","2000","15","","234","238","10.1017/S0885715600011143","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:47",""
"9012640","7.335","","10.255","","5.599","","90","","99.79","","90","","415.026","","","","","","","","","","","","Kamchatka peninsula, Russia","4","P 1 21/c 1","-P 2ybc","14","","","Urusovite","- Al As Cu O5 -","- Al As Cu O5 -","- Al4 As4 Cu4 O20 -","4","1","","Krivovichev, S. V.; Molchanov, A. V.; Filatov, S. K.","Crystal structure of urusovite Cu(AlAsO5): a new type of an aluminoarsenate tetrahedral polyanion","Crystallography Reports","2000","45","","723","727","10.1134/1.1312909","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:47",""
"9012641","14.369","","13.906","","7.812","","90","","117.09","","90","","1389.71","","","","","","","","","","","","Lovozero massif, Kola Peninsula, Russia","10","C 1 m 1","C -2y","8","","","Kuzmenkoite-Mn","- Ba0.03 Fe0.4 H13.17 K1.63 Mn0.56 Na0.18 Nb0.34 O32.25 Si8 Ti3.4 -","- Ba0.03 Fe0.4 H11.85 K1.63 Mn0.56 Na0.18 Nb0.34 O32.25 Si8 Ti3.4 -","- Ba0.06 Fe0.8 H23.7 K3.26 Mn1.12 Na0.36 Nb0.68 O64.5 Si16 Ti6.8 -","2","0.5","","Rastsvetaeva, R. K.; Chukanov, N. V.; Pekov, I. V.","Refined crystal structure of kuzmenkoite","Crystallography Reports","2000","45","","759","761","10.1134/1.1312915","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:55:07",""
"9012717","6.3165","","6.3165","","7.4278","","90","","90","","120","","256.652","","","","","","","","","","","","Synthetic","3","P -6 2 c","P -6c -2c","190","","","Majakite","- As Ni0.808 Pd1.192 -","- As Ni0.808 Pd1.192 -","- As6 Ni4.848 Pd7.152 -","6","0.5","","Evstigneeva, T.; Kabalov, Y.; Schneider, J.","Crystal structure of PdNiAs, ordered member of isomorphous series Pd2As-Ni2As","Materials Science Forum","2000","321","","700","705","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:48",""
"9012747","14.262","","14.262","","29.949","","90","","90","","120","","5275.62","","","","","","","","","","","","Petrelius peak, Khibiny massif, Kola Peninsula, Russia","16","R 3 m :H","R 3 -2""","160","","","Georgbarsanovite","- Ba0.033 Ca6.333 Ce0.468 Cl1.6 Fe2.55 H7.38 K0.249 Mn1.188 Na12 Nb0.8 O81.18 Si25.2 Sr0.717 Ti0.06 Y0.132 Zr3.27 -","- Ba0.033 Ca6.333 Ce0.468 Cl1.6 Fe2.55 H6.98 K0.249 Mn1.188 Na12 Nb0.8 O78.18 Si25.2 Sr0.717 Ti0.06 Y0.132 Zr3.27 -","- Ba0.099 Ca18.999 Ce1.404 Cl4.8 Fe7.65 H20.94 K0.747 Mn3.564 Na36 Nb2.4 O234.54 Si75.6 Sr2.151 Ti0.18 Y0.396 Zr9.81 -","3","0.166667","","Ekimenkova, I. A.; Rastsvetaeva, R. K.; Khomyakov, A. P.","Crystal structure of the Fe,Cl-analogue of kentbrooksite","Doklady Chemistry","2000","370","","17","20","","","","","","","","","","","","","","","","","","","","","","has coordinates","283912","2023-05-21","08:41:26",""
"9012748","14.604","","14.274","","7.933","","90","","117.4","","90","","1468.17","","","","","","","","","","","","Khibinpakhchorr mountain, Khibiny massif, Kola Peninsula, Russia","10","C 1 m 1","C -2y","8","","","Tsepinite-Na","- Ba0.08 Fe0.02 H11.94 K0.44 Na1.09 Nb1.8 O32.44 Si8 Sr0.2 Ti2.2 -","- Ba0.08 Fe0.02 H6.94 K0.44 Na1.09 Nb1.8 O32.44 Si8 Sr0.2 Ti2.2 -","- Ba0.16 Fe0.04 H13.88 K0.88 Na2.18 Nb3.6 O64.88 Si16 Sr0.4 Ti4.4 -","2","0.5","","Rastsvetaeva, R. K.; Organova, N. I.; Rozhdestvenskaya, I. V.; Shlyukova, Z. V.; Chukanov, N. V.","Crystal structure of oxonium mineral of the nenadkevichite-labuntsovite group from Khibiny massif Locality: Khibinpakhchorr mountain, Khibiny massif, Kola Peninsula, Russia","Doklady Chemistry","2000","371","","52","56","","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:55:07",""
"9012749","14.167","","14.167","","30.081","","90","","90","","120","","5228.52","","","","","","","","","","","","Karnasurt Mountains, Lovozero massif, Kola Peninsula, Russia","14","R 3 m :H","R 3 -2""","160","","","Ikranite","- Ca3.3 Ce0.498 Cl0.26 Fe2.1 H14.43 K0.3 Mn1.398 Na9.63 Nb0.1 O79.16 Si24.3 Sr0.504 Ti0.1 Zr3.399 -","- Ca3.3 Ce0.498 Cl0.26 Fe2.1 H12.43 K0.3 Mn1.398 Na9.63 Nb0.1 O79.16 Si24.3 Sr0.504 Ti0.1 Zr3.399 -","- Ca9.9 Ce1.494 Cl0.78 Fe6.3 H37.29 K0.9 Mn4.194 Na28.89 Nb0.3 O237.48 Si72.9 Sr1.512 Ti0.3 Zr10.197 -","3","0.166667","","Ekimenkova, I. A.; Rastsvetaeva, R. K.; Chukanov, N. V.; Khasanov, S. S.","Crystal structure of an oxonium-containing analogue of eudialyte","Doklady Chemistry","2000","371","","65","69","","","","","","","","","","","","","","","","","","","","","","has coordinates","285100","2023-07-08","13:37:51",""
"9012750","14.229","","14.229","","30.019","","90","","90","","120","","5263.51","","","","","","","","","","","","","17","R 3 :H","R 3","146","","","Raslakite","- Al0.2 Ca3.708 Ce0.3 Cl Fe2.199 H3.537 Hf0.099 K0.201 Mg0.15 Mn0.9 Na15.591 Nb0.2 O76.6 Si25.3 Sr0.201 Ti0.15 Zr3.801 -","- Al0.2 Ca3.708 Ce0.3 Cl Fe2.199 H2.87 Hf0.099 K0.201 Mg0.15 Mn0.9 Na15.591 Nb0.2 O76.6 Si25.3 Sr0.201 Ti0.15 Zr3.801 -","- Al0.6 Ca11.124 Ce0.9 Cl3 Fe6.597 H8.61 Hf0.297 K0.603 Mg0.45 Mn2.7 Na46.773 Nb0.6 O229.8 Si75.9 Sr0.603 Ti0.45 Zr11.403 -","3","0.333333","","Ekimenkova, I. A.; Rastsvetaeva, R. K.; Chukanov, N. V.","Ordering of calcium and iron in a mineral of the eudialyte group with the symmetry R3 Locality: Lovozero massif, Kola Peninsula, Russia","Doklady Chemistry","2000","374","","195","198","","","","","","","","","","","","","","","","","","","","","","has coordinates","283907","2023-05-21","07:14:44",""
"9012795","8.176","","8.176","","5.108","","90","","90","","120","","295.708","","","","","","","","","","","","","4","P 3 2 1","P 3 2""","150","","","","- Ga5 La3 O14 Si -","- Ga5 La3 O14 Si -","- Ga5 La3 O14 Si -","1","0.166667","","Belokoneva, E. L.; Stefanovich, S. Y.; Pisarevskii, Y. V.; Mosunov, A. V.","Refined structures of La3Ga5SiO14 and Pb3Ga2Ge4O14 and the crystal-chemical regularities in the structure and properties of compounds of the langasite family","Russian Journal of Inorganic Chemistry","2000","45","","1642","1651","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:48",""
"9012796","8.417","","8.417","","5.014","","90","","90","","120","","307.631","","","","","","","","","","","","","4","P 3 2 1","P 3 2""","150","","","","- Ga1.999 Ge4.001 O14 Pb3 -","- Ga1.999 Ge4.001 O14 Pb3 -","- Ga1.999 Ge4.001 O14 Pb3 -","1","0.166667","","Belokoneva, E. L.; Stefanovich, S. Y.; Pisarevskii, Y. V.; Mosunov, A. V.","Refined structures of La3Ga5SiO14 and Pb3Ga2Ge4O14 and the crystal-chemical regularities in the structure and properties of compounds of the langasite family","Russian Journal of Inorganic Chemistry","2000","45","","1642","1651","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:48",""
"9013426","8.378","","4.6018","","9.0568","","90","","124.949","","90","","286.205","","","","","","","","3500000","","","","Synthetic","2","P 1 21/c 1","-P 2ybc","14","","","Cristobalite","- O2 Si -","- O2 Si -","- O16 Si8 -","8","2","","Dove, M. T.; Craig, M. S.; Keen, D. A.; Marshall, W. G.; Redfern, S. A. T.; Trachenko, K. O.; Tucker, M. G.","Crystal structure of the high-pressure monoclinic phase-II of cristobalite, SiO2 Locality: synthetic Note: P = 3.5 GPa, refinement by unconstrained Rietveld analysis","Mineralogical Magazine","2000","64","","569","576","10.1180/002646100549436","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:49",""
"9013427","8.3769","","4.602","","9.0583","","90","","124.939","","90","","286.263","","","","","","","","3500000","","","","Synthetic","2","P 1 21/c 1","-P 2ybc","14","","","Cristobalite","- O2 Si -","- O2 Si -","- O16 Si8 -","8","2","","Dove, M. T.; Craig, M. S.; Keen, D. A.; Marshall, W. G.; Redfern, S. A. T.; Trachenko, K. O.; Tucker, M. G.","Crystal structure of the high-pressure monoclinic phase-II of cristobalite, SiO2 Locality: synthetic Note: P = 3.5 GPa, refinement by constrained Rietveld analysis","Mineralogical Magazine","2000","64","","569","576","10.1180/002646100549436","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:49",""
"9014104","16.017","","16.017","","7.256","","90","","90","","120","","1612.09","","","","","","","","","","","","Madagascar","12","R 3 m :H","R 3 -2""","160","","","Dravite","- Al4.56 B3 Ca0.48 F0.18 Fe2.01 H6.18 K0.01 Mg2.19 Na0.49 O30.82 Si6 Ti0.21 -","- Al4.56 B3 Ca0.48 F0.18 Fe2.01 H6.18 K0.01 Mg2.19 Na0.49 O30.82 Si6 Ti0.21 -","- Al13.68 B9 Ca1.44 F0.54 Fe6.03 H18.54 K0.03 Mg6.57 Na1.47 O92.46 Si18 Ti0.63 -","3","0.166667","","Camara, F.; Ottolini, L.; Hawthorne, F. C.","Crystal chemistry of three tourmalines by SREF, EMPA and SIMS Sample: Crystal 1","American Mineralogist","2000","87","","1437","1442","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:51",""
"9014105","7.48","","12.159","","6.678","","86.1","","93.92","","112.08","","560.91","","","","","","","","","","","","Arvigo, Val Calanca, Grisons, Switzerland","8","P -1","-P 1","2","","","Babingtonite","- Al0.03 Ca2 Fe1.366 H Mg0.344 Mn0.26 O15 Si5 -","- Al0.03 Ca2 Fe1.366 H Mg0.344 Mn0.26 O15 Si5 -","- Al0.06 Ca4 Fe2.732 H2 Mg0.688 Mn0.52 O30 Si10 -","2","1","","Armbruster, T.","Cation distribution in Mg, Mn-bearing babingtonite from Arvigo, Val Calanca, Grisons, Switzerland Note: Sample NMBE 34974","Schweizerische Mineralogische und Petrographische Mitteilungen","2000","80","","279","284","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:48",""
"9014177","5.457","","9.131","","9.769","","108.47","","91.72","","97.44","","456.5","","","","","","","","","","","","Saint-Aubin-des-Chateaux, Loire-Atlantique, France","9","P -1","-P 1","2","","","Lulzacite","- Al4 Ba0.08 Fe2.26 H4 Mg0.74 O26 P3.92 Sr1.92 V0.08 -","- Al4 Ba0.08 Fe2.26 H4 Mg0.74 O26 P3.92 Sr1.92 V0.08 -","- Al4 Ba0.08 Fe2.26 H4 Mg0.74 O26 P3.92 Sr1.92 V0.08 -","1","0.5","","Leone, P.; Palvadeau, P.; Moelo, Y.","Structure cristalline d'un nouvel hydroxyphosphate naturel de strontium, fer et aluminium (lulzacite), Sr2Fe(Fe0,63Mg0,37)2Al4(PO4)4(OH)10","Chimie de l'etat Solide et Cristallochimie","2000","3","","301","308","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:17",""
"9014453","11.821","","11.821","","11.821","","90","","90","","90","","1651.82","","","","","","","","","","","","Synthetic","3","P m -3 n","-P 4n 2 3","223","","","Methane hydrate","- C4 H46 O23 -","- C4 H46 O23 -","- C8 H92 O46 -","2","0.0416667","","Gutt, C.; Asmussen, B.; Press, W.; Johnson, M. R.; Handa, Y. P.; Tse, J. S.","The structure of deuterated methane-hydrate Note: T = 2 K","Journal of Chemical Physics","2000","113","","4713","4721","10.1063/1.1288789","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:10",""
"9015099","9.5007","","9.5007","","6.8406","","90","","90","","120","","534.732","","","","","","","","","","","","Synthetic","4","P -3","-P 3","147","","","","- Ca10 O24 P6 Se -","- Ca10 O24 P6 Se -","- Ca10 O24 P6 Se -","1","0.166667","","Henning, P. A.; Adolfsson, E.; Grins, J.","The chalcogenide phosphate apatites Ca10(PO4)6S, Sr10(PO4)6S, Ba10(PO4)6S and Ca10(PO4)6Se","Zeitschrift fur Kristallographie","2000","215","","226","230","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:18",""
"9015499","14.018","","14.133","","7.84","","90","","109.4","","90","","1465.04","","","","","","","","","","","","granite pegmatites and alkaline granites in Mongolia","8","C 1 2 1","C 2y","5","","","Armstrongite","- Ca0.91 H6 Na0.09 O18 Si6 Ti0.01 Y0.03 Zr0.96 -","- Ca0.91 H6 Na0.09 O18 Si6 Ti0.01 Y0.03 Zr0.96 -","- Ca3.64 H24 Na0.36 O72 Si24 Ti0.04 Y0.12 Zr3.84 -","4","1","","Kabalov, Y. K.; Zubkova, N. V.; Pushcharovsky, D. Y.; Schneider, J.; Sapozhnikov, A. N.","Powder Rietveld refinement of armstrongite, CaZr[Si6O15]*3H2O","Zeitschrift fur Kristallographie","2000","215","","757","761","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:10",""
"9015661","9.8077","","9.8077","","7.2089","","90","","90","","120","","600.529","","","","","","","","","","","","Synthetic","4","P -3","-P 3","147","","","","- O24 P6 S Sr10 -","- O24 P6 S Sr10 -","- O24 P6 S Sr10 -","1","0.166667","","Henning, P. A.; Adolfsson, E.; Grins, J.","The chalcogenide phosphate apatites Ca10(PO4)6S, Sr10(PO4)6S, Ba10(PO4)6S and Ca10(PO4)6Se","Zeitschrift fur Kristallographie","2000","215","","226","230","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:19",""
"9015732","7.458","","12.168","","6.675","","86.12","","93.86","","112.27","","558.71","","","","","","","","","","","","Westfield, Massachusetts, USA","8","P -1","-P 1","2","","","Babingtonite","- Al0.05 Ca2 Fe1.703 H Mg0.187 Mn0.06 O15 Si5 -","- Al0.05 Ca2 Fe1.703 H Mg0.187 Mn0.06 O15 Si5 -","- Al0.1 Ca4 Fe3.406 H2 Mg0.374 Mn0.12 O30 Si10 -","2","1","","Armbruster, T.","Cation distribution in Mg, Mn-bearing babingtonite from Arvigo, Val Calanca, Grisons, Switzerland","Schweizerische Mineralogische und Petrographische Mitteilungen","2000","80","","279","284","","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:53",""
"9015884","7.469","","12.161","","6.675","","86.09","","93.94","","112.21","","559.398","","","","","","","","","","","","Arvigo, Val Calanca, Grisons, Switzerland","8","P -1","-P 1","2","","","Babingtonite","- Al0.08 Ca2 Fe1.513 H Mg0.197 Mn0.21 O15 Si5 -","- Al0.08 Ca2 Fe1.513 H Mg0.197 Mn0.21 O15 Si5 -","- Al0.16 Ca4 Fe3.026 H2 Mg0.394 Mn0.42 O30 Si10 -","2","1","","Armbruster, T.","Cation distribution in Mg, Mn-bearing babingtonite from Arvigo, Val Calanca, Grisons, Switzerland Note: Sample Arvigo 1, NMBE 34973","Schweizerische Mineralogische und Petrographische Mitteilungen","2000","80","","279","284","","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:54",""
"9016148","12.0627","","17.1745","","18.2094","","90","","106.34","","90","","3620.08","","","","","","","","","","","","Synthetic","4","P 1 21/n 1","-P 2yn","14","","","Rakovanite","- H30 Na3 O43 V10 -","- H30 Na3 O43 V10 -","- H120 Na12 O172 V40 -","4","1","","Duraisamy, T.; Ramanan, A.; Vittal, J. J.","Novel self-assembled decavanadate clusters forming 1D molecular chains and 2D molecular arrays: [HMTA-H...H2O][HMTA-CH2OH][H3V10O28{Na(H2O)4}]*4H2O and [Na2(H2O)10] [H3V10O28 {Na(H2O)2}]*3H2O","Crystal Engineering","2000","3","","237","250","10.1016/S1463-0184(00)00043-5","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:54",""
"9016259","4.2043","","9.199","","16.663","","90","","91.82","","90","","644.122","","","","","","","","","","","","a Late-Hellenistic shipwreck found near Mahdia, Tunisia","5","P 1 21/m 1","-P 2yb","11","","","Barstowite","- C H2 Cl6 O4 Pb4 -","- C H2 Cl6 O4 Pb4 -","- C2 H4 Cl12 O8 Pb8 -","2","0.5","","Kutzke, H.; Klapper, H.; Merlino, S.; Pasero, M.; Perchiazzi, N.; Eggert, G.","The crystal structure of barstowite, Pb4Cl6(CO3)*H2O, determined on crystals from Etruscan slags and from a Late-Hellenistic shipwreck","Zeitschrift fur Kristallographie","2000","215","","110","113","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:52",""
"9016283","9.4619","","9.4619","","6.8342","","90","","90","","120","","529.877","","","","","","","","","","","","Synthetic","4","P -3","-P 3","147","","","","- Ca5 O12 P3 S0.5 -","- Ca5 O12 P3 S0.5 -","- Ca10 O24 P6 S -","2","0.333333","","Henning, P. A.; Adolfsson, E.; Grins, J.","The chalcogenide phosphate apatites Ca10(PO4)6S, Sr10(PO4)6S, Ba10(PO4)6S and Ca10(PO4)6Se","Zeitschrift fur Kristallographie","2000","215","","226","230","","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:54",""
"9016465","10.252","","10.252","","7.659","","90","","90","","120","","697.14","","","","","","","","","","","","Synthetic","4","P -3","-P 3","147","","","","- Ba10 O24 P6 S -","- Ba10 O24 P6 S -","- Ba10 O24 P6 S -","1","0.166667","","Henning, P. A.; Adolfsson, E.; Grins, J.","The chalcogenide phosphate apatites Ca10(PO4)6S, Sr10(PO4)6S, Ba10(PO4)6S and Ca10(PO4)6Se","Zeitschrift fur Kristallographie","2000","215","","226","230","","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:54",""
"9017386","9.963","","10.4348","","4.7044","","90","","90","","90","","489.078","","","","","","","","","","","","Khibiny massif, Kola Peninsula, Russia","4","P 21 21 21","P 2ac 2ab","19","","","Lisitsynite","- B K O6 Si2 -","- B K O6 Si2 -","- B4 K4 O24 Si8 -","4","1","","Sokolova, E. V.; Uvarova Yu, A.; Hawthorne, F. C.; Khomyakov, A. P.","First edition. A A Balkema, Rotterdam, Netherlands Crystal chemistry of a novel zeolite mineral from the Kbibiny Alkaline Massif, Kolal Peninsula","Applied Mineralogy in Research, Economy, Technology, and Culture","2000","1","","254","248","","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:56",""
"9017808","11.96269","","11.96269","","11.96269","","90","","90","","90","","1711.93","","","","","","","","","","","","Synthetic","4","I -4 3 d","I -4bd 2c 3","220","","","Fluormayenite","- Al7 Ca6 F0.87 O16 -","- Al7 Ca6 F0.87 O16 -","- Al28 Ca24 F3.48 O64 -","4","0.0833333","","Costa, U.; Ballirano, P.","Improved powder X-ray data for the cement phase Ca12Al14O32F2 (C11A7f)","Powder Diffraction","2000","15","","56","61","","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:56",""